data_1sxm_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1sxm _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 104.164 -2.532 . . . . 0.0 104.164 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -108.18 -174.42 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.175 1.39 . . . . 0.0 109.287 177.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -130.98 80.39 1.94 Allowed 'General case' 0 C--N 1.362 1.139 0 C-N-CA 124.984 1.314 . . . . 0.0 107.634 -176.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 t -131.16 129.75 63.09 Favored 'Isoleucine or valine' 0 C--N 1.361 1.093 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 172.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -79.88 135.72 36.5 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.017 1.727 . . . . 0.0 110.56 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.66 171.95 13.48 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -169.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.39 22.88 0.54 Allowed 'General case' 0 C--N 1.355 0.821 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.3 p -171.96 149.72 2.34 Favored Pre-proline 0 C--N 1.36 1.059 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -71.66 -16.88 30.04 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.197 3.264 . . . . 0.0 114.549 168.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -79.09 -10.75 59.91 Favored 'General case' 0 C--N 1.369 1.45 0 C-N-CA 127.516 2.326 . . . . 0.0 114.799 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -89.94 -11.53 41.46 Favored 'General case' 0 C--N 1.37 1.5 0 C-N-CA 127.735 2.414 . . . . 0.0 110.275 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.5 t -109.72 -13.63 14.46 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.289 2.236 . . . . 0.0 108.76 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.5 m -83.69 -1.39 53.94 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.182 1.793 . . . . 0.0 111.445 174.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -80.35 -59.06 0.54 Allowed Pre-proline 0 N--CA 1.44 -0.938 0 C-N-CA 129.545 3.138 . . . . 0.0 111.471 172.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -70.61 -40.35 4.08 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 125.097 3.865 . . . . 0.0 113.703 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.5 m -69.52 -31.45 69.69 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 127.6 2.36 . . . . 0.0 114.696 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -88.14 -7.17 57.31 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 124.837 1.255 . . . . 0.0 113.296 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.1 -19.21 28.87 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.746 1.618 . . . . 0.0 111.468 165.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 mt -93.9 -67.39 0.86 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 127.608 2.363 . . . . 0.0 111.14 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -94.72 -9.54 34.42 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.09 2.556 . . . . 0.0 112.4 -167.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -78.06 0.29 Allowed Glycine 0 C--N 1.365 2.153 0 C-N-CA 124.97 1.271 . . . . 0.0 113.161 166.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.423 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -152.99 -8.52 0.17 Allowed 'General case' 0 C--N 1.355 0.836 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.423 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -105.42 71.12 0.91 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 126.992 2.117 . . . . 0.0 105.748 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.38 123.24 31.21 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 125.684 1.594 . . . . 0.0 106.776 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.19 85.19 0.73 Allowed Glycine 0 C--N 1.364 2.098 0 N-CA-C 107.488 -2.245 . . . . 0.0 107.488 171.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.46 114.39 26.4 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.602 1.561 . . . . 0.0 109.949 -169.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.3 mttp -122.95 142.02 51.28 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -171.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.8 t -122.49 112.52 18.14 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.7 mmm -121.7 123.53 42.1 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.747 -2.316 . . . . 0.0 104.747 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.72 -84.61 0.02 OUTLIER 'General case' 0 C--N 1.381 1.964 0 C-N-CA 127.623 2.369 . . . . 0.0 111.099 176.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.83 54.47 0.19 Allowed Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 105.58 -3.008 . . . . 0.0 105.58 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mttm -154.04 152.19 30.21 Favored 'General case' 0 C--N 1.362 1.149 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.4 t -105.78 144.07 33.04 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 127.518 2.327 . . . . 0.0 109.465 -164.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -124.33 139.53 53.82 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.35 1.86 . . . . 0.0 106.671 174.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 67.7 m -125.2 111.45 15.28 Favored 'General case' 0 CA--C 1.5 -0.967 0 C-N-CA 124.09 0.956 . . . . 0.0 108.498 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 . . . . . 0 N--CA 1.439 -0.99 0 C-N-CA 127.001 2.12 . . . . 0.0 106.647 178.713 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 39.7 mt . . . . . 0 N--CA 1.445 -0.705 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.0 pt -112.88 -171.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 125.578 1.551 . . . . 0.0 108.208 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -131.9 80.29 1.91 Allowed 'General case' 0 C--N 1.363 1.156 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.3 t -130.62 129.52 64.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.082 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 171.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.64 134.26 35.16 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 125.734 1.614 . . . . 0.0 110.448 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.5 p -142.51 170.44 15.7 Favored 'General case' 0 C--N 1.36 1.029 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -167.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.03 22.37 0.76 Allowed 'General case' 0 C--N 1.355 0.843 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -170.42 150.16 3.31 Favored Pre-proline 0 C--N 1.362 1.121 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -71.46 -15.79 30.92 Favored 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 124.196 3.264 . . . . 0.0 114.891 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -82.66 -2.35 53.74 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.947 2.099 . . . . 0.0 114.315 171.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -101.87 7.53 41.56 Favored 'General case' 0 C--N 1.372 1.568 0 C-N-CA 127.195 2.198 . . . . 0.0 109.233 170.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.2 t -128.25 -14.3 4.86 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 127.229 2.212 . . . . 0.0 108.253 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.9 m -84.24 -1.15 54.72 Favored 'General case' 0 C--N 1.372 1.571 0 C-N-CA 126.064 1.746 . . . . 0.0 111.756 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -79.47 -58.67 0.64 Allowed Pre-proline 0 C--N 1.358 0.965 0 C-N-CA 128.926 2.89 . . . . 0.0 111.74 170.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.89 -39.66 4.16 Favored 'Trans proline' 0 C--N 1.364 1.366 0 C-N-CA 124.966 3.778 . . . . 0.0 113.522 175.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.6 m -69.42 -31.79 70.35 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.824 2.45 . . . . 0.0 114.679 -178.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -88.06 -6.38 57.97 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.853 1.261 . . . . 0.0 113.184 172.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -88.23 -19.65 26.57 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.814 1.646 . . . . 0.0 111.232 165.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.0 mt -93.38 -67.11 0.88 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 127.636 2.374 . . . . 0.0 111.059 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -94.89 -11.36 28.87 Favored 'General case' 0 C--N 1.362 1.14 0 C-N-CA 128.115 2.566 . . . . 0.0 112.277 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.86 -79.72 0.31 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 124.753 1.168 . . . . 0.0 113.284 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -146.42 -15.1 0.44 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 125.495 1.518 . . . . 0.0 107.097 -175.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.7 t -103.43 72.8 1.16 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 126.94 2.096 . . . . 0.0 106.14 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.0 122.58 30.37 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 125.792 1.637 . . . . 0.0 106.777 -174.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.9 85.25 0.75 Allowed Glycine 0 C--N 1.365 2.156 0 N-CA-C 107.647 -2.181 . . . . 0.0 107.647 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.09 115.07 27.34 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 125.567 1.547 . . . . 0.0 109.896 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -123.37 142.92 50.47 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -171.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.8 t -123.31 114.52 20.31 Favored 'General case' 0 C--N 1.351 0.645 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.45 123.0 39.67 Favored 'General case' 0 C--N 1.358 0.95 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 177.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 77.33 -84.6 0.02 OUTLIER 'General case' 0 C--N 1.381 1.949 0 C-N-CA 127.481 2.312 . . . . 0.0 111.27 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.59 54.52 0.19 Allowed Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 168.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -152.85 152.23 31.31 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.8 t -104.99 145.04 30.98 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 127.514 2.326 . . . . 0.0 109.038 -164.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.415 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 55.6 mtmt -125.97 138.07 53.73 Favored 'General case' 0 CA--C 1.5 -0.968 0 C-N-CA 126.074 1.749 . . . . 0.0 106.624 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.0 m -124.36 112.69 17.26 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 124.482 1.113 . . . . 0.0 108.573 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.415 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 70.8 m-85 . . . . . 0 N--CA 1.438 -1.045 0 C-N-CA 126.985 2.114 . . . . 0.0 106.396 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 104.066 -2.568 . . . . 0.0 104.066 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 pt -100.8 177.94 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.288 0 C-N-CA 125.188 1.395 . . . . 0.0 110.953 -176.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -113.38 71.4 0.74 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 126.273 1.829 . . . . 0.0 108.34 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t -133.56 143.92 37.48 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.179 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -103.25 139.97 38.01 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 126.827 2.051 . . . . 0.0 107.068 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.4 p -143.28 177.82 8.16 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 -170.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -155.02 22.99 0.44 Allowed 'General case' 0 C--N 1.355 0.815 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 174.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.2 p -174.79 148.01 1.14 Allowed Pre-proline 0 C--N 1.361 1.078 0 N-CA-C 105.235 -2.135 . . . . 0.0 105.235 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -71.81 -13.19 29.32 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.444 3.429 . . . . 0.0 114.157 167.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -73.97 -21.41 60.02 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 128.495 2.718 . . . . 0.0 114.833 170.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -87.4 -15.08 38.82 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.095 2.558 . . . . 0.0 110.743 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.45 -14.22 15.79 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 126.732 2.013 . . . . 0.0 109.955 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 p -87.97 3.33 49.09 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 120.498 -1.376 . . . . 0.0 111.371 174.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -79.16 -59.62 0.6 Allowed Pre-proline 0 C--N 1.361 1.099 0 C-N-CA 129.364 3.066 . . . . 0.0 111.221 169.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.75 -39.42 4.62 Favored 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 125.08 3.853 . . . . 0.0 113.653 174.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.99 -30.65 66.97 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.87 2.468 . . . . 0.0 114.653 -177.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -88.1 -7.37 57.05 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.766 1.226 . . . . 0.0 113.281 171.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.66 -18.98 29.95 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.702 1.601 . . . . 0.0 111.468 165.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.2 mt -94.04 -66.8 0.89 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 127.615 2.366 . . . . 0.0 111.153 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -95.25 -9.44 33.17 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 128.001 2.521 . . . . 0.0 112.329 -167.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.39 -79.79 0.32 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 124.868 1.223 . . . . 0.0 113.234 166.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.42 -14.2 0.39 Allowed 'General case' 0 C--N 1.354 0.78 0 C-N-CA 125.543 1.537 . . . . 0.0 106.949 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 t -103.51 72.46 1.14 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.022 2.129 . . . . 0.0 106.369 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.67 124.8 34.51 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 -175.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.71 84.47 0.67 Allowed Glycine 0 C--N 1.364 2.108 0 N-CA-C 107.493 -2.243 . . . . 0.0 107.493 172.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.35 116.15 28.7 Favored 'General case' 0 C--N 1.36 1.032 0 C-N-CA 125.563 1.545 . . . . 0.0 109.923 -170.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -122.99 139.73 53.76 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -171.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -121.01 111.94 18.11 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.89 -1.892 . . . . 0.0 105.89 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -119.91 123.17 42.91 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 77.58 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.382 2.004 0 C-N-CA 127.646 2.378 . . . . 0.0 111.027 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.54 55.95 0.19 Allowed Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 105.219 -3.152 . . . . 0.0 105.219 168.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -153.08 148.31 26.85 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.2 t -106.45 143.36 34.68 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 127.373 2.269 . . . . 0.0 109.529 -165.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.47 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 56.1 mtmt -125.99 142.28 51.59 Favored 'General case' 0 C--N 1.357 0.926 0 C-N-CA 126.575 1.95 . . . . 0.0 107.083 175.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.09 120.56 32.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.687 1.195 . . . . 0.0 108.399 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.47 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 67.9 m-85 . . . . . 0 N--CA 1.436 -1.126 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 178.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.6 mt . . . . . 0 N--CA 1.444 -0.769 0 N-CA-C 103.525 -2.769 . . . . 0.0 103.525 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.9 pt -103.63 -176.38 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.279 0 C-N-CA 125.357 1.463 . . . . 0.0 109.128 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.1 m-80 -129.38 79.23 1.9 Allowed 'General case' 0 C--N 1.361 1.102 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -176.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.6 t -129.55 127.83 65.18 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.621 -2.733 . . . . 0.0 103.621 171.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -82.37 133.82 35.23 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 126.183 1.793 . . . . 0.0 109.967 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.2 p -142.65 172.51 12.6 Favored 'General case' 0 C--N 1.357 0.904 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -167.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.0 26.91 0.48 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 170.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -170.4 148.29 2.83 Favored Pre-proline 0 C--N 1.36 1.039 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 -176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -71.34 -16.08 31.25 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 124.199 3.266 . . . . 0.0 114.672 169.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -80.75 -7.28 59.33 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 127.217 2.207 . . . . 0.0 114.636 171.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -94.55 -3.25 50.13 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.195 2.198 . . . . 0.0 109.945 170.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.3 t -116.69 -13.92 10.8 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.28 2.232 . . . . 0.0 108.238 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -83.97 -1.18 54.15 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 126.196 1.799 . . . . 0.0 111.394 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.11 -59.35 0.54 Allowed Pre-proline 0 C--N 1.357 0.931 0 C-N-CA 129.556 3.142 . . . . 0.0 111.322 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -70.68 -40.87 3.5 Favored 'Trans proline' 0 C--N 1.365 1.397 0 C-N-CA 125.079 3.853 . . . . 0.0 113.48 174.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.4 m -69.93 -31.33 69.03 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 127.736 2.415 . . . . 0.0 114.824 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -88.07 -7.37 57.09 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 124.624 1.169 . . . . 0.0 113.338 172.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -87.14 -20.66 26.72 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.649 1.58 . . . . 0.0 111.447 165.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.1 mt -92.74 -66.7 0.91 Allowed 'General case' 0 C--N 1.366 1.303 0 C-N-CA 127.553 2.341 . . . . 0.0 111.086 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -96.59 -7.86 33.28 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 128.107 2.563 . . . . 0.0 112.253 -167.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.81 -80.03 0.5 Allowed Glycine 0 C--N 1.365 2.167 0 C-N-CA 124.936 1.255 . . . . 0.0 113.621 165.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.1 m -147.63 -11.38 0.4 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.74 1.616 . . . . 0.0 107.093 -175.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 t -105.13 69.17 0.84 Allowed 'General case' 0 C--N 1.366 1.298 0 C-N-CA 126.907 2.083 . . . . 0.0 106.142 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.78 126.14 42.91 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 125.741 1.616 . . . . 0.0 106.855 -175.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.56 85.8 0.57 Allowed Glycine 0 C--N 1.363 2.054 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 170.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.08 112.88 24.53 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 125.327 1.451 . . . . 0.0 109.812 -169.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -121.91 141.78 50.94 Favored 'General case' 0 C--N 1.361 1.088 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -127.96 110.62 12.71 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -118.93 128.11 54.11 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 78.75 -85.54 0.02 OUTLIER 'General case' 0 C--N 1.383 2.023 0 C-N-CA 127.537 2.335 . . . . 0.0 111.023 173.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 55.6 0.18 Allowed Glycine 0 N--CA 1.432 -1.582 0 N-CA-C 106.083 -2.807 . . . . 0.0 106.083 169.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -153.45 151.99 30.5 Favored 'General case' 0 C--N 1.362 1.148 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -106.35 144.98 32.26 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.558 2.343 . . . . 0.0 109.239 -165.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.3 mtmm -127.11 139.02 53.28 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 126.059 1.744 . . . . 0.0 106.835 173.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.7 m -120.66 119.42 32.79 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 124.523 1.129 . . . . 0.0 108.16 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 . . . . . 0 N--CA 1.438 -1.061 0 C-N-CA 126.37 1.868 . . . . 0.0 106.008 179.467 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.6 mt . . . . . 0 N--CA 1.443 -0.805 0 N-CA-C 104.311 -2.477 . . . . 0.0 104.311 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -113.56 -169.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.303 0 C-N-CA 125.631 1.572 . . . . 0.0 107.961 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.97 80.73 1.86 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 124.406 1.083 . . . . 0.0 108.431 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.35 126.97 66.7 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 103.665 -2.717 . . . . 0.0 103.665 172.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -78.56 134.19 37.26 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 126.395 1.878 . . . . 0.0 110.919 -175.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.2 p -145.95 168.82 19.93 Favored 'General case' 0 C--N 1.357 0.929 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -166.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.92 26.37 0.64 Allowed 'General case' 0 C--N 1.357 0.9 0 N-CA-C 105.445 -2.058 . . . . 0.0 105.445 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.7 p -168.85 149.77 4.31 Favored Pre-proline 0 C--N 1.361 1.074 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 -177.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -71.86 -13.46 29.27 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.257 3.304 . . . . 0.0 114.727 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -86.63 6.91 28.71 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 126.855 2.062 . . . . 0.0 113.582 170.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -113.09 22.23 14.56 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 127.38 2.272 . . . . 0.0 107.24 170.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.8 t -144.93 -19.01 0.5 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.4 m -82.58 -1.26 50.21 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 126.347 1.859 . . . . 0.0 111.798 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -82.6 -56.81 0.49 Allowed Pre-proline 0 C--N 1.357 0.919 0 C-N-CA 129.357 3.063 . . . . 0.0 111.424 172.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.34 -40.47 5.94 Favored 'Trans proline' 0 C--N 1.365 1.441 0 C-N-CA 124.939 3.759 . . . . 0.0 113.881 172.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.41 -31.8 70.39 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.698 2.399 . . . . 0.0 114.74 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -88.06 -6.73 57.78 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 124.992 1.317 . . . . 0.0 113.252 172.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -87.44 -19.51 27.92 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.749 1.619 . . . . 0.0 111.392 165.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -93.77 -67.38 0.86 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 127.598 2.359 . . . . 0.0 111.089 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -94.75 -10.61 31.07 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 128.089 2.555 . . . . 0.0 112.269 -167.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.22 -79.97 0.31 Allowed Glycine 0 C--N 1.365 2.142 0 C-N-CA 124.882 1.23 . . . . 0.0 113.106 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' SER . 74.7 m -146.37 -15.39 0.44 Allowed 'General case' 0 C--N 1.355 0.824 0 C-N-CA 125.569 1.548 . . . . 0.0 107.092 -175.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.1 t -102.85 74.74 1.35 Allowed 'General case' 0 C--N 1.364 1.228 0 C-N-CA 127.005 2.122 . . . . 0.0 106.134 177.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.87 122.95 26.52 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 -174.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.59 86.51 0.76 Allowed Glycine 0 C--N 1.363 2.071 0 N-CA-C 107.565 -2.214 . . . . 0.0 107.565 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.72 116.0 28.21 Favored 'General case' 0 C--N 1.359 1.013 0 C-N-CA 125.504 1.521 . . . . 0.0 109.957 -169.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -123.93 143.41 50.4 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -171.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.3 t -122.83 114.87 21.09 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -125.62 124.15 40.55 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 104.429 -2.434 . . . . 0.0 104.429 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.43 -84.13 0.02 OUTLIER 'General case' 0 C--N 1.383 2.03 0 C-N-CA 127.579 2.352 . . . . 0.0 110.88 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.08 53.14 0.19 Allowed Glycine 0 N--CA 1.433 -1.538 0 N-CA-C 106.059 -2.816 . . . . 0.0 106.059 168.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -152.75 153.92 34.17 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 105.982 -1.858 . . . . 0.0 105.982 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.1 t -105.08 145.33 30.65 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 127.384 2.274 . . . . 0.0 108.73 -164.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.406 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 55.1 mtmt -126.37 138.67 53.58 Favored 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 126.225 1.81 . . . . 0.0 106.447 175.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.5 m -125.33 112.51 16.43 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 124.473 1.109 . . . . 0.0 108.51 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.406 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 70.2 m-85 . . . . . 0 N--CA 1.438 -1.035 0 C-N-CA 126.931 2.092 . . . . 0.0 106.546 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.0 mt . . . . . 0 N--CA 1.444 -0.768 0 N-CA-C 102.955 -2.98 . . . . 0.0 102.955 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.0 pt -102.0 -177.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.32 0 C-N-CA 125.435 1.494 . . . . 0.0 109.831 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -126.87 76.8 1.67 Allowed 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.815 1.246 . . . . 0.0 108.196 -173.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.2 t -132.11 130.59 60.99 Favored 'Isoleucine or valine' 0 C--N 1.36 1.058 0 N-CA-C 103.957 -2.608 . . . . 0.0 103.957 173.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -80.56 137.11 36.37 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.202 1.801 . . . . 0.0 110.605 -178.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.82 172.51 12.92 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.83 27.85 0.43 Allowed 'General case' 0 C--N 1.355 0.82 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.4 p -171.23 149.14 2.55 Favored Pre-proline 0 C--N 1.36 1.037 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -71.35 -16.78 31.11 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 124.278 3.319 . . . . 0.0 114.775 169.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.62 -6.84 59.38 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.139 2.176 . . . . 0.0 114.647 172.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -94.49 -4.11 48.72 Favored 'General case' 0 C--N 1.37 1.48 0 C-N-CA 127.173 2.189 . . . . 0.0 110.1 170.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.6 t -116.19 -13.45 11.13 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 127.402 2.281 . . . . 0.0 108.048 -178.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.4 m -84.04 0.09 49.6 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 126.367 1.867 . . . . 0.0 111.304 173.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.27 -59.37 0.53 Allowed Pre-proline 0 C--N 1.358 0.94 0 C-N-CA 129.365 3.066 . . . . 0.0 111.14 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.22 -40.49 3.16 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 124.902 3.735 . . . . 0.0 113.509 174.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.79 -31.13 68.88 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 127.535 2.334 . . . . 0.0 114.747 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.09 -7.87 56.32 Favored 'General case' 0 C--N 1.371 1.516 0 C-N-CA 124.59 1.156 . . . . 0.0 113.289 172.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -86.92 -21.16 26.45 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 125.798 1.639 . . . . 0.0 111.528 165.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.7 mt -92.16 -66.46 0.92 Allowed 'General case' 0 C--N 1.366 1.301 0 C-N-CA 127.601 2.36 . . . . 0.0 111.04 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -95.72 -12.14 25.93 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 128.022 2.529 . . . . 0.0 112.106 -167.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.74 -74.59 0.4 Allowed Glycine 0 C--N 1.364 2.133 0 C-N-CA 124.915 1.245 . . . . 0.0 113.836 164.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -141.72 -36.59 0.43 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.584 1.553 . . . . 0.0 107.218 -170.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.6 t -90.5 75.07 6.78 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.86 2.464 . . . . 0.0 108.346 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.32 124.8 35.24 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -176.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.52 87.06 0.63 Allowed Glycine 0 C--N 1.362 1.992 0 N-CA-C 107.545 -2.222 . . . . 0.0 107.545 172.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.26 115.21 27.12 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.286 1.434 . . . . 0.0 109.721 -171.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -123.33 142.27 51.13 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.9 t -123.56 113.87 19.29 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 105.885 -1.894 . . . . 0.0 105.885 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 79.0 mtp -120.38 123.4 42.98 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 175.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 78.58 -84.78 0.02 OUTLIER 'General case' 0 C--N 1.383 2.039 0 C-N-CA 127.512 2.325 . . . . 0.0 110.936 174.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.8 55.28 0.2 Allowed Glycine 0 N--CA 1.434 -1.499 0 N-CA-C 105.806 -2.917 . . . . 0.0 105.806 168.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -154.04 152.5 30.57 Favored 'General case' 0 C--N 1.363 1.18 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.91 146.44 29.98 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 127.438 2.295 . . . . 0.0 109.568 -163.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 53.1 mtmt -126.13 141.82 51.78 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.294 1.838 . . . . 0.0 106.793 173.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -124.79 122.89 38.73 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.255 1.022 . . . . 0.0 108.261 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.427 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 64.6 m-85 . . . . . 0 N--CA 1.435 -1.178 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.9 mt . . . . . 0 N--CA 1.444 -0.767 0 N-CA-C 103.51 -2.774 . . . . 0.0 103.51 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.4 pt -104.16 -176.72 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.279 1.431 . . . . 0.0 109.299 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -127.73 77.19 1.73 Allowed 'General case' 0 C--N 1.362 1.115 0 C-N-CA 124.699 1.2 . . . . 0.0 107.8 -175.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.3 t -129.98 129.69 65.87 Favored 'Isoleucine or valine' 0 C--N 1.361 1.087 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 172.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -79.72 137.02 36.92 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 126.451 1.901 . . . . 0.0 110.447 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -145.86 173.43 12.14 Favored 'General case' 0 C--N 1.358 0.965 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.96 27.27 0.42 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 p -172.06 147.32 1.87 Allowed Pre-proline 0 C--N 1.359 1.017 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -71.07 -13.71 31.52 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.609 3.539 . . . . 0.0 114.28 167.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -72.18 -23.27 61.24 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 128.879 2.872 . . . . 0.0 114.438 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -89.42 -8.74 52.4 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 127.555 2.342 . . . . 0.0 110.931 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -110.45 -15.24 13.96 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 126.984 2.114 . . . . 0.0 109.417 -178.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.3 p -87.89 3.01 50.07 Favored 'General case' 0 C--N 1.369 1.422 0 O-C-N 120.179 -1.576 . . . . 0.0 111.156 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -79.87 -58.25 0.63 Allowed Pre-proline 0 C--N 1.359 1.002 0 C-N-CA 129.846 3.258 . . . . 0.0 111.347 170.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -70.15 -40.22 4.95 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 125.119 3.879 . . . . 0.0 113.756 173.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -69.78 -31.68 69.75 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.647 2.379 . . . . 0.0 114.796 -176.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -88.1 -8.0 56.11 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 124.952 1.301 . . . . 0.0 113.16 172.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -86.85 -20.16 27.89 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 125.81 1.644 . . . . 0.0 111.434 165.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.5 mt -92.02 -66.66 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.692 2.397 . . . . 0.0 111.097 177.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -96.9 -11.21 25.02 Favored 'General case' 0 C--N 1.362 1.129 0 C-N-CA 127.914 2.486 . . . . 0.0 112.288 -166.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -78.55 0.43 Allowed Glycine 0 C--N 1.363 2.08 0 C-N-CA 124.933 1.254 . . . . 0.0 113.097 166.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.47 -6.96 0.4 Allowed 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.764 1.625 . . . . 0.0 107.201 -175.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.7 t -107.39 64.46 0.63 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 126.77 2.028 . . . . 0.0 106.156 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -124.6 127.0 46.71 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 125.944 1.697 . . . . 0.0 107.227 -174.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.92 87.74 0.58 Allowed Glycine 0 C--N 1.362 1.983 0 N-CA-C 107.023 -2.431 . . . . 0.0 107.023 169.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.04 114.75 26.59 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 125.227 1.411 . . . . 0.0 109.868 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -124.42 140.53 52.86 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 -171.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.3 t -124.33 119.2 28.59 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.5 mtt -127.42 126.98 43.37 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.05 -84.24 0.02 OUTLIER 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.553 2.341 . . . . 0.0 110.82 173.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.3 55.94 0.17 Allowed Glycine 0 N--CA 1.432 -1.586 0 N-CA-C 106.088 -2.805 . . . . 0.0 106.088 167.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -154.0 151.54 29.49 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.5 t -106.81 146.69 30.6 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.543 2.337 . . . . 0.0 109.367 -163.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.464 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 31.0 mtmm -127.29 139.12 53.11 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 106.701 174.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.8 m -123.81 116.15 22.51 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 124.458 1.103 . . . . 0.0 108.043 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.464 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 63.3 m-85 . . . . . 0 N--CA 1.439 -1.016 0 C-N-CA 126.51 1.924 . . . . 0.0 106.883 -179.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 45.5 mt . . . . . 0 N--CA 1.443 -0.787 0 N-CA-C 103.728 -2.693 . . . . 0.0 103.728 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 33.6 pt -103.21 -173.11 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.39 1.476 . . . . 0.0 109.015 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -134.95 78.16 1.72 Allowed 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.244 1.018 . . . . 0.0 108.379 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.3 t -128.31 128.1 68.05 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.725 -2.694 . . . . 0.0 103.725 172.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -79.2 134.62 36.68 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.354 1.861 . . . . 0.0 110.472 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -144.39 169.47 17.86 Favored 'General case' 0 C--N 1.358 0.961 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -167.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -148.8 18.86 1.01 Allowed 'General case' 0 C--N 1.353 0.733 0 C-N-CA 125.874 1.67 . . . . 0.0 106.515 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.7 p -169.6 151.19 4.25 Favored Pre-proline 0 C--N 1.36 1.033 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 -175.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -71.26 -15.15 31.68 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 124.597 3.531 . . . . 0.0 114.326 166.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -73.63 -19.61 60.81 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.306 2.642 . . . . 0.0 114.744 170.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.0 tp60 -88.96 -13.76 38.2 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.415 2.686 . . . . 0.0 110.883 175.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.7 t -106.29 -13.79 15.29 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.11 2.164 . . . . 0.0 109.407 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.2 p -87.82 4.41 44.61 Favored 'General case' 0 C--N 1.368 1.398 0 O-C-N 120.303 -1.498 . . . . 0.0 111.251 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.04 -59.33 0.63 Allowed Pre-proline 0 C--N 1.361 1.107 0 C-N-CA 129.279 3.032 . . . . 0.0 111.139 169.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.72 -39.41 4.68 Favored 'Trans proline' 0 C--N 1.366 1.484 0 C-N-CA 125.089 3.859 . . . . 0.0 113.651 174.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.7 m -70.78 -30.32 66.77 Favored 'General case' 0 C--N 1.368 1.398 0 C-N-CA 127.57 2.348 . . . . 0.0 114.818 -176.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -88.08 -8.85 54.89 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 124.787 1.235 . . . . 0.0 112.682 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -86.43 -19.93 28.91 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 125.731 1.612 . . . . 0.0 111.696 166.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.1 mt -94.01 -67.9 0.83 Allowed 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.521 2.328 . . . . 0.0 110.873 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -93.99 -10.47 33.51 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 128.169 2.587 . . . . 0.0 112.2 -168.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.1 -79.71 0.42 Allowed Glycine 0 C--N 1.364 2.136 0 C-N-CA 124.897 1.237 . . . . 0.0 113.69 164.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.3 m -145.2 -15.39 0.51 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.681 1.592 . . . . 0.0 107.284 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.0 t -105.6 72.66 0.98 Allowed 'General case' 0 C--N 1.364 1.239 0 C-N-CA 126.835 2.054 . . . . 0.0 105.89 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.43 121.9 30.08 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 125.687 1.595 . . . . 0.0 106.864 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.97 84.27 0.64 Allowed Glycine 0 C--N 1.365 2.178 0 N-CA-C 107.672 -2.171 . . . . 0.0 107.672 171.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.04 117.08 29.66 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.532 1.533 . . . . 0.0 110.141 -170.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -124.64 140.33 53.04 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 -171.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.2 t -124.62 119.4 28.92 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 -178.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.402 ' HG2' ' HZ2' ' A' ' 35' ' ' LYS . 26.2 mmt -129.39 126.3 38.51 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 103.857 -2.646 . . . . 0.0 103.857 176.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.2 m120 78.6 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.008 0 C-N-CA 127.564 2.346 . . . . 0.0 110.968 174.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.34 55.64 0.18 Allowed Glycine 0 N--CA 1.432 -1.567 0 N-CA-C 106.069 -2.812 . . . . 0.0 106.069 168.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -154.01 153.16 31.46 Favored 'General case' 0 C--N 1.362 1.141 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -107.54 146.07 32.33 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 127.596 2.358 . . . . 0.0 109.092 -164.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.503 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 28.1 mtmm -127.65 139.47 52.7 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.391 1.876 . . . . 0.0 106.451 174.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -121.58 118.72 29.94 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 124.563 1.145 . . . . 0.0 108.149 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.503 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 64.5 m-85 . . . . . 0 N--CA 1.436 -1.146 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 85.4 mt . . . . . 0 CA--C 1.511 -0.558 0 N-CA-C 105.82 -1.918 . . . . 0.0 105.82 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.6 pt -102.47 179.22 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.082 0 C-N-CA 125.272 1.429 . . . . 0.0 111.113 -171.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -120.41 67.96 0.85 Allowed 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.741 1.616 . . . . 0.0 108.42 -172.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.2 t -125.91 129.64 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -87.68 133.73 33.78 Favored 'General case' 0 C--N 1.363 1.185 0 C-N-CA 125.98 1.712 . . . . 0.0 108.991 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -138.5 175.26 9.72 Favored 'General case' 0 C--N 1.358 0.947 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -168.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -154.54 23.12 0.47 Allowed 'General case' 0 C--N 1.356 0.855 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.3 p -173.68 149.39 1.58 Allowed Pre-proline 0 C--N 1.361 1.1 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -173.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -71.4 -16.34 31.01 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.189 3.259 . . . . 0.0 114.617 168.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -78.31 -13.75 59.71 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 127.624 2.37 . . . . 0.0 114.897 173.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -88.2 -11.26 47.23 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 127.962 2.505 . . . . 0.0 110.324 171.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -110.13 -12.34 14.5 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 127.322 2.249 . . . . 0.0 108.758 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.6 m -85.68 -1.65 57.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.535 1.934 . . . . 0.0 111.12 173.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -79.08 -59.27 0.63 Allowed Pre-proline 0 C--N 1.359 0.979 0 C-N-CA 129.203 3.001 . . . . 0.0 111.319 171.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.22 -41.9 2.3 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 125.004 3.803 . . . . 0.0 113.551 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.32 -29.05 65.66 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.656 2.383 . . . . 0.0 114.813 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -88.0 -8.39 55.7 Favored 'General case' 0 C--N 1.37 1.476 0 CA-C-N 120.069 1.304 . . . . 0.0 113.545 170.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -86.55 -20.74 27.53 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.694 1.598 . . . . 0.0 111.536 166.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.9 mt -93.96 -66.21 0.93 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.549 2.339 . . . . 0.0 111.141 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -95.4 -7.76 37.5 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.812 2.445 . . . . 0.0 112.212 -167.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.8 -78.77 0.37 Allowed Glycine 0 C--N 1.366 2.196 0 C-N-CA 125.124 1.345 . . . . 0.0 113.334 165.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.9 t -153.12 -7.92 0.17 Allowed 'General case' 0 C--N 1.354 0.787 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 t -104.93 69.7 0.88 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.103 2.161 . . . . 0.0 105.687 175.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.99 127.49 41.76 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 125.709 1.604 . . . . 0.0 106.691 -175.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.56 89.57 0.66 Allowed Glycine 0 C--N 1.36 1.91 0 N-CA-C 107.084 -2.406 . . . . 0.0 107.084 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.11 116.52 29.11 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 125.144 1.378 . . . . 0.0 109.736 -171.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -123.44 141.73 51.7 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 -173.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -123.03 110.29 15.16 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 -178.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 49.9 mtt -117.38 122.8 44.83 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 79.12 -85.34 0.02 OUTLIER 'General case' 0 C--N 1.383 2.022 0 C-N-CA 127.561 2.345 . . . . 0.0 110.204 175.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.28 56.49 0.18 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 105.218 -3.153 . . . . 0.0 105.218 169.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -152.37 149.88 29.09 Favored 'General case' 0 C--N 1.362 1.135 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.0 t -105.83 142.33 35.74 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.238 2.215 . . . . 0.0 109.086 -165.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -120.82 146.14 46.86 Favored 'General case' 0 CA--C 1.5 -0.96 0 C-N-CA 126.219 1.807 . . . . 0.0 107.168 172.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.88 142.84 48.31 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 . . . . . 0 N--CA 1.431 -1.381 0 N-CA-C 103.631 -2.729 . . . . 0.0 103.631 177.151 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 38.1 mt . . . . . 0 N--CA 1.446 -0.666 0 N-CA-C 104.377 -2.453 . . . . 0.0 104.377 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -107.65 -174.88 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.295 0 C-N-CA 125.143 1.377 . . . . 0.0 109.189 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 -131.63 80.05 1.91 Allowed 'General case' 0 C--N 1.361 1.101 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.8 t -129.16 126.46 64.2 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -85.75 138.19 32.27 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.902 1.681 . . . . 0.0 108.872 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 p -146.74 171.07 15.71 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -162.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.63 21.73 0.71 Allowed 'General case' 0 C--N 1.355 0.817 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 174.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.8 p -170.15 149.96 3.44 Favored Pre-proline 0 C--N 1.36 1.036 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -70.98 -17.37 32.09 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.443 3.429 . . . . 0.0 114.55 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -79.8 -10.86 59.83 Favored 'General case' 0 C--N 1.369 1.455 0 C-N-CA 127.353 2.261 . . . . 0.0 114.923 173.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -89.03 -10.64 46.77 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 127.685 2.394 . . . . 0.0 110.248 170.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.5 t -108.83 -14.6 14.55 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.193 2.197 . . . . 0.0 108.646 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.6 m -83.97 -0.68 52.52 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 126.208 1.803 . . . . 0.0 111.358 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -79.15 -59.65 0.6 Allowed Pre-proline 0 C--N 1.358 0.969 0 C-N-CA 128.85 2.86 . . . . 0.0 111.277 170.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.04 -42.51 3.05 Favored 'Trans proline' 0 C--N 1.366 1.451 0 C-N-CA 125.017 3.812 . . . . 0.0 113.423 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.5 -32.59 72.67 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 127.442 2.297 . . . . 0.0 115.135 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -88.06 -7.41 57.04 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 124.429 1.092 . . . . 0.0 112.605 173.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -87.82 -22.57 24.41 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 125.795 1.638 . . . . 0.0 111.73 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.06 -66.68 0.91 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 127.527 2.331 . . . . 0.0 110.964 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -91.95 -18.65 23.4 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 128.21 2.604 . . . . 0.0 111.685 -169.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.96 -75.21 0.46 Allowed Glycine 0 C--N 1.365 2.192 0 C-N-CA 125.081 1.324 . . . . 0.0 113.211 165.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.3 m -144.95 -9.48 0.6 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.227 1.811 . . . . 0.0 107.694 -171.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.6 t -111.31 61.99 0.61 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 126.353 1.861 . . . . 0.0 106.216 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.8 124.09 45.27 Favored 'General case' 0 C--N 1.358 0.959 0 C-N-CA 126.063 1.745 . . . . 0.0 107.458 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.11 85.77 0.47 Allowed Glycine 0 C--N 1.362 2.012 0 N-CA-C 106.652 -2.579 . . . . 0.0 106.652 168.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.84 111.96 23.72 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 125.224 1.409 . . . . 0.0 110.094 -168.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -119.68 146.23 45.77 Favored 'General case' 0 CA--C 1.497 -1.089 0 C-N-CA 125.194 1.397 . . . . 0.0 107.268 -171.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.5 t -129.97 114.87 16.37 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.1 mmt -126.78 127.02 44.39 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 176.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 80.11 -83.65 0.02 OUTLIER 'General case' 0 C--N 1.383 2.048 0 C-N-CA 127.469 2.308 . . . . 0.0 109.946 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.26 56.83 0.12 Allowed Glycine 0 N--CA 1.431 -1.675 0 N-CA-C 105.42 -3.072 . . . . 0.0 105.42 168.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -153.68 152.08 30.4 Favored 'General case' 0 C--N 1.364 1.198 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -106.19 142.72 35.41 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 127.713 2.405 . . . . 0.0 109.314 -164.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 27.2 mtmm -124.87 138.01 54.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 126.045 1.738 . . . . 0.0 106.887 173.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.1 m -121.27 110.71 16.47 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 124.428 1.091 . . . . 0.0 108.103 178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.459 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 61.5 m-85 . . . . . 0 N--CA 1.44 -0.945 0 C-N-CA 126.744 2.018 . . . . 0.0 107.858 -179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.3 mt . . . . . 0 CA--C 1.513 -0.448 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.9 pt -101.67 -178.41 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.221 0 C-N-CA 125.819 1.648 . . . . 0.0 109.852 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.71 76.63 1.69 Allowed 'General case' 0 C--N 1.362 1.132 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.4 t -127.23 126.08 67.23 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 172.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -83.49 132.54 34.94 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.962 1.705 . . . . 0.0 110.151 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -141.66 171.56 13.89 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -165.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.43 26.93 0.51 Allowed 'General case' 0 C--N 1.356 0.87 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 170.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -170.13 148.76 3.11 Favored Pre-proline 0 C--N 1.359 1.006 0 N-CA-C 105.196 -2.15 . . . . 0.0 105.196 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -71.58 -15.93 30.51 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.216 3.278 . . . . 0.0 114.764 169.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -79.43 -11.04 59.92 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.493 2.317 . . . . 0.0 114.356 171.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -92.23 -2.23 56.62 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 127.216 2.207 . . . . 0.0 110.238 171.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.81 -13.55 9.53 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.254 2.221 . . . . 0.0 108.243 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -85.1 -0.84 55.83 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 126.077 1.751 . . . . 0.0 111.251 174.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.9 mmmm -81.45 -57.31 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.927 0 C-N-CA 128.915 2.886 . . . . 0.0 111.282 171.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -70.04 -41.36 3.98 Favored 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 124.796 3.664 . . . . 0.0 113.832 173.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.75 -30.59 68.22 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.522 2.329 . . . . 0.0 114.824 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.05 -7.62 56.74 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 124.747 1.219 . . . . 0.0 113.071 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.69 -20.26 26.51 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 125.656 1.582 . . . . 0.0 111.706 165.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.0 mt -94.9 -67.86 0.83 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.499 2.32 . . . . 0.0 110.967 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -91.65 -13.22 32.18 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 128.373 2.669 . . . . 0.0 111.789 -169.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.95 -75.63 0.29 Allowed Glycine 0 C--N 1.365 2.148 0 C-N-CA 124.916 1.246 . . . . 0.0 113.942 162.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.41 -34.76 0.48 Allowed 'General case' 0 C--N 1.354 0.795 0 C-N-CA 125.543 1.537 . . . . 0.0 107.071 -170.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 t -92.61 78.93 4.86 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.877 2.471 . . . . 0.0 107.778 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -132.82 120.13 21.17 Favored 'General case' 0 C--N 1.361 1.077 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.32 85.53 0.73 Allowed Glycine 0 C--N 1.363 2.076 0 N-CA-C 107.638 -2.185 . . . . 0.0 107.638 172.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.18 117.6 30.26 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.65 1.58 . . . . 0.0 110.095 -169.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -123.99 141.39 52.09 Favored 'General case' 0 C--N 1.362 1.146 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -171.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.5 t -122.68 111.0 16.22 Favored 'General case' 0 C--N 1.351 0.671 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.3 mtp -117.81 123.67 46.52 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 105.109 -2.182 . . . . 0.0 105.109 175.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.58 -84.3 0.02 OUTLIER 'General case' 0 C--N 1.383 2.026 0 C-N-CA 127.641 2.376 . . . . 0.0 110.826 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.04 56.07 0.18 Allowed Glycine 0 N--CA 1.432 -1.571 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -154.0 152.36 30.44 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 175.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.9 t -105.58 145.5 30.88 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 127.262 2.225 . . . . 0.0 109.574 -164.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -126.04 143.62 51.04 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 126.225 1.81 . . . . 0.0 106.964 173.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -127.59 116.6 20.58 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 124.949 1.3 . . . . 0.0 108.298 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 . . . . . 0 N--CA 1.438 -1.053 0 C-N-CA 126.429 1.892 . . . . 0.0 105.935 178.728 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.4 mt . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 pt -103.42 -171.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.273 0 C-N-CA 125.442 1.497 . . . . 0.0 109.335 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -133.48 77.71 1.74 Allowed 'General case' 0 C--N 1.361 1.077 0 C-N-CA 124.464 1.106 . . . . 0.0 108.685 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -129.49 127.7 65.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 171.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -82.43 132.78 35.2 Favored 'General case' 0 C--N 1.366 1.289 0 C-N-CA 125.964 1.706 . . . . 0.0 109.9 -176.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.0 p -141.38 166.62 24.25 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 123.821 1.772 . . . . 0.0 110.079 -165.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 83.3 m -128.91 -49.11 1.23 Allowed 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 129.634 3.174 . . . . 0.0 104.699 -174.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.9 p -114.23 163.24 19.64 Favored Pre-proline 0 C--N 1.36 1.058 0 C-N-CA 127.443 2.297 . . . . 0.0 109.011 -177.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -72.6 -17.31 26.51 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.546 3.497 . . . . 0.0 114.409 164.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.68 -14.98 60.36 Favored 'General case' 0 C--N 1.372 1.57 0 C-N-CA 127.681 2.392 . . . . 0.0 114.469 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -84.81 -14.63 47.46 Favored 'General case' 0 C--N 1.37 1.491 0 C-N-CA 128.399 2.679 . . . . 0.0 110.62 172.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -107.46 -14.08 14.94 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 127.343 2.257 . . . . 0.0 109.077 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.7 m -84.52 -2.06 56.75 Favored 'General case' 0 C--N 1.369 1.413 0 C-N-CA 126.067 1.747 . . . . 0.0 111.386 174.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -80.43 -57.29 0.63 Allowed Pre-proline 0 N--CA 1.442 -0.866 0 C-N-CA 129.042 2.937 . . . . 0.0 111.5 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.63 -41.52 4.37 Favored 'Trans proline' 0 C--N 1.365 1.434 0 C-N-CA 124.984 3.789 . . . . 0.0 114.049 173.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.75 -30.9 68.59 Favored 'General case' 0 C--N 1.368 1.379 0 C-N-CA 127.579 2.352 . . . . 0.0 114.815 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -88.08 -7.7 56.58 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 124.921 1.288 . . . . 0.0 113.33 172.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -86.99 -20.12 27.71 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 125.654 1.582 . . . . 0.0 111.436 165.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.4 mt -92.39 -66.51 0.92 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 127.51 2.324 . . . . 0.0 111.168 177.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.2 -8.83 29.04 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 128.032 2.533 . . . . 0.0 112.245 -166.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.64 0.46 Allowed Glycine 0 C--N 1.364 2.109 0 C-N-CA 125.042 1.306 . . . . 0.0 113.377 165.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.42 -8.65 0.38 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 125.843 1.657 . . . . 0.0 107.143 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.1 t -106.56 67.78 0.73 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 126.822 2.049 . . . . 0.0 105.933 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.74 126.26 43.16 Favored 'General case' 0 CA--C 1.5 -0.969 0 C-N-CA 125.748 1.619 . . . . 0.0 106.946 -174.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.79 88.07 0.63 Allowed Glycine 0 C--N 1.361 1.97 0 N-CA-C 107.372 -2.291 . . . . 0.0 107.372 170.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.97 114.17 25.86 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 125.048 1.339 . . . . 0.0 109.84 -171.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.65 141.95 48.88 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -173.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.0 t -122.2 110.37 15.64 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -120.9 123.42 42.47 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.02 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.591 2.356 . . . . 0.0 110.901 177.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.91 54.62 0.17 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.631 -2.988 . . . . 0.0 105.631 168.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -152.55 152.3 31.71 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.6 t -105.15 144.29 32.16 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.16 2.184 . . . . 0.0 109.417 -165.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -125.28 139.69 53.49 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 126.463 1.905 . . . . 0.0 107.181 173.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.9 m -123.76 118.97 28.39 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.361 1.064 . . . . 0.0 108.319 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 N--CA 1.438 -1.074 0 C-N-CA 126.569 1.948 . . . . 0.0 106.381 179.961 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt -103.54 -170.77 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.337 0 C-N-CA 125.601 1.56 . . . . 0.0 109.142 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -135.01 78.43 1.73 Allowed 'General case' 0 C--N 1.361 1.07 0 C-N-CA 124.33 1.052 . . . . 0.0 108.555 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.0 t -128.87 127.21 66.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.7 133.13 34.82 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 125.613 1.565 . . . . 0.0 110.201 -174.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -142.12 171.71 13.68 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -165.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -153.28 27.33 0.51 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 169.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.3 p -170.53 149.22 2.97 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -71.31 -14.25 31.14 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 124.228 3.286 . . . . 0.0 114.822 168.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -87.75 9.43 21.7 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 126.71 2.004 . . . . 0.0 113.464 171.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -113.1 19.55 17.08 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.189 2.196 . . . . 0.0 107.614 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.3 t -142.58 -16.06 0.72 Allowed 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.36 1.864 . . . . 0.0 109.001 -175.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.8 m -83.83 -0.7 52.2 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 126.333 1.853 . . . . 0.0 111.717 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.1 mptp? -83.13 -57.3 0.44 Allowed Pre-proline 0 C--N 1.358 0.959 0 C-N-CA 129.069 2.947 . . . . 0.0 110.885 173.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.83 -40.01 5.71 Favored 'Trans proline' 0 C--N 1.367 1.521 0 C-N-CA 124.877 3.718 . . . . 0.0 113.714 174.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -70.07 -31.44 69.05 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 127.805 2.442 . . . . 0.0 114.782 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -88.07 -5.02 58.69 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 124.78 1.232 . . . . 0.0 113.463 171.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -87.05 -24.92 24.45 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 125.98 1.712 . . . . 0.0 110.655 164.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.9 mt -89.78 -63.38 1.29 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.473 2.309 . . . . 0.0 111.913 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -98.21 -9.05 26.24 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 127.797 2.439 . . . . 0.0 111.893 -167.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.56 -80.12 0.36 Allowed Glycine 0 C--N 1.365 2.176 0 C-N-CA 124.898 1.237 . . . . 0.0 113.407 165.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 24' ' ' SER . 74.8 m -146.31 -15.79 0.44 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.458 1.503 . . . . 0.0 107.006 -176.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.5 t -102.71 74.3 1.34 Allowed 'General case' 0 C--N 1.365 1.265 0 C-N-CA 126.948 2.099 . . . . 0.0 106.435 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -130.27 125.45 34.83 Favored 'General case' 0 C--N 1.36 1.025 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 -176.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.99 85.91 0.65 Allowed Glycine 0 C--N 1.362 2.016 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 171.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.05 117.74 30.53 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.49 1.516 . . . . 0.0 109.964 -170.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -124.51 144.32 50.18 Favored 'General case' 0 C--N 1.362 1.138 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -170.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -122.96 113.46 19.11 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -126.01 125.85 43.32 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 104.438 -2.43 . . . . 0.0 104.438 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 81.04 -86.25 0.02 OUTLIER 'General case' 0 C--N 1.384 2.068 0 C-N-CA 127.592 2.357 . . . . 0.0 109.158 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -173.23 54.51 0.16 Allowed Glycine 0 N--CA 1.432 -1.593 0 N-CA-C 104.923 -3.271 . . . . 0.0 104.923 166.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -150.23 152.95 35.39 Favored 'General case' 0 C--N 1.365 1.27 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.9 t -105.05 144.12 32.3 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 126.771 2.029 . . . . 0.0 109.297 -164.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -124.32 142.31 51.37 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 126.179 1.792 . . . . 0.0 106.774 174.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.8 m -125.97 119.01 26.58 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 124.342 1.057 . . . . 0.0 108.198 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 . . . . . 0 N--CA 1.436 -1.146 0 N-CA-C 105.769 -1.938 . . . . 0.0 105.769 178.997 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.6 mt . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 102.897 -3.001 . . . . 0.0 102.897 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.0 pt -99.5 -177.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.314 0 C-N-CA 125.556 1.543 . . . . 0.0 110.235 -178.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.39 74.47 1.52 Allowed 'General case' 0 C--N 1.362 1.146 0 C-N-CA 124.813 1.245 . . . . 0.0 107.957 -174.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.4 t -126.81 122.6 60.95 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 N-CA-C 103.36 -2.83 . . . . 0.0 103.36 171.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -85.62 136.45 33.37 Favored 'General case' 0 C--N 1.364 1.226 0 C-N-CA 125.771 1.628 . . . . 0.0 109.029 -173.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 p -145.61 170.47 16.39 Favored 'General case' 0 C--N 1.356 0.891 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 -160.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.43 22.63 0.72 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.789 -1.93 . . . . 0.0 105.789 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 p -170.62 148.36 2.71 Favored Pre-proline 0 C--N 1.36 1.054 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -174.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -71.52 -13.36 30.13 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 124.632 3.554 . . . . 0.0 114.291 165.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -75.57 -15.22 60.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 128.156 2.582 . . . . 0.0 114.786 170.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -91.85 -9.8 42.05 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 128.052 2.541 . . . . 0.0 110.332 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.7 t -112.64 -12.86 13.35 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.857 2.063 . . . . 0.0 109.456 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.2 p -87.96 0.43 55.9 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 125.71 1.604 . . . . 0.0 111.345 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -78.96 -58.05 0.73 Allowed Pre-proline 0 C--N 1.36 1.053 0 C-N-CA 128.42 2.688 . . . . 0.0 111.775 169.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.98 -41.41 2.74 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.945 3.763 . . . . 0.0 113.204 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -69.89 -31.66 69.58 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.831 2.452 . . . . 0.0 114.971 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -88.01 -6.64 57.88 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 124.659 1.184 . . . . 0.0 113.304 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.09 -22.32 22.96 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 126.255 1.822 . . . . 0.0 111.638 165.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.2 mt -91.3 -68.17 0.81 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.287 2.235 . . . . 0.0 110.966 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.24 -30.07 15.37 Favored 'General case' 0 C--N 1.36 1.055 0 C-N-CA 128.001 2.52 . . . . 0.0 111.672 -167.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.48 -169.64 14.88 Favored Glycine 0 C--N 1.36 1.883 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 34.2 m -69.23 -4.92 19.73 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 128.496 2.719 . . . . 0.0 116.302 -174.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 t -109.57 67.1 0.64 Allowed 'General case' 0 C--N 1.363 1.159 0 C-N-CA 126.717 2.007 . . . . 0.0 106.196 167.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.47 140.73 49.04 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.055 1.742 . . . . 0.0 106.6 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.82 87.11 0.62 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.476 -2.25 . . . . 0.0 107.476 173.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.94 112.59 24.29 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.357 1.463 . . . . 0.0 109.425 -171.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -123.23 139.0 54.5 Favored 'General case' 0 C--N 1.362 1.111 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -171.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.9 t -119.88 112.45 19.23 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -121.97 123.52 41.86 Favored 'General case' 0 C--N 1.358 0.957 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 37.7 t30 79.23 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.381 1.963 0 C-N-CA 127.285 2.234 . . . . 0.0 110.217 175.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.48 55.35 0.17 Allowed Glycine 0 N--CA 1.432 -1.599 0 N-CA-C 105.495 -3.042 . . . . 0.0 105.495 168.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -154.05 153.95 32.81 Favored 'General case' 0 C--N 1.363 1.175 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -105.03 148.47 26.72 Favored 'General case' 0 C--N 1.359 0.983 0 C-N-CA 127.23 2.212 . . . . 0.0 109.454 -165.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -128.15 142.66 51.12 Favored 'General case' 0 CA--C 1.501 -0.921 0 C-N-CA 126.238 1.815 . . . . 0.0 106.89 174.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.8 m -123.67 123.72 41.17 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 . . . . . 0 N--CA 1.437 -1.12 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.665 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt . . . . . 0 N--CA 1.444 -0.766 0 N-CA-C 102.995 -2.965 . . . . 0.0 102.995 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.1 pt -99.8 -178.93 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.287 0 C-N-CA 125.576 1.55 . . . . 0.0 109.858 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -127.21 75.66 1.6 Allowed 'General case' 0 C--N 1.363 1.183 0 C-N-CA 124.541 1.137 . . . . 0.0 107.935 -174.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.6 t -129.38 129.22 67.08 Favored 'Isoleucine or valine' 0 C--N 1.36 1.055 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 172.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -82.59 140.88 32.98 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 125.914 1.686 . . . . 0.0 109.613 -175.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.9 p -147.67 167.35 24.83 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -167.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -148.83 22.12 1.0 Allowed 'General case' 0 C--N 1.355 0.81 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 171.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.0 p -169.01 150.73 4.53 Favored Pre-proline 0 C--N 1.361 1.067 0 N-CA-C 105.304 -2.109 . . . . 0.0 105.304 -175.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -71.62 -16.32 30.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.114 3.21 . . . . 0.0 114.815 169.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.51 -4.82 57.02 Favored 'General case' 0 C--N 1.369 1.437 0 C-N-CA 127.009 2.123 . . . . 0.0 114.569 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -99.14 3.01 46.42 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 127.161 2.184 . . . . 0.0 109.648 171.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -122.99 -14.04 7.68 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 127.465 2.306 . . . . 0.0 108.007 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 m -85.66 0.66 52.06 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 126.195 1.798 . . . . 0.0 110.81 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.45 -57.21 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.965 0 C-N-CA 129.297 3.039 . . . . 0.0 110.92 172.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -70.05 -42.04 3.43 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 124.867 3.711 . . . . 0.0 113.919 171.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.3 -28.98 65.61 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.293 2.237 . . . . 0.0 114.941 -175.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -88.09 -11.08 48.12 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.589 1.156 . . . . 0.0 113.026 171.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -84.78 -20.37 31.13 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 125.527 1.531 . . . . 0.0 111.872 166.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.5 mt -93.42 -67.01 0.88 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.626 2.37 . . . . 0.0 111.03 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -96.78 -6.61 35.75 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 127.866 2.466 . . . . 0.0 112.518 -166.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.22 -78.73 0.52 Allowed Glycine 0 C--N 1.366 2.203 0 C-N-CA 125.074 1.321 . . . . 0.0 113.672 164.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.1 t -153.2 -7.96 0.17 Allowed 'General case' 0 C--N 1.354 0.776 0 N-CA-C 106.528 -1.656 . . . . 0.0 106.528 -174.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -106.21 68.71 0.77 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.001 2.12 . . . . 0.0 105.66 174.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.86 128.88 48.32 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.013 1.725 . . . . 0.0 106.892 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.46 87.53 0.54 Allowed Glycine 0 C--N 1.362 2.005 0 N-CA-C 106.965 -2.454 . . . . 0.0 106.965 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.42 113.45 25.11 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.235 1.414 . . . . 0.0 109.704 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -124.03 140.36 53.04 Favored 'General case' 0 C--N 1.36 1.054 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -171.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 45.3 t -121.24 113.62 20.21 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.6 mmm -124.23 123.62 40.66 Favored 'General case' 0 C--N 1.359 1.003 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 79.23 -85.73 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.463 2.305 . . . . 0.0 110.266 175.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.76 54.12 0.19 Allowed Glycine 0 N--CA 1.433 -1.522 0 N-CA-C 105.453 -3.059 . . . . 0.0 105.453 169.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -154.02 154.35 33.57 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.2 t -106.1 147.15 29.28 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.368 2.267 . . . . 0.0 109.407 -164.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -126.81 141.06 51.93 Favored 'General case' 0 CA--C 1.501 -0.916 0 C-N-CA 126.165 1.786 . . . . 0.0 106.794 173.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.4 m -123.56 124.42 42.77 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 . . . . . 0 N--CA 1.436 -1.164 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.29 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 88.1 mt . . . . . 0 CA--C 1.511 -0.544 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -105.38 -177.56 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.117 0 C-N-CA 125.938 1.695 . . . . 0.0 109.933 -172.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -127.26 75.93 1.62 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 124.918 1.287 . . . . 0.0 107.686 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 t -126.76 125.66 67.28 Favored 'Isoleucine or valine' 0 C--N 1.362 1.126 0 N-CA-C 103.909 -2.626 . . . . 0.0 103.909 173.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -80.58 133.13 35.73 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.13 1.772 . . . . 0.0 110.067 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.0 169.94 16.66 Favored 'General case' 0 C--N 1.357 0.934 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -166.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.49 22.07 0.72 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.918 -1.882 . . . . 0.0 105.918 174.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 p -170.06 149.51 3.37 Favored Pre-proline 0 C--N 1.36 1.044 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 -175.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -71.64 -16.64 30.16 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.317 3.345 . . . . 0.0 114.601 168.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -82.27 -3.43 55.19 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.931 2.093 . . . . 0.0 114.628 171.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -94.23 -5.81 46.05 Favored 'General case' 0 C--N 1.37 1.499 0 C-N-CA 127.319 2.248 . . . . 0.0 109.827 169.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.0 t -116.35 -13.05 11.03 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 126.921 2.089 . . . . 0.0 108.795 -177.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -86.25 -2.38 58.33 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 126.655 1.982 . . . . 0.0 110.604 172.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HZ2' ' HB3' ' A' ' 15' ' ' LYS . 9.7 mtpm? -79.15 -57.97 0.72 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.099 2.959 . . . . 0.0 111.389 171.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.18 -45.01 0.96 Allowed 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 124.984 3.789 . . . . 0.0 113.577 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.2 m -69.43 -28.93 66.55 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 127.296 2.238 . . . . 0.0 115.048 -177.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -88.05 -9.3 53.79 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.73 170.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -86.04 -23.28 26.84 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 125.651 1.58 . . . . 0.0 111.319 167.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.8 mt -87.99 -61.16 1.78 Allowed 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.785 2.434 . . . . 0.0 111.389 176.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -107.34 1.71 23.94 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.664 1.986 . . . . 0.0 112.323 -162.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.84 -82.79 0.75 Allowed Glycine 0 C--N 1.365 2.163 0 C-N-CA 125.163 1.363 . . . . 0.0 113.711 165.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -148.2 -6.75 0.42 Allowed 'General case' 0 C--N 1.355 0.81 0 C-N-CA 125.909 1.684 . . . . 0.0 106.797 -178.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.0 t -102.65 77.89 1.65 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.392 2.277 . . . . 0.0 106.316 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -145.36 125.9 14.12 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.21 87.35 0.66 Allowed Glycine 0 C--N 1.366 2.208 0 N-CA-C 107.535 -2.226 . . . . 0.0 107.535 171.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.1 113.18 25.36 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 125.171 1.388 . . . . 0.0 110.71 -168.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -117.91 145.62 44.52 Favored 'General case' 0 C--N 1.363 1.177 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -125.09 112.95 17.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 105.469 -2.048 . . . . 0.0 105.469 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.85 123.91 41.49 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 104.4 -2.445 . . . . 0.0 104.4 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.0 m120 77.65 -84.03 0.03 OUTLIER 'General case' 0 C--N 1.383 2.027 0 C-N-CA 127.617 2.367 . . . . 0.0 111.09 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.64 55.44 0.16 Allowed Glycine 0 N--CA 1.433 -1.505 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 169.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -152.51 153.02 32.62 Favored 'General case' 0 C--N 1.364 1.197 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.0 t -104.99 142.98 33.82 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.347 2.259 . . . . 0.0 109.238 -165.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -125.63 145.53 50.11 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 126.031 1.732 . . . . 0.0 108.107 174.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 16.6 m -117.43 135.44 53.89 Favored 'General case' 0 C--N 1.36 1.049 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 . . . . . 0 C--N 1.359 1.009 0 C-N-CA 124.801 1.24 . . . . 0.0 109.097 -174.846 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.8 mt . . . . . 0 N--CA 1.447 -0.616 0 N-CA-C 104.318 -2.475 . . . . 0.0 104.318 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.3 pt -106.68 -172.58 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.249 0 C-N-CA 125.385 1.474 . . . . 0.0 108.949 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -133.33 85.74 2.24 Favored 'General case' 0 C--N 1.361 1.085 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.0 t -131.42 129.45 62.15 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 N-CA-C 103.473 -2.788 . . . . 0.0 103.473 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HZ3' ' HB3' ' A' ' 6' ' ' LYS . 2.6 mmmp? -79.29 135.38 36.73 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 126.283 1.833 . . . . 0.0 110.187 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.72 173.06 12.17 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -168.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.01 27.34 0.42 Allowed 'General case' 0 C--N 1.355 0.844 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 169.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.3 p -171.32 148.54 2.38 Favored Pre-proline 0 C--N 1.361 1.075 0 N-CA-C 105.1 -2.185 . . . . 0.0 105.1 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -70.7 -17.46 33.28 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 124.286 3.324 . . . . 0.0 114.857 169.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.63 -8.77 59.41 Favored 'General case' 0 C--N 1.368 1.392 0 C-N-CA 127.556 2.342 . . . . 0.0 114.204 172.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -93.96 -1.84 54.03 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 126.954 2.102 . . . . 0.0 110.193 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.8 t -118.51 -12.97 9.74 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 127.157 2.183 . . . . 0.0 108.209 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.3 m -83.47 -1.94 54.75 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 125.987 1.715 . . . . 0.0 112.099 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -80.99 -56.96 0.6 Allowed Pre-proline 0 C--N 1.361 1.067 0 C-N-CA 128.304 2.642 . . . . 0.0 111.358 171.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.26 -40.81 4.16 Favored 'Trans proline' 0 C--N 1.366 1.456 0 C-N-CA 124.78 3.653 . . . . 0.0 113.59 175.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.7 m -69.19 -31.87 70.78 Favored 'General case' 0 C--N 1.368 1.391 0 C-N-CA 127.787 2.435 . . . . 0.0 114.888 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -88.07 -6.01 58.16 Favored 'General case' 0 C--N 1.369 1.436 0 C-N-CA 124.852 1.261 . . . . 0.0 113.267 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -88.59 -20.31 25.16 Favored 'General case' 0 C--N 1.36 1.053 0 C-N-CA 125.906 1.682 . . . . 0.0 111.243 165.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.7 mt -93.1 -67.09 0.88 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.571 2.348 . . . . 0.0 111.119 178.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -95.56 -10.07 30.58 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 128.163 2.585 . . . . 0.0 112.121 -167.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.62 -79.55 0.39 Allowed Glycine 0 C--N 1.365 2.139 0 C-N-CA 125.01 1.29 . . . . 0.0 113.404 165.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.69 -13.38 0.44 Allowed 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.65 1.58 . . . . 0.0 107.071 -175.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 t -104.43 70.18 0.94 Allowed 'General case' 0 C--N 1.366 1.321 0 C-N-CA 126.862 2.065 . . . . 0.0 106.1 177.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.45 126.25 43.47 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.738 1.615 . . . . 0.0 106.826 -175.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.25 86.54 0.57 Allowed Glycine 0 C--N 1.361 1.95 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 171.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.36 114.73 26.83 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 125.185 1.394 . . . . 0.0 109.822 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -121.34 145.54 47.78 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -173.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.1 t -127.93 112.08 14.29 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 65.9 mtt -131.92 130.85 42.11 Favored 'General case' 0 C--N 1.359 1.009 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 79.36 -14.36 0.87 Allowed 'General case' 0 C--N 1.384 2.072 0 C-N-CA 126.869 2.068 . . . . 0.0 114.516 172.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.22 41.18 4.06 Favored Glycine 0 C--N 1.361 1.952 0 C-N-CA 127.36 2.41 . . . . 0.0 110.451 -171.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -148.54 151.33 34.92 Favored 'General case' 0 C--N 1.365 1.246 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.5 t -104.94 140.09 38.69 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.583 1.953 . . . . 0.0 109.462 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -121.76 140.53 52.23 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 126.128 1.771 . . . . 0.0 107.066 173.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.2 m -125.72 113.2 17.01 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 . . . . . 0 N--CA 1.439 -1.013 0 C-N-CA 127.243 2.217 . . . . 0.0 106.767 -179.891 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 103.9 -2.63 . . . . 0.0 103.9 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -102.52 -179.73 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.318 0 C-N-CA 125.715 1.606 . . . . 0.0 110.013 -178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -123.77 71.9 1.12 Allowed 'General case' 0 C--N 1.363 1.157 0 C-N-CA 125.075 1.35 . . . . 0.0 108.323 -173.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.1 t -128.94 131.18 68.44 Favored 'Isoleucine or valine' 0 C--N 1.362 1.111 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 173.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.73 140.18 30.71 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 125.868 1.667 . . . . 0.0 109.308 -173.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 p -146.3 168.56 20.78 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -168.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -153.38 26.02 0.52 Allowed 'General case' 0 C--N 1.355 0.848 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 167.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.4 p -167.46 148.22 4.88 Favored Pre-proline 0 C--N 1.361 1.068 0 N-CA-C 105.19 -2.152 . . . . 0.0 105.19 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -72.59 -14.74 27.52 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 123.966 3.111 . . . . 0.0 114.844 171.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -76.88 -15.97 59.54 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 127.234 2.214 . . . . 0.0 114.28 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -88.65 -3.76 58.71 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 127.262 2.225 . . . . 0.0 110.636 173.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.2 t -117.41 -13.84 10.36 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 127.556 2.342 . . . . 0.0 108.433 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -85.99 -1.85 57.73 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 126.184 1.793 . . . . 0.0 111.075 174.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -77.4 -59.01 0.9 Allowed Pre-proline 0 C--N 1.357 0.895 0 C-N-CA 129.006 2.923 . . . . 0.0 111.813 170.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -71.32 -41.04 2.7 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 124.961 3.774 . . . . 0.0 113.676 174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.47 -29.31 65.83 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 127.509 2.324 . . . . 0.0 114.566 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -88.06 -9.91 51.89 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 124.732 1.213 . . . . 0.0 113.103 171.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -85.5 -20.08 30.22 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 125.613 1.565 . . . . 0.0 111.706 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.1 mt -93.81 -66.53 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.681 2.393 . . . . 0.0 111.092 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -96.12 -7.63 35.44 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.875 2.47 . . . . 0.0 112.346 -167.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.14 -78.91 0.4 Allowed Glycine 0 C--N 1.364 2.125 0 C-N-CA 124.982 1.277 . . . . 0.0 113.445 165.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.7 t -153.06 -8.43 0.17 Allowed 'General case' 0 C--N 1.354 0.775 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 t -106.3 68.78 0.77 Allowed 'General case' 0 C--N 1.365 1.272 0 C-N-CA 126.947 2.099 . . . . 0.0 105.649 175.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.57 126.57 45.01 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 125.956 1.702 . . . . 0.0 106.725 -174.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.29 86.32 0.56 Allowed Glycine 0 C--N 1.361 1.962 0 N-CA-C 107.326 -2.31 . . . . 0.0 107.326 171.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.07 113.09 24.99 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.356 1.462 . . . . 0.0 109.534 -172.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -121.61 137.7 54.63 Favored 'General case' 0 C--N 1.36 1.032 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 -171.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.5 t -115.0 126.62 54.97 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 -177.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 95.9 mmm -110.42 69.14 0.68 Allowed 'General case' 0 C--N 1.359 1.02 0 N-CA-C 104.349 -2.463 . . . . 0.0 104.349 172.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -2.9 71.32 0.0 OUTLIER 'General case' 0 C--N 1.38 1.927 1 C-N-CA 134.678 5.191 . . . . 0.0 118.433 -172.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.48 -39.38 0.58 Allowed Glycine 0 C--N 1.354 1.545 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -164.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -154.06 158.27 40.26 Favored 'General case' 0 C--N 1.37 1.474 0 CA-C-N 119.443 1.622 . . . . 0.0 108.666 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -107.46 153.81 22.27 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 128.661 2.784 . . . . 0.0 109.688 -166.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.409 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 54.1 mtmt -131.46 142.77 50.06 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.04 2.136 . . . . 0.0 106.896 175.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.1 m -125.6 122.58 36.87 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.301 1.04 . . . . 0.0 108.748 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.409 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 66.0 m-85 . . . . . 0 N--CA 1.437 -1.082 0 C-N-CA 126.443 1.897 . . . . 0.0 105.911 179.169 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 72.1 mt . . . . . 0 CA--C 1.511 -0.544 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.8 pt -103.72 -176.55 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.597 1.559 . . . . 0.0 110.354 -173.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -127.41 79.86 1.92 Allowed 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -128.37 123.07 59.2 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.038 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 170.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -81.82 130.28 35.01 Favored 'General case' 0 C--N 1.366 1.285 0 C-N-CA 125.954 1.702 . . . . 0.0 109.651 -175.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.1 p -139.01 171.48 14.26 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -164.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.87 22.85 0.68 Allowed 'General case' 0 C--N 1.355 0.847 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 174.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.4 p -171.52 148.01 2.2 Favored Pre-proline 0 C--N 1.36 1.043 0 N-CA-C 105.526 -2.028 . . . . 0.0 105.526 -174.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -71.56 -13.63 30.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.632 3.554 . . . . 0.0 114.173 165.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -75.28 -16.15 60.46 Favored 'General case' 0 C--N 1.369 1.447 0 C-N-CA 128.35 2.66 . . . . 0.0 114.76 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -89.8 -12.05 40.35 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 128.225 2.61 . . . . 0.0 110.441 174.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.8 t -111.82 -12.92 13.75 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 126.797 2.039 . . . . 0.0 109.636 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.2 p -88.04 -1.22 57.86 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 125.613 1.565 . . . . 0.0 111.61 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -78.03 -58.49 0.85 Allowed Pre-proline 0 C--N 1.36 1.03 0 C-N-CA 128.586 2.754 . . . . 0.0 111.668 169.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.9 -43.92 2.27 Favored 'Trans proline' 0 C--N 1.365 1.438 0 C-N-CA 124.98 3.787 . . . . 0.0 113.198 177.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 66.0 m -67.58 -33.58 75.3 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 128.26 2.624 . . . . 0.0 115.411 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -88.06 -5.04 58.69 Favored 'General case' 0 C--N 1.37 1.465 0 CA-C-N 119.628 1.103 . . . . 0.0 113.337 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -88.97 -23.44 22.65 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.97 1.708 . . . . 0.0 111.628 164.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.6 mt -90.77 -64.14 1.17 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 127.41 2.284 . . . . 0.0 111.611 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -90.05 -32.82 16.56 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.154 2.581 . . . . 0.0 110.797 -168.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.66 92.6 1.37 Allowed Glycine 0 C--N 1.364 2.116 0 C-N-CA 124.966 1.27 . . . . 0.0 114.299 163.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . 0.259 20.1 m 83.57 -53.01 0.15 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 128.439 2.696 . . . . 0.0 114.554 169.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.1 t -109.31 71.74 0.78 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 126.652 1.981 . . . . 0.0 107.103 -177.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.96 146.84 34.55 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 125.559 1.544 . . . . 0.0 107.572 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.5 89.44 0.78 Allowed Glycine 0 C--N 1.359 1.854 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.46 115.94 28.12 Favored 'General case' 0 C--N 1.355 0.827 0 C-N-CA 125.283 1.433 . . . . 0.0 109.438 -172.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.6 mtpt -122.81 140.29 53.09 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.1 t -119.44 110.45 16.94 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -120.05 122.91 42.14 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 178.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.44 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.635 2.374 . . . . 0.0 111.195 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.15 55.27 0.18 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 105.38 -3.088 . . . . 0.0 105.38 169.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -153.67 152.2 30.55 Favored 'General case' 0 C--N 1.364 1.203 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 176.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.2 t -105.22 143.15 33.8 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 127.119 2.167 . . . . 0.0 109.214 -166.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -122.06 148.15 45.22 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 126.045 1.738 . . . . 0.0 107.232 172.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 m -126.02 133.69 51.67 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.434 -1.261 0 N-CA-C 104.561 -2.385 . . . . 0.0 104.561 179.25 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.9 mt . . . . . 0 N--CA 1.445 -0.719 0 N-CA-C 104.398 -2.445 . . . . 0.0 104.398 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -111.53 -171.65 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.631 1.572 . . . . 0.0 108.305 174.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -131.45 82.01 2.01 Favored 'General case' 0 C--N 1.364 1.22 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.0 t -132.89 130.0 58.37 Favored 'Isoleucine or valine' 0 C--N 1.361 1.092 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 171.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.68 135.05 35.53 Favored 'General case' 0 C--N 1.366 1.297 0 C-N-CA 125.866 1.666 . . . . 0.0 110.357 -177.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.2 p -143.72 171.8 13.7 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -168.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -153.72 27.28 0.49 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 105.307 -2.109 . . . . 0.0 105.307 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 76.1 p -170.71 149.16 2.84 Favored Pre-proline 0 C--N 1.36 1.04 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -71.69 -13.1 29.58 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 124.46 3.44 . . . . 0.0 114.081 167.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.05 -13.72 59.92 Favored 'General case' 0 C--N 1.371 1.501 0 C-N-CA 128.793 2.837 . . . . 0.0 113.915 172.001 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -98.17 0.71 46.42 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 127.719 2.408 . . . . 0.0 109.913 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.5 t -122.51 -17.5 6.97 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 126.504 1.922 . . . . 0.0 108.669 -175.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 p -87.04 1.58 52.41 Favored 'General case' 0 C--N 1.369 1.416 0 O-C-N 120.155 -1.591 . . . . 0.0 111.095 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.86 -56.81 0.54 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 129.67 3.188 . . . . 0.0 110.942 170.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.35 -46.8 2.59 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 124.863 3.709 . . . . 0.0 113.646 171.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -62.87 -37.79 88.28 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.984 2.514 . . . . 0.0 115.517 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.1 -3.25 58.91 Favored 'General case' 0 C--N 1.368 1.4 0 C-N-CA 125.012 1.325 . . . . 0.0 113.447 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -89.02 -25.85 21.76 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 125.401 1.48 . . . . 0.0 111.911 162.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.5 mt -94.58 -61.85 1.43 Allowed 'General case' 0 C--N 1.367 1.332 0 C-N-CA 127.044 2.137 . . . . 0.0 112.844 -173.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -91.41 -33.59 15.19 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 127.092 2.157 . . . . 0.0 112.416 -161.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 173.88 -113.39 0.46 Allowed Glycine 0 C--N 1.356 1.661 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 176.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -148.52 -10.5 0.36 Allowed 'General case' 0 C--N 1.356 0.877 0 C-N-CA 126.258 1.823 . . . . 0.0 106.51 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -128.54 73.87 1.52 Allowed 'General case' 0 C--N 1.362 1.116 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.88 153.37 19.91 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.908 1.683 . . . . 0.0 108.687 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.55 87.35 0.94 Allowed Glycine 0 C--N 1.364 2.124 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.75 115.82 28.09 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 125.239 1.416 . . . . 0.0 109.459 -171.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -124.91 140.6 52.77 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 -172.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -121.33 114.7 21.71 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 -178.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -124.94 124.14 41.4 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 78.41 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.007 0 C-N-CA 127.592 2.357 . . . . 0.0 110.916 176.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.6 54.34 0.18 Allowed Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 105.48 -3.048 . . . . 0.0 105.48 168.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -153.99 151.74 29.73 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 105.631 -1.989 . . . . 0.0 105.631 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.5 t -104.96 145.92 29.76 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 127.44 2.296 . . . . 0.0 109.067 -164.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -125.77 138.86 53.87 Favored 'General case' 0 CA--C 1.499 -1.003 0 C-N-CA 126.34 1.856 . . . . 0.0 106.441 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 66.5 m -125.5 116.11 21.28 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.286 1.034 . . . . 0.0 108.717 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 . . . . . 0 N--CA 1.436 -1.127 0 C-N-CA 127.197 2.199 . . . . 0.0 106.536 179.647 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.9 mt . . . . . 0 N--CA 1.445 -0.712 0 N-CA-C 103.106 -2.924 . . . . 0.0 103.106 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.0 pt -105.8 -175.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.269 0 C-N-CA 125.307 1.443 . . . . 0.0 109.445 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -129.63 78.42 1.85 Allowed 'General case' 0 C--N 1.362 1.114 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.66 127.62 66.9 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 N-CA-C 103.772 -2.677 . . . . 0.0 103.772 172.557 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -80.35 132.84 35.85 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.218 1.807 . . . . 0.0 110.409 -176.116 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.8 p -142.85 173.13 11.82 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 123.219 1.485 . . . . 0.0 109.009 -165.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 96.3 m -142.05 -52.73 0.42 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 102.625 -3.102 . . . . 0.0 102.625 -168.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.7 p -107.98 162.74 18.82 Favored Pre-proline 0 C--N 1.362 1.127 0 C-N-CA 127.635 2.374 . . . . 0.0 109.351 179.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -72.12 -18.35 27.32 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.685 3.59 . . . . 0.0 114.417 164.27 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.43 -2.29 48.96 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.735 2.014 . . . . 0.0 114.505 171.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -93.13 -10.27 36.52 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.162 2.585 . . . . 0.0 109.773 169.762 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.6 t -112.74 -14.67 13.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 127.511 2.324 . . . . 0.0 108.159 -177.031 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -82.91 -0.69 49.6 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 126.749 2.019 . . . . 0.0 111.25 173.426 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -82.09 -57.65 0.49 Allowed Pre-proline 0 N--CA 1.439 -1.01 0 C-N-CA 129.272 3.029 . . . . 0.0 110.881 172.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.07 -43.69 3.07 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 124.911 3.741 . . . . 0.0 113.796 171.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -68.1 -30.39 69.54 Favored 'General case' 0 C--N 1.367 1.36 0 C-N-CA 127.138 2.175 . . . . 0.0 115.215 -176.01 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -88.05 -9.31 53.78 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.946 1.298 . . . . 0.0 113.076 173.108 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -87.5 -22.13 25.07 Favored 'General case' 0 C--N 1.362 1.114 0 C-N-CA 125.917 1.687 . . . . 0.0 112.219 165.735 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.8 mt -96.54 -71.13 0.69 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.214 2.206 . . . . 0.0 110.756 -177.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -89.45 -25.89 21.25 Favored 'General case' 0 C--N 1.361 1.102 0 C-N-CA 128.568 2.747 . . . . 0.0 111.531 -169.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.73 -155.86 20.14 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 125.669 1.604 . . . . 0.0 109.826 177.333 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.4 m -72.46 -4.51 30.72 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 128.337 2.655 . . . . 0.0 114.911 179.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.7 t -104.52 71.78 1.01 Allowed 'General case' 0 C--N 1.365 1.245 0 C-N-CA 127.261 2.224 . . . . 0.0 105.73 165.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.46 127.07 36.63 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.6 87.45 0.65 Allowed Glycine 0 C--N 1.361 1.96 0 N-CA-C 107.085 -2.406 . . . . 0.0 107.085 170.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.81 111.37 23.16 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.473 1.509 . . . . 0.0 109.754 -170.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -120.81 141.63 50.36 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -170.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.2 t -122.59 111.77 17.18 Favored 'General case' 0 C--N 1.352 0.675 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 -178.194 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.8 mmm -120.59 124.79 46.15 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 104.415 -2.439 . . . . 0.0 104.415 178.55 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.47 12.5 p30 70.41 -79.07 0.04 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 128.647 2.779 . . . . 0.0 113.596 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.23 54.0 0.14 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.854 -2.898 . . . . 0.0 105.854 169.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -153.23 151.49 30.13 Favored 'General case' 0 C--N 1.361 1.095 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 176.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.11 144.37 32.0 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.212 2.205 . . . . 0.0 109.295 -163.656 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -124.99 140.63 52.75 Favored 'General case' 0 CA--C 1.501 -0.912 0 C-N-CA 126.01 1.724 . . . . 0.0 107.027 174.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -125.31 110.79 14.42 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.307 1.043 . . . . 0.0 108.492 179.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 . . . . . 0 C--N 1.357 0.928 0 C-N-CA 127.23 2.212 . . . . 0.0 106.829 177.462 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt . . . . . 0 N--CA 1.443 -0.8 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.7 pt -101.01 -172.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.286 0 C-N-CA 125.422 1.489 . . . . 0.0 109.644 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -133.38 73.15 1.5 Allowed 'General case' 0 C--N 1.36 1.049 0 C-N-CA 124.424 1.09 . . . . 0.0 108.669 -173.1 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.8 t -125.32 125.48 69.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.461 ' HZ1' ' HE3' ' A' ' 33' ' ' LYS . 58.3 mmtt -88.77 125.0 34.68 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 125.264 1.426 . . . . 0.0 108.813 -171.107 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 p -131.37 176.09 8.58 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.177 0.991 . . . . 0.0 109.314 -162.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.84 23.27 0.45 Allowed 'General case' 0 C--N 1.356 0.88 0 N-CA-C 105.734 -1.951 . . . . 0.0 105.734 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -173.47 149.56 1.67 Allowed Pre-proline 0 C--N 1.359 1.002 0 N-CA-C 105.118 -2.179 . . . . 0.0 105.118 -173.59 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -70.58 -17.33 33.9 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.538 3.492 . . . . 0.0 114.36 167.847 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -78.02 -14.28 59.57 Favored 'General case' 0 C--N 1.37 1.473 0 C-N-CA 128.584 2.754 . . . . 0.0 114.001 174.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -88.66 -11.44 45.29 Favored 'General case' 0 C--N 1.372 1.574 0 C-N-CA 127.852 2.461 . . . . 0.0 110.263 172.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.5 t -109.08 -13.41 14.7 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.04 2.136 . . . . 0.0 109.135 -179.144 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -84.8 -0.41 53.77 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.021 1.728 . . . . 0.0 111.202 173.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -80.09 -59.06 0.56 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.108 2.963 . . . . 0.0 111.266 171.21 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -70.88 -41.77 2.65 Favored 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 125.023 3.815 . . . . 0.0 113.509 174.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.59 -30.06 66.65 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 127.482 2.313 . . . . 0.0 114.941 -176.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -88.07 -8.94 54.79 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.823 1.192 . . . . 0.0 112.792 171.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -86.27 -21.37 27.39 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.836 1.654 . . . . 0.0 111.586 166.471 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.9 mt -91.92 -66.27 0.94 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 127.563 2.345 . . . . 0.0 111.023 178.006 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.16 -8.57 29.75 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.863 2.465 . . . . 0.0 112.263 -167.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.38 -79.64 0.58 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 125.099 1.333 . . . . 0.0 113.655 164.92 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.8 m -147.97 -7.13 0.43 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.005 1.722 . . . . 0.0 107.225 -174.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 t -108.73 66.6 0.64 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 126.733 2.013 . . . . 0.0 105.886 177.372 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.58 125.31 42.98 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.715 1.606 . . . . 0.0 106.838 -175.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.16 83.59 0.43 Allowed Glycine 0 C--N 1.362 2.018 0 N-CA-C 106.897 -2.481 . . . . 0.0 106.897 170.177 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.89 113.59 25.34 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.291 1.437 . . . . 0.0 110.172 -168.427 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -119.78 149.28 42.3 Favored 'General case' 0 CA--C 1.495 -1.148 0 C-N-CA 125.197 1.399 . . . . 0.0 108.026 -171.165 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -131.33 115.34 16.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 -179.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 94.7 mtp -124.34 127.37 47.49 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 173.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.44 -83.31 0.02 OUTLIER 'General case' 0 C--N 1.384 2.104 0 C-N-CA 127.562 2.345 . . . . 0.0 110.533 174.518 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.54 57.14 0.11 Allowed Glycine 0 N--CA 1.43 -1.756 0 N-CA-C 105.558 -3.017 . . . . 0.0 105.558 167.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.461 ' HE3' ' HZ1' ' A' ' 6' ' ' LYS . 53.8 mttp -152.09 150.21 29.66 Favored 'General case' 0 C--N 1.365 1.25 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 175.758 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -105.04 142.88 34.04 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.28 2.232 . . . . 0.0 109.555 -164.747 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -123.58 140.6 52.83 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.83 1.652 . . . . 0.0 107.315 173.008 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -120.62 119.26 32.35 Favored 'General case' 0 C--N 1.361 1.082 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.385 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 . . . . . 0 N--CA 1.438 -1.061 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 178.039 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.0 mt . . . . . 0 N--CA 1.445 -0.687 0 N-CA-C 103.064 -2.939 . . . . 0.0 103.064 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.1 pt -103.78 -175.85 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.248 0 C-N-CA 125.12 1.368 . . . . 0.0 109.679 -179.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -128.73 78.69 1.86 Allowed 'General case' 0 C--N 1.362 1.12 0 C-N-CA 124.913 1.285 . . . . 0.0 107.589 -175.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.26 124.37 62.11 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -80.87 134.94 35.84 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 126.904 2.082 . . . . 0.0 110.125 -177.87 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.3 p -142.33 -179.18 6.12 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.726 0.774 . . . . 0.0 110.079 -164.253 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.5 t -148.94 18.64 0.99 Allowed 'General case' 0 C--N 1.355 0.839 0 C-N-CA 126.064 1.746 . . . . 0.0 106.772 168.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.2 p -172.96 155.96 3.03 Favored Pre-proline 0 C--N 1.363 1.189 0 C-N-CA 124.651 1.181 . . . . 0.0 108.196 -172.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -69.75 -18.22 37.17 Favored 'Trans proline' 0 C--N 1.361 1.198 1 C-N-CA 125.395 4.064 . . . . 0.0 114.804 163.224 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -76.09 -17.11 59.76 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 128.161 2.584 . . . . 0.0 113.744 174.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.5 tp60 -91.6 -7.86 48.94 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 128.499 2.72 . . . . 0.0 110.179 174.293 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 t -109.06 -13.54 14.69 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.522 2.329 . . . . 0.0 109.144 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.1 m -84.39 -1.88 56.24 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 126.332 1.853 . . . . 0.0 111.295 174.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -79.95 -59.37 0.55 Allowed Pre-proline 0 C--N 1.357 0.907 0 C-N-CA 129.331 3.053 . . . . 0.0 111.314 171.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -70.61 -41.02 3.47 Favored 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 125.114 3.876 . . . . 0.0 113.584 175.332 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.12 -31.44 70.13 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 127.684 2.394 . . . . 0.0 114.735 -177.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.08 -6.4 57.95 Favored 'General case' 0 C--N 1.37 1.486 0 C-N-CA 124.651 1.18 . . . . 0.0 113.2 172.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -88.65 -20.44 24.91 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.68 1.592 . . . . 0.0 111.471 165.632 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -93.36 -66.88 0.89 Allowed 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.506 2.322 . . . . 0.0 111.111 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -92.68 -14.92 27.4 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 128.181 2.592 . . . . 0.0 111.705 -169.416 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.0 -74.29 0.29 Allowed Glycine 0 C--N 1.365 2.154 0 C-N-CA 124.9 1.238 . . . . 0.0 113.746 163.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.39 -35.22 0.47 Allowed 'General case' 0 C--N 1.354 0.766 0 C-N-CA 125.588 1.555 . . . . 0.0 107.13 -169.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.8 t -93.14 75.64 4.66 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.823 2.449 . . . . 0.0 108.034 176.466 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.53 121.15 28.16 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 -177.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.36 85.08 0.78 Allowed Glycine 0 C--N 1.364 2.104 0 N-CA-C 107.783 -2.127 . . . . 0.0 107.783 172.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.65 114.55 27.14 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 125.556 1.542 . . . . 0.0 109.843 -170.841 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -123.99 143.21 50.55 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 -172.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.8 113.38 8.54 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -176.696 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.5 mmt -115.0 122.32 45.85 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 -175.003 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 77.92 -83.91 0.03 OUTLIER 'General case' 0 C--N 1.38 1.895 0 C-N-CA 127.491 2.316 . . . . 0.0 111.152 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.76 49.44 0.25 Allowed Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 107.194 -2.362 . . . . 0.0 107.194 170.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.9 mttm -151.28 149.25 29.15 Favored 'General case' 0 C--N 1.367 1.343 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.173 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -104.97 150.11 25.19 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.91 2.484 . . . . 0.0 110.076 -161.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 55.8 mtmt -132.31 138.39 47.8 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.559 1.943 . . . . 0.0 106.035 177.743 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.4 m -124.41 113.43 18.16 Favored 'General case' 0 C--N 1.359 1.001 0 C-N-CA 124.336 1.054 . . . . 0.0 108.685 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.444 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 74.5 m-85 . . . . . 0 N--CA 1.44 -0.964 0 C-N-CA 127.112 2.165 . . . . 0.0 106.311 178.312 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.9 mt . . . . . 0 N--CA 1.445 -0.717 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.6 pt -99.88 -177.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.382 0 C-N-CA 125.367 1.467 . . . . 0.0 109.777 -179.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -127.36 77.58 1.75 Allowed 'General case' 0 C--N 1.362 1.123 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -173.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.7 t -128.63 125.44 63.51 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.535 -2.395 . . . . 0.0 104.535 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -78.27 138.78 38.78 Favored 'General case' 0 C--N 1.367 1.338 0 C-N-CA 127.091 2.156 . . . . 0.0 110.914 -177.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 p -147.96 -176.35 5.24 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-O 121.421 0.629 . . . . 0.0 109.606 -166.865 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.11 27.3 0.42 Allowed 'General case' 0 C--N 1.359 0.984 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 163.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.9 p -174.44 151.25 1.57 Allowed Pre-proline 0 C--N 1.364 1.213 0 C-N-CA 124.669 1.188 . . . . 0.0 108.137 -170.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -69.12 -17.15 40.62 Favored 'Trans proline' 0 C--N 1.361 1.185 1 C-N-CA 125.333 4.022 . . . . 0.0 115.305 165.059 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.02 6.89 33.83 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 126.093 1.757 . . . . 0.0 113.746 172.385 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -113.0 25.42 11.41 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 126.917 2.087 . . . . 0.0 107.366 167.129 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.9 t -145.2 -18.26 0.49 Allowed 'General case' 0 C--N 1.356 0.857 0 C-N-CA 126.329 1.852 . . . . 0.0 109.549 -175.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -88.02 1.26 54.62 Favored 'General case' 0 C--N 1.37 1.496 0 CA-C-N 121.147 1.794 . . . . 0.0 110.464 177.26 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -82.79 -55.34 0.53 Allowed Pre-proline 0 C--N 1.359 1.011 0 C-N-CA 129.346 3.058 . . . . 0.0 110.955 171.155 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.83 -39.09 6.77 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 124.99 3.793 . . . . 0.0 113.79 172.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.8 m -70.18 -29.42 66.29 Favored 'General case' 0 C--N 1.367 1.347 0 C-N-CA 127.601 2.36 . . . . 0.0 114.828 -179.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -88.08 -8.27 55.75 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.922 1.289 . . . . 0.0 113.204 170.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -87.71 -20.42 26.25 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 125.797 1.639 . . . . 0.0 111.157 167.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.3 mt -92.91 -66.47 0.92 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.663 2.385 . . . . 0.0 111.016 177.578 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.42 -7.48 31.6 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.682 2.393 . . . . 0.0 112.447 -167.055 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.56 -80.75 0.52 Allowed Glycine 0 C--N 1.364 2.1 0 C-N-CA 124.953 1.263 . . . . 0.0 113.738 165.318 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.29 -11.2 0.42 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.762 1.625 . . . . 0.0 107.167 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t -105.78 70.59 0.87 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 126.811 2.045 . . . . 0.0 105.842 176.694 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.81 129.39 48.21 Favored 'General case' 0 C--N 1.36 1.033 0 C-N-CA 125.718 1.607 . . . . 0.0 107.042 -174.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 89.37 0.61 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.208 -2.357 . . . . 0.0 107.208 171.39 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.48 115.66 27.87 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 125.253 1.421 . . . . 0.0 109.653 -173.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -128.89 142.97 50.78 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 -171.501 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.7 115.37 9.07 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -174.236 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 92.1 mtp -113.29 121.92 45.86 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 126.28 1.832 . . . . 0.0 106.183 -177.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 78.58 -84.34 0.02 OUTLIER 'General case' 0 C--N 1.38 1.899 0 C-N-CA 127.385 2.274 . . . . 0.0 111.332 173.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -165.11 48.95 0.28 Allowed Glycine 0 N--CA 1.434 -1.471 0 N-CA-C 107.54 -2.224 . . . . 0.0 107.54 171.71 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -151.75 150.86 30.66 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 171.078 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.01 154.05 20.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.016 2.526 . . . . 0.0 110.472 -162.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.479 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 53.2 mtmt -134.74 140.81 46.22 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 126.623 1.969 . . . . 0.0 105.945 177.502 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -125.86 128.02 46.96 Favored 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.417 1.087 . . . . 0.0 108.067 178.247 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.479 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 61.0 m-85 . . . . . 0 N--CA 1.436 -1.141 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -177.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.3 mt . . . . . 0 N--CA 1.443 -0.783 0 N-CA-C 102.832 -3.025 . . . . 0.0 102.832 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.6 pt -100.64 -179.05 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.17 -177.849 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -124.52 73.94 1.29 Allowed 'General case' 0 C--N 1.363 1.156 0 C-N-CA 124.952 1.301 . . . . 0.0 108.397 -173.071 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.96 126.51 64.76 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 174.009 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -84.26 140.96 31.31 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 126.424 1.89 . . . . 0.0 109.146 -175.944 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.96 -178.79 6.38 Favored 'General case' 0 C--N 1.357 0.909 0 CA-C-O 121.552 0.692 . . . . 0.0 110.41 -164.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -154.94 25.19 0.43 Allowed 'General case' 0 C--N 1.358 0.959 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 167.233 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.5 p -173.81 152.07 1.93 Allowed Pre-proline 0 C--N 1.365 1.274 0 C-N-CA 124.653 1.181 . . . . 0.0 107.975 -172.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -69.79 -17.89 37.18 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 125.269 3.98 . . . . 0.0 115.288 164.512 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.2 tptt -78.89 -13.74 59.63 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.676 1.99 . . . . 0.0 114.374 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -90.37 -3.71 57.54 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 127.239 2.215 . . . . 0.0 110.077 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.19 -14.15 12.33 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.285 2.234 . . . . 0.0 109.138 179.725 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -85.14 -3.77 58.92 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 126.071 1.748 . . . . 0.0 111.013 174.874 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -77.83 -59.33 0.8 Allowed Pre-proline 0 N--CA 1.441 -0.906 0 C-N-CA 129.408 3.083 . . . . 0.0 111.907 170.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -71.14 -39.96 3.62 Favored 'Trans proline' 0 C--N 1.364 1.344 0 C-N-CA 125.138 3.892 . . . . 0.0 113.841 175.111 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.72 -29.7 66.04 Favored 'General case' 0 C--N 1.367 1.369 0 C-N-CA 127.487 2.315 . . . . 0.0 114.294 -177.115 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -88.04 -8.19 55.92 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 124.889 1.276 . . . . 0.0 113.143 171.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -87.07 -19.94 27.87 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 125.608 1.563 . . . . 0.0 111.443 165.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.4 mt -92.83 -66.51 0.92 Allowed 'General case' 0 C--N 1.364 1.227 0 C-N-CA 127.666 2.386 . . . . 0.0 111.122 178.211 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -95.53 -10.4 29.77 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.991 2.516 . . . . 0.0 112.247 -167.769 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.35 -79.97 0.37 Allowed Glycine 0 C--N 1.366 2.198 0 C-N-CA 124.863 1.221 . . . . 0.0 113.351 165.517 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.76 -14.01 0.43 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.661 1.584 . . . . 0.0 107.072 -174.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.7 t -104.56 70.1 0.93 Allowed 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.866 2.066 . . . . 0.0 106.146 176.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.1 122.89 38.47 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.134 1.774 . . . . 0.0 106.813 -176.276 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.23 84.01 0.68 Allowed Glycine 0 C--N 1.364 2.097 0 N-CA-C 107.597 -2.201 . . . . 0.0 107.597 171.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.86 115.8 28.45 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.298 1.439 . . . . 0.0 109.689 -171.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -122.57 145.55 48.24 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 102.984 -2.969 . . . . 0.0 102.984 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.89 132.05 28.09 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.747 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 96.8 mtp -105.46 73.39 1.02 Allowed 'General case' 0 C--N 1.359 1.009 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 175.259 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -0.76 68.28 0.0 OUTLIER 'General case' 0 C--N 1.378 1.813 1 C-N-CA 135.193 5.397 . . . . 0.0 118.537 -175.354 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 160.61 -42.24 0.43 Allowed Glycine 0 C--N 1.355 1.624 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -161.799 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -153.96 155.4 35.53 Favored 'General case' 0 C--N 1.37 1.482 0 CA-C-N 119.264 1.532 . . . . 0.0 109.369 179.74 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.8 t -107.02 153.63 22.31 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 129.275 3.03 . . . . 0.0 110.519 -165.266 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -133.37 137.18 45.75 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 126.79 2.036 . . . . 0.0 106.557 176.148 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 63.4 m -121.11 122.7 40.6 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 124.369 1.067 . . . . 0.0 108.721 177.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 . . . . . 0 N--CA 1.436 -1.165 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 178.758 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.8 mt . . . . . 0 N--CA 1.445 -0.7 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.5 pt -103.15 -171.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.289 0 C-N-CA 125.538 1.535 . . . . 0.0 108.936 177.554 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -134.99 91.62 2.77 Favored 'General case' 0 C--N 1.36 1.046 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.46 124.37 48.37 Favored 'Isoleucine or valine' 0 C--N 1.359 1.007 0 N-CA-C 103.251 -2.87 . . . . 0.0 103.251 169.746 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -79.32 134.63 36.61 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 126.689 1.996 . . . . 0.0 109.814 -178.485 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.5 p -143.32 -177.87 5.59 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-O 121.505 0.669 . . . . 0.0 110.052 -163.453 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.3 t -152.42 22.29 0.63 Allowed 'General case' 0 C--N 1.358 0.948 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 168.556 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.2 p -173.49 151.84 2.03 Favored Pre-proline 0 C--N 1.364 1.237 0 C-N-CA 124.455 1.102 . . . . 0.0 108.28 -171.102 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -69.45 -17.79 38.79 Favored 'Trans proline' 0 C--N 1.36 1.177 1 C-N-CA 125.377 4.051 . . . . 0.0 115.153 164.139 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -77.91 -15.28 59.13 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.02 2.128 . . . . 0.0 114.455 172.483 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -89.67 -4.49 57.73 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 127.256 2.222 . . . . 0.0 110.005 171.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.5 t -113.18 -13.49 12.99 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 127.236 2.214 . . . . 0.0 109.245 178.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.4 m -85.29 -4.03 59.02 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 126.128 1.771 . . . . 0.0 111.057 174.6 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -78.61 -58.85 0.73 Allowed Pre-proline 0 C--N 1.356 0.882 0 C-N-CA 129.499 3.119 . . . . 0.0 111.7 171.05 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.21 -42.23 3.11 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 125.253 3.969 . . . . 0.0 113.725 174.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -69.43 -30.77 68.78 Favored 'General case' 0 C--N 1.367 1.367 0 C-N-CA 127.451 2.3 . . . . 0.0 114.888 -177.458 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -87.97 -7.02 57.7 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 124.817 1.247 . . . . 0.0 113.495 171.915 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -85.79 -25.74 26.16 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 125.913 1.685 . . . . 0.0 110.956 165.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.7 mt -89.36 -63.3 1.31 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.553 2.341 . . . . 0.0 111.781 179.706 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.77 -8.84 25.31 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.786 2.434 . . . . 0.0 111.898 -167.495 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.14 -79.94 0.48 Allowed Glycine 0 C--N 1.365 2.189 0 C-N-CA 125.048 1.309 . . . . 0.0 113.551 165.237 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -147.31 -11.45 0.42 Allowed 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.711 1.604 . . . . 0.0 106.98 -175.43 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -105.26 69.51 0.85 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 126.887 2.075 . . . . 0.0 106.132 177.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.22 128.13 46.73 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 125.842 1.657 . . . . 0.0 106.723 -175.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.18 86.03 0.5 Allowed Glycine 0 C--N 1.362 1.975 0 N-CA-C 107.017 -2.433 . . . . 0.0 107.017 170.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.84 113.8 25.91 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 125.14 1.376 . . . . 0.0 109.832 -171.483 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -121.52 144.13 48.89 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 -173.595 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.82 110.76 6.23 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 -178.491 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.7 mtt -115.26 126.06 54.06 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.751 2.02 . . . . 0.0 105.695 -175.797 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 t30 81.67 -85.64 0.02 OUTLIER 'General case' 0 C--N 1.382 1.991 0 C-N-CA 127.32 2.248 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -168.86 50.84 0.22 Allowed Glycine 0 N--CA 1.433 -1.525 0 N-CA-C 106.527 -2.629 . . . . 0.0 106.527 169.363 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -151.41 149.98 29.91 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 174.595 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.4 t -104.94 150.06 25.21 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 127.686 2.395 . . . . 0.0 110.368 -162.785 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -132.36 138.88 47.9 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 126.812 2.045 . . . . 0.0 106.395 177.111 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -123.16 121.99 37.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 124.334 1.053 . . . . 0.0 108.546 178.087 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 . . . . . 0 N--CA 1.437 -1.103 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.156 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 57.1 mt . . . . . 0 N--CA 1.45 -0.431 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.7 pt -100.87 -171.62 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 126.098 1.759 . . . . 0.0 110.111 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -130.99 82.46 2.05 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -176.309 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 t -132.84 128.05 56.44 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.56 -2.755 . . . . 0.0 103.56 172.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -83.03 132.0 35.15 Favored 'General case' 0 C--N 1.364 1.234 0 C-N-CA 126.084 1.754 . . . . 0.0 109.551 -177.328 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -140.83 170.03 16.51 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -166.018 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -152.14 25.91 0.62 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 170.577 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -168.73 149.31 4.23 Favored Pre-proline 0 C--N 1.36 1.032 0 N-CA-C 105.175 -2.158 . . . . 0.0 105.175 -177.686 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -71.43 -15.48 31.06 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.469 3.446 . . . . 0.0 114.394 168.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.43 -11.65 59.96 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.047 2.539 . . . . 0.0 113.736 172.24 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -94.24 -3.93 49.8 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.509 2.324 . . . . 0.0 110.138 173.478 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.5 t -118.12 -13.41 9.95 Favored 'General case' 0 C--N 1.36 1.061 0 C-N-CA 126.886 2.074 . . . . 0.0 108.895 -177.383 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -88.03 1.0 55.26 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 125.897 1.679 . . . . 0.0 110.949 172.651 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -79.69 -58.8 0.61 Allowed Pre-proline 0 C--N 1.359 1.003 0 C-N-CA 129.165 2.986 . . . . 0.0 111.592 170.871 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.23 -40.02 3.49 Favored 'Trans proline' 0 C--N 1.365 1.404 0 C-N-CA 125.024 3.816 . . . . 0.0 113.668 175.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -74.3 -25.67 59.72 Favored 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.591 2.356 . . . . 0.0 114.669 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.13 -8.16 55.84 Favored 'General case' 0 C--N 1.371 1.531 0 CA-C-N 120.15 1.341 . . . . 0.0 113.248 168.122 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -86.91 -19.71 28.45 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 125.565 1.546 . . . . 0.0 111.398 166.56 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.9 mt -93.54 -65.92 0.96 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.575 2.35 . . . . 0.0 111.133 177.606 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -95.41 -6.73 40.23 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 127.797 2.439 . . . . 0.0 112.35 -167.407 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.64 -80.11 0.45 Allowed Glycine 0 C--N 1.365 2.188 0 C-N-CA 125.103 1.335 . . . . 0.0 113.392 165.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -146.68 -5.87 0.54 Allowed 'General case' 0 C--N 1.353 0.745 0 C-N-CA 125.722 1.609 . . . . 0.0 106.903 -177.164 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 t -102.22 73.24 1.34 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.092 2.157 . . . . 0.0 106.907 179.375 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -152.02 116.55 5.06 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.253 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -108.97 72.61 0.2 Allowed Glycine 0 C--N 1.36 1.862 0 N-CA-C 106.481 -2.648 . . . . 0.0 106.481 169.035 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.11 140.54 34.98 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 128.366 2.666 . . . . 0.0 111.484 -167.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -122.13 142.97 49.83 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.787 1.235 . . . . 0.0 107.79 -163.41 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.5 t -117.91 103.73 10.23 Favored 'General case' 0 C--N 1.353 0.732 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 178.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.7 mtp -111.83 121.94 46.43 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 176.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 78.32 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.383 2.051 0 C-N-CA 127.781 2.432 . . . . 0.0 110.706 178.618 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 53.56 0.18 Allowed Glycine 0 N--CA 1.433 -1.5 0 N-CA-C 105.299 -3.121 . . . . 0.0 105.299 168.574 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -151.88 151.82 31.78 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 179.031 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.98 141.2 36.99 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 126.497 1.919 . . . . 0.0 109.907 -163.296 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -120.08 146.64 45.73 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.669 1.988 . . . . 0.0 106.746 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.1 m -117.13 137.7 52.13 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.114 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 . . . . . 0 N--CA 1.434 -1.229 0 N-CA-C 105.112 -2.181 . . . . 0.0 105.112 -178.554 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 98.3 mt . . . . . 0 CA--C 1.512 -0.498 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.3 pt -106.13 -174.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.037 0 C-N-CA 125.751 1.62 . . . . 0.0 110.093 -172.622 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -130.1 82.34 2.06 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -177.206 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 t -130.79 126.17 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.123 0 N-CA-C 103.101 -2.926 . . . . 0.0 103.101 171.457 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -83.23 131.59 35.09 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 125.673 1.589 . . . . 0.0 109.519 -175.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.8 p -138.72 171.84 13.75 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -165.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -152.88 26.73 0.55 Allowed 'General case' 0 C--N 1.356 0.886 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 170.202 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.8 p -170.18 148.39 2.98 Favored Pre-proline 0 C--N 1.36 1.056 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -177.443 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -71.14 -16.29 31.91 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 124.293 3.329 . . . . 0.0 114.801 168.965 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -84.08 -0.36 51.51 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.564 1.946 . . . . 0.0 114.449 171.525 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -97.17 -0.64 46.54 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 127.115 2.166 . . . . 0.0 109.619 168.118 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.6 t -122.69 -12.52 8.08 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 127.013 2.125 . . . . 0.0 108.866 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -87.68 1.11 54.64 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 126.797 2.039 . . . . 0.0 110.16 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -81.4 -58.73 0.48 Allowed Pre-proline 0 N--CA 1.44 -0.957 0 C-N-CA 129.347 3.059 . . . . 0.0 111.096 171.342 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -71.52 -40.33 3.04 Favored 'Trans proline' 0 C--N 1.364 1.393 0 C-N-CA 124.972 3.782 . . . . 0.0 113.534 173.762 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.0 m -71.88 -23.96 61.58 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 127.353 2.261 . . . . 0.0 114.764 -179.325 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -88.09 -9.06 54.46 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.471 1.487 . . . . 0.0 114.117 166.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -88.08 -20.07 26.22 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 125.525 1.53 . . . . 0.0 111.445 167.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.7 mt -98.8 -71.79 0.68 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.437 2.295 . . . . 0.0 110.292 179.368 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.82 40.48 1.56 Allowed 'General case' 0 C--N 1.359 1.004 0 C-N-CA 128.643 2.777 . . . . 0.0 109.963 -169.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.84 83.97 1.5 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 126.212 1.863 . . . . 0.0 116.051 -167.59 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.3 m -154.95 -61.48 0.12 Allowed 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 103.508 -2.775 . . . . 0.0 103.508 171.237 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.7 t -137.35 71.78 1.41 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 104.184 -2.525 . . . . 0.0 104.184 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.45 135.85 34.52 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 125.311 1.444 . . . . 0.0 111.899 177.079 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.51 148.62 18.38 Favored Glycine 0 C--N 1.362 2.002 0 N-CA-C 106.686 -2.566 . . . . 0.0 106.686 164.558 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.98 118.5 4.51 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 -170.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -122.28 147.15 46.58 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.5 t -123.05 107.93 12.33 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 177.763 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.2 mmm -119.54 123.69 44.57 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.755 -2.313 . . . . 0.0 104.755 177.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.08 -84.35 0.02 OUTLIER 'General case' 0 C--N 1.382 1.983 0 C-N-CA 127.645 2.378 . . . . 0.0 110.904 177.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.67 55.92 0.16 Allowed Glycine 0 N--CA 1.433 -1.51 0 N-CA-C 104.808 -3.317 . . . . 0.0 104.808 168.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -152.91 152.18 31.2 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -104.93 138.36 41.29 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.122 2.169 . . . . 0.0 108.882 -166.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -115.56 145.85 42.28 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 125.814 1.646 . . . . 0.0 107.227 169.769 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.7 m -114.42 148.51 37.61 Favored 'General case' 0 C--N 1.357 0.905 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 169.747 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 . . . . . 0 N--CA 1.433 -1.312 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -174.71 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.8 mt . . . . . 0 N--CA 1.443 -0.797 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.8 pt -101.9 -174.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.345 0 C-N-CA 125.435 1.494 . . . . 0.0 108.773 177.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -135.01 86.6 2.27 Favored 'General case' 0 C--N 1.361 1.1 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -179.198 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.2 t -127.69 124.72 63.88 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 N-CA-C 103.573 -2.751 . . . . 0.0 103.573 170.687 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -85.69 129.76 34.74 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 126.191 1.796 . . . . 0.0 109.521 -171.824 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.4 p -138.36 -175.72 4.21 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.36 0.664 . . . . 0.0 109.607 -160.561 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -153.79 26.02 0.5 Allowed 'General case' 0 C--N 1.359 0.982 0 N-CA-C 105.585 -2.005 . . . . 0.0 105.585 164.938 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.5 p -173.87 150.55 1.69 Allowed Pre-proline 0 C--N 1.363 1.162 0 C-N-CA 124.604 1.162 . . . . 0.0 108.241 -171.525 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -68.54 -17.84 43.27 Favored 'Trans proline' 0 C--N 1.36 1.16 1 C-N-CA 125.331 4.021 . . . . 0.0 115.444 164.217 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -75.26 -20.74 59.02 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.015 2.126 . . . . 0.0 114.148 171.713 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.95 1.55 55.28 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.239 2.216 . . . . 0.0 110.541 173.878 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.5 t -117.44 -12.27 10.44 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 127.616 2.366 . . . . 0.0 108.785 177.264 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.4 m -86.02 -4.75 59.24 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 125.934 1.694 . . . . 0.0 111.831 174.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -56.79 1.19 Allowed Pre-proline 0 C--N 1.359 1.016 0 C-N-CA 127.382 2.273 . . . . 0.0 112.634 167.797 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.86 -41.62 2.77 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 124.88 3.72 . . . . 0.0 113.587 176.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.6 m -70.71 -29.66 66.0 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.757 2.423 . . . . 0.0 114.593 -178.059 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -88.12 -6.64 57.79 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.623 1.169 . . . . 0.0 113.332 171.591 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -88.68 -21.11 24.08 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 125.723 1.609 . . . . 0.0 111.068 166.347 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.3 mt -92.39 -65.65 0.99 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 127.525 2.33 . . . . 0.0 111.26 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -97.69 -5.62 34.83 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.964 2.506 . . . . 0.0 112.26 -167.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.26 -79.33 0.52 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.027 1.298 . . . . 0.0 113.891 164.331 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.8 t -152.93 -7.53 0.18 Allowed 'General case' 0 C--N 1.353 0.75 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 -175.345 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.5 t -107.2 68.02 0.71 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.014 2.126 . . . . 0.0 105.528 174.769 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.1 126.62 47.41 Favored 'General case' 0 C--N 1.359 1.016 0 C-N-CA 125.806 1.642 . . . . 0.0 106.87 -176.599 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.24 85.37 0.56 Allowed Glycine 0 C--N 1.361 1.969 0 N-CA-C 107.265 -2.334 . . . . 0.0 107.265 170.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.9 113.02 24.95 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 125.253 1.421 . . . . 0.0 109.539 -171.963 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.08 143.15 49.69 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 -171.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -143.7 115.63 8.31 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -177.028 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' MET . . . . . 0.459 ' HG2' ' HZ2' ' A' ' 35' ' ' LYS . 26.3 mmt -121.0 127.41 51.74 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 -176.164 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 79.72 -85.17 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.544 2.337 . . . . 0.0 110.571 175.386 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.44 51.91 0.21 Allowed Glycine 0 N--CA 1.434 -1.464 0 N-CA-C 106.635 -2.586 . . . . 0.0 106.635 169.717 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -151.61 148.83 28.44 Favored 'General case' 0 C--N 1.369 1.426 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.009 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -105.1 154.05 20.68 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 128.022 2.529 . . . . 0.0 109.963 -163.44 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.496 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 32.4 mtmm -138.21 137.06 37.2 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 178.713 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 57.7 m -120.65 124.42 45.18 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 124.355 1.062 . . . . 0.0 108.179 178.353 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.496 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 59.2 m-85 . . . . . 0 N--CA 1.436 -1.15 0 N-CA-C 105.702 -1.962 . . . . 0.0 105.702 -179.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.9 mt . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 104.199 -2.519 . . . . 0.0 104.199 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.3 pt -101.12 179.52 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.335 0 C-N-CA 125.419 1.488 . . . . 0.0 110.236 -178.757 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -119.81 73.89 0.99 Allowed 'General case' 0 C--N 1.361 1.088 0 C-N-CA 125.412 1.485 . . . . 0.0 108.546 -172.379 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -130.57 126.39 60.59 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 N-CA-C 105.521 -2.029 . . . . 0.0 105.521 175.289 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -83.58 138.18 33.5 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 127.131 2.172 . . . . 0.0 109.611 179.847 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -143.26 -177.75 5.52 Favored 'General case' 0 C--N 1.359 1.006 0 CA-C-O 121.735 0.779 . . . . 0.0 109.844 -165.957 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.9 t -149.08 18.73 0.97 Allowed 'General case' 0 C--N 1.356 0.876 0 C-N-CA 126.06 1.744 . . . . 0.0 106.495 168.566 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 51.9 p -173.67 155.52 2.57 Favored Pre-proline 0 C--N 1.364 1.236 0 C-N-CA 124.673 1.189 . . . . 0.0 108.292 -171.933 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -69.68 -18.59 37.29 Favored 'Trans proline' 0 C--N 1.362 1.24 1 C-N-CA 125.41 4.073 . . . . 0.0 115.025 163.767 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -79.26 -11.22 59.95 Favored 'General case' 0 C--N 1.369 1.431 0 C-N-CA 126.999 2.12 . . . . 0.0 114.768 173.416 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -94.02 -4.79 48.9 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 127.902 2.481 . . . . 0.0 109.974 171.791 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.3 t -111.69 -14.45 13.61 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.468 2.307 . . . . 0.0 108.65 179.605 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -84.79 -1.19 56.04 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 126.655 1.982 . . . . 0.0 110.753 173.038 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -81.77 -57.47 0.52 Allowed Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 129.056 2.942 . . . . 0.0 110.928 172.17 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.33 -45.37 1.85 Allowed 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 124.876 3.717 . . . . 0.0 113.68 172.011 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.88 -29.42 67.71 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 127.416 2.286 . . . . 0.0 115.081 -175.158 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -88.04 -10.83 49.05 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 124.436 1.094 . . . . 0.0 113.429 172.641 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -85.98 -21.22 27.96 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 125.858 1.663 . . . . 0.0 112.086 166.375 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 mt -94.97 -69.05 0.77 Allowed 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.307 2.243 . . . . 0.0 110.942 -178.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -91.4 -27.83 18.07 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 128.035 2.534 . . . . 0.0 111.856 -167.97 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.75 -171.02 15.83 Favored Glycine 0 C--N 1.362 1.997 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.417 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.1 m -71.8 -4.88 30.32 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 128.003 2.521 . . . . 0.0 115.571 -174.897 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.3 t -108.65 64.08 0.61 Allowed 'General case' 0 C--N 1.363 1.193 0 C-N-CA 127.059 2.144 . . . . 0.0 106.411 168.359 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.62 143.35 43.95 Favored 'General case' 0 C--N 1.364 1.205 0 C-N-CA 126.399 1.879 . . . . 0.0 106.924 176.557 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.71 85.49 0.52 Allowed Glycine 0 C--N 1.361 1.927 0 N-CA-C 107.559 -2.216 . . . . 0.0 107.559 171.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.55 111.07 23.06 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 125.246 1.418 . . . . 0.0 109.037 -173.368 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -123.14 141.92 51.45 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 104.181 -2.525 . . . . 0.0 104.181 -171.111 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.82 109.25 6.19 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 -175.662 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -110.15 123.54 49.93 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 127.071 2.148 . . . . 0.0 106.122 -176.862 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.7 m120 78.54 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.554 2.342 . . . . 0.0 111.05 177.076 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.03 49.77 0.25 Allowed Glycine 0 N--CA 1.435 -1.407 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 170.352 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.453 ' HB3' ' HZ2' ' A' ' 33' ' ' LYS . 9.2 mtpm? -150.52 147.99 28.16 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.308 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.94 151.74 23.53 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 127.842 2.457 . . . . 0.0 110.506 -161.97 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -134.34 139.43 45.64 Favored 'General case' 0 C--N 1.361 1.083 0 C-N-CA 126.726 2.01 . . . . 0.0 106.241 177.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.8 m -121.78 125.77 47.3 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 124.375 1.07 . . . . 0.0 108.576 176.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.435 -1.224 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.282 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.444 -0.743 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -99.87 -179.99 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 125.945 1.698 . . . . 0.0 110.38 -176.071 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -123.36 70.9 1.05 Allowed 'General case' 0 C--N 1.363 1.165 0 C-N-CA 125.021 1.328 . . . . 0.0 108.422 -173.17 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.7 t -128.63 132.71 67.57 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.154 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 173.682 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -84.66 140.99 30.93 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 125.869 1.668 . . . . 0.0 109.425 -174.999 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.5 p -147.07 160.76 42.02 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 121.656 0.741 . . . . 0.0 109.289 -169.379 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.3 t -133.13 -0.29 3.36 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 126.589 1.956 . . . . 0.0 108.171 169.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -152.55 157.36 33.59 Favored Pre-proline 0 C--N 1.364 1.205 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -176.087 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -71.99 -16.16 29.1 Favored 'Trans proline' 0 C--N 1.359 1.095 0 C-N-CA 124.418 3.412 . . . . 0.0 114.702 169.446 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.433 ' HA ' ' HG ' ' A' ' 14' ' ' SER . 75.5 mmtt -83.0 -1.71 53.35 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 126.595 1.958 . . . . 0.0 114.579 170.788 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -99.71 -0.77 39.42 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.773 2.429 . . . . 0.0 109.627 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.9 t -124.34 -14.71 6.89 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.89 2.076 . . . . 0.0 108.439 -173.079 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.433 ' HG ' ' HA ' ' A' ' 11' ' ' LYS . 78.4 p -87.92 3.13 49.71 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 125.44 1.496 . . . . 0.0 110.927 173.278 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -77.49 -59.2 0.86 Allowed Pre-proline 0 C--N 1.359 1.001 0 C-N-CA 129.757 3.223 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.23 -38.42 4.85 Favored 'Trans proline' 0 C--N 1.364 1.357 0 C-N-CA 125.121 3.881 . . . . 0.0 113.878 174.156 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -71.68 -29.07 64.19 Favored 'General case' 0 C--N 1.366 1.326 0 C-N-CA 127.647 2.379 . . . . 0.0 114.46 -176.938 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -88.04 -9.0 54.77 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 125.148 1.379 . . . . 0.0 113.135 170.339 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -86.51 -20.53 27.9 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.632 1.573 . . . . 0.0 111.489 166.498 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.4 mt -92.78 -66.63 0.91 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.704 2.402 . . . . 0.0 110.962 177.962 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -95.84 -8.91 32.87 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.972 2.509 . . . . 0.0 112.175 -167.383 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.99 -79.83 0.54 Allowed Glycine 0 C--N 1.364 2.087 0 C-N-CA 125.289 1.423 . . . . 0.0 113.46 165.125 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.1 -6.29 0.44 Allowed 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.064 1.746 . . . . 0.0 106.929 -175.568 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 t -107.02 63.81 0.63 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 126.948 2.099 . . . . 0.0 106.212 177.552 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.73 140.23 52.55 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 125.973 1.709 . . . . 0.0 106.732 -176.875 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.79 -76.07 1.17 Allowed Glycine 0 C--N 1.361 1.962 0 C-N-CA 126.316 1.913 . . . . 0.0 110.943 172.373 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 84.97 98.9 0.04 OUTLIER 'General case' 0 C--N 1.367 1.336 0 C-N-CA 126.823 2.049 . . . . 0.0 110.984 169.024 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -125.44 141.37 52.09 Favored 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -171.552 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.4 t -116.24 124.8 51.12 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -176.171 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.2 mtp -109.34 72.17 0.8 Allowed 'General case' 0 C--N 1.36 1.058 0 N-CA-C 104.43 -2.433 . . . . 0.0 104.43 170.302 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -5.39 72.33 0.0 OUTLIER 'General case' 0 C--N 1.377 1.782 1 C-N-CA 134.63 5.172 . . . . 0.0 118.749 -171.8 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.76 -38.05 0.61 Allowed Glycine 0 C--N 1.354 1.536 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -166.185 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -154.05 157.68 39.38 Favored 'General case' 0 C--N 1.37 1.472 0 CA-C-N 119.45 1.625 . . . . 0.0 108.419 -175.833 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.26 154.62 20.98 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 128.66 2.784 . . . . 0.0 109.56 -166.156 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -129.82 147.49 51.6 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.733 2.013 . . . . 0.0 106.444 173.902 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.5 m -123.14 122.34 38.21 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 175.207 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 . . . . . 0 N--CA 1.44 -0.934 0 C-N-CA 126.541 1.936 . . . . 0.0 106.141 177.383 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 53.2 mt . . . . . 0 N--CA 1.445 -0.722 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.4 pt -106.06 -172.63 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.276 0 C-N-CA 125.129 1.372 . . . . 0.0 109.25 178.873 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -135.04 77.49 1.68 Allowed 'General case' 0 C--N 1.361 1.093 0 C-N-CA 124.325 1.05 . . . . 0.0 108.207 -177.23 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.4 t -121.06 122.52 67.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 172.205 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -80.9 133.98 35.65 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 126.757 2.023 . . . . 0.0 110.185 -172.733 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.16 -176.64 5.18 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 121.399 0.618 . . . . 0.0 110.252 -162.634 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -155.0 26.25 0.43 Allowed 'General case' 0 C--N 1.358 0.971 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 165.428 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.7 p -173.63 149.87 1.67 Allowed Pre-proline 0 C--N 1.364 1.23 0 C-N-CA 124.498 1.119 . . . . 0.0 108.369 -170.751 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -68.69 -16.62 42.3 Favored 'Trans proline' 0 C--N 1.362 1.245 1 C-N-CA 125.505 4.137 . . . . 0.0 115.29 165.479 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.01 7.98 28.7 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 126.128 1.771 . . . . 0.0 113.824 171.006 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -113.06 27.75 9.36 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.09 2.156 . . . . 0.0 107.127 166.417 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.6 t -148.12 -19.63 0.34 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.688 1.595 . . . . 0.0 110.189 -175.111 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -85.99 0.85 52.25 Favored 'General case' 0 C--N 1.369 1.424 0 CA-C-N 121.527 1.967 . . . . 0.0 111.476 175.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -81.31 -56.49 0.6 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.124 2.97 . . . . 0.0 110.807 170.438 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.1 -42.13 4.4 Favored 'Trans proline' 0 C--N 1.368 1.596 0 C-N-CA 124.964 3.776 . . . . 0.0 113.725 173.08 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.0 m -68.08 -31.61 71.35 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.81 2.444 . . . . 0.0 115.188 -177.873 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -88.06 -8.03 56.13 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 124.986 1.314 . . . . 0.0 112.92 172.928 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -87.84 -20.48 25.99 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 125.679 1.592 . . . . 0.0 111.374 166.508 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -92.85 -66.48 0.92 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.54 2.336 . . . . 0.0 111.116 178.706 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.15 -10.26 28.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 127.908 2.483 . . . . 0.0 111.999 -168.197 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.94 0.46 Allowed Glycine 0 C--N 1.364 2.086 0 C-N-CA 125.011 1.291 . . . . 0.0 113.672 164.685 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.52 -10.63 0.47 Allowed 'General case' 0 C--N 1.355 0.806 0 C-N-CA 125.851 1.661 . . . . 0.0 107.266 -174.14 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.07 69.49 0.76 Allowed 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.88 2.072 . . . . 0.0 105.681 176.509 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.89 125.44 41.6 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 125.695 1.598 . . . . 0.0 106.826 -174.768 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.64 87.42 0.57 Allowed Glycine 0 C--N 1.362 2.0 0 N-CA-C 107.276 -2.33 . . . . 0.0 107.276 170.698 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.79 113.54 25.84 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.238 1.415 . . . . 0.0 109.667 -172.236 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -124.43 146.39 48.94 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 103.963 -2.606 . . . . 0.0 103.963 -172.577 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.45 116.1 7.19 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 -175.912 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 68.9 mtt -121.11 126.39 49.65 Favored 'General case' 0 C--N 1.361 1.074 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 -176.04 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.33 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.505 2.322 . . . . 0.0 110.906 173.946 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.88 50.65 0.25 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 107.388 -2.285 . . . . 0.0 107.388 171.105 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -151.99 150.61 30.19 Favored 'General case' 0 C--N 1.368 1.39 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.846 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.0 151.96 23.3 Favored 'General case' 0 C--N 1.36 1.029 0 C-N-CA 128.499 2.72 . . . . 0.0 109.644 -165.305 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -135.4 137.63 42.48 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 179.013 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.68 110.65 14.64 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 124.465 1.106 . . . . 0.0 108.437 -179.321 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.44 -0.929 0 C-N-CA 127.431 2.292 . . . . 0.0 107.189 179.713 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 56.0 mt . . . . . 0 CA--C 1.513 -0.474 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 pt -106.28 -173.21 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 126.229 1.811 . . . . 0.0 109.74 -175.478 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -130.96 79.95 1.92 Allowed 'General case' 0 C--N 1.362 1.112 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -175.971 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.8 127.07 63.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 173.615 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -80.83 131.8 35.42 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 126.133 1.773 . . . . 0.0 110.155 -176.515 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -141.28 171.08 14.56 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -166.316 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.77 22.37 0.69 Allowed 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 174.194 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 p -171.09 149.23 2.63 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -174.781 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -71.84 -15.37 29.8 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 124.22 3.28 . . . . 0.0 114.747 168.685 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -79.3 -11.75 59.94 Favored 'General case' 0 C--N 1.371 1.508 0 C-N-CA 127.231 2.212 . . . . 0.0 114.323 171.525 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -89.77 -5.17 57.22 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 127.335 2.254 . . . . 0.0 110.178 171.357 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.0 t -118.19 -11.78 10.07 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.162 2.185 . . . . 0.0 108.592 -176.685 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -88.0 1.26 54.58 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 126.497 1.919 . . . . 0.0 110.38 171.569 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -80.93 -58.03 0.54 Allowed Pre-proline 0 C--N 1.356 0.89 0 C-N-CA 129.121 2.969 . . . . 0.0 111.301 170.998 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -72.04 -39.44 3.15 Favored 'Trans proline' 0 C--N 1.364 1.377 0 C-N-CA 125.072 3.848 . . . . 0.0 113.582 173.883 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -73.16 -22.69 60.45 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 127.185 2.194 . . . . 0.0 114.571 -179.427 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -88.14 -9.73 52.26 Favored 'General case' 0 C--N 1.374 1.633 0 CA-C-N 120.455 1.48 . . . . 0.0 114.068 166.141 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.39 -19.36 28.21 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.663 1.585 . . . . 0.0 111.334 168.337 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.6 mt -98.69 -71.33 0.69 Allowed 'General case' 0 C--N 1.365 1.25 0 C-N-CA 127.539 2.336 . . . . 0.0 110.221 178.27 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -106.42 42.43 1.28 Allowed 'General case' 0 C--N 1.361 1.072 0 C-N-CA 128.655 2.782 . . . . 0.0 109.955 -169.781 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -79.47 89.04 1.22 Allowed Glycine 0 C--N 1.365 2.171 0 C-N-CA 126.488 1.994 . . . . 0.0 115.939 -169.078 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.0 t -168.06 -61.37 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 103.275 -2.861 . . . . 0.0 103.275 174.308 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -137.28 70.33 1.4 Allowed 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 179.352 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.61 138.93 31.83 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.532 1.533 . . . . 0.0 111.606 177.261 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -106.31 152.66 17.04 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 105.893 -2.883 . . . . 0.0 105.893 165.568 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.31 121.96 4.86 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -171.407 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -124.73 141.27 52.22 Favored 'General case' 0 C--N 1.361 1.071 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 -179.128 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.2 t -117.56 103.37 10.0 Favored 'General case' 0 C--N 1.352 0.71 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.913 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.6 mmt -108.84 121.61 45.46 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 178.857 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.466 3.6 p-10 68.66 -78.06 0.05 OUTLIER 'General case' 0 C--N 1.38 1.905 0 C-N-CA 128.718 2.807 . . . . 0.0 113.95 -177.842 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.28 54.46 0.14 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 105.407 -3.077 . . . . 0.0 105.407 170.664 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -153.92 152.12 30.24 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.2 t -104.99 141.32 36.78 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.637 1.975 . . . . 0.0 109.435 -164.016 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -119.86 147.04 45.17 Favored 'General case' 0 CA--C 1.499 -0.989 0 C-N-CA 126.571 1.948 . . . . 0.0 106.27 172.486 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -116.33 143.47 45.5 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 172.01 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 N--CA 1.434 -1.233 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 -174.617 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 26.3 mt . . . . . 0 N--CA 1.444 -0.745 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.2 pt -102.41 -170.53 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 125.966 1.707 . . . . 0.0 109.429 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.98 76.6 1.63 Allowed 'General case' 0 C--N 1.36 1.056 0 C-N-CA 124.333 1.053 . . . . 0.0 108.378 -175.48 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.0 t -129.59 133.26 65.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.132 0 N-CA-C 103.938 -2.615 . . . . 0.0 103.938 173.301 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.75 134.75 35.48 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 125.847 1.659 . . . . 0.0 110.447 -177.041 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.7 p -140.25 -178.98 5.73 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 -169.227 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 55.4 m -154.93 -53.36 0.09 Allowed 'General case' 0 N--CA 1.432 -1.366 0 N-CA-C 100.969 -3.715 . . . . 0.0 100.969 -163.057 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.6 p -111.25 161.91 23.17 Favored Pre-proline 0 C--N 1.362 1.112 0 C-N-CA 127.647 2.379 . . . . 0.0 108.661 177.893 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -71.88 -16.2 29.45 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.468 3.446 . . . . 0.0 114.535 165.803 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -74.73 -17.05 60.71 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 127.759 2.424 . . . . 0.0 114.146 168.941 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -88.85 -2.93 58.83 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 127.649 2.38 . . . . 0.0 110.485 174.864 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.5 t -118.93 -12.45 9.56 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 128.068 2.547 . . . . 0.0 108.207 179.697 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.3 m -86.2 -0.78 56.52 Favored 'General case' 0 C--N 1.371 1.536 0 C-N-CA 126.317 1.847 . . . . 0.0 111.06 172.867 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -77.87 -58.06 0.92 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.193 2.997 . . . . 0.0 111.795 170.817 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.08 -37.7 4.53 Favored 'Trans proline' 0 C--N 1.363 1.309 0 C-N-CA 125.111 3.874 . . . . 0.0 113.886 174.496 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.54 -27.6 64.28 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.309 2.244 . . . . 0.0 114.298 -179.531 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -88.04 -8.94 54.85 Favored 'General case' 0 C--N 1.371 1.534 0 C-N-CA 125.341 1.456 . . . . 0.0 113.141 170.236 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -87.44 -19.58 27.84 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.791 1.636 . . . . 0.0 111.357 167.182 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 mt -95.11 -67.35 0.86 Allowed 'General case' 0 C--N 1.365 1.252 0 C-N-CA 127.696 2.398 . . . . 0.0 110.94 178.694 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -93.37 -11.21 32.84 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 128.198 2.599 . . . . 0.0 112.032 -168.542 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.19 -81.09 0.44 Allowed Glycine 0 C--N 1.364 2.131 0 C-N-CA 125.067 1.318 . . . . 0.0 113.573 164.224 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.6 m -148.46 -8.59 0.38 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 125.952 1.701 . . . . 0.0 106.927 -173.81 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 t -108.25 63.59 0.61 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.969 2.107 . . . . 0.0 105.386 175.391 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.16 130.73 53.15 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 125.959 1.703 . . . . 0.0 107.878 -172.916 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.74 153.16 18.76 Favored Glycine 0 C--N 1.359 1.829 0 N-CA-C 105.837 -2.905 . . . . 0.0 105.837 161.175 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.21 120.39 5.36 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 105.024 -2.213 . . . . 0.0 105.024 -171.457 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -124.7 137.65 54.34 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 -177.181 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -117.94 106.81 13.34 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.443 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.7 mtp -111.34 121.97 46.62 Favored 'General case' 0 C--N 1.361 1.089 0 N-CA-C 105.312 -2.107 . . . . 0.0 105.312 176.69 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.467 12.0 p30 69.99 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.382 1.981 0 C-N-CA 128.627 2.771 . . . . 0.0 113.704 -179.617 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 53.5 0.17 Allowed Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 105.591 -3.003 . . . . 0.0 105.591 170.686 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -152.47 150.77 29.98 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 105.369 -2.085 . . . . 0.0 105.369 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.99 144.58 31.61 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 126.746 2.018 . . . . 0.0 109.788 -162.73 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.412 ' HE2' ' HH ' ' A' ' 37' ' ' TYR . 39.2 mtpt -122.63 145.45 48.35 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 127.145 2.178 . . . . 0.0 106.119 173.544 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 85.8 m -123.84 127.64 48.34 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 122.25 1.024 . . . . 0.0 109.411 177.202 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.412 ' HH ' ' HE2' ' A' ' 35' ' ' LYS . 46.7 m-85 . . . . . 0 N--CA 1.435 -1.217 0 C-N-CA 127.762 2.425 . . . . 0.0 105.383 -178.962 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 mt . . . . . 0 N--CA 1.443 -0.779 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.0 pt -104.47 -171.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 126.009 1.723 . . . . 0.0 108.936 177.686 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -132.5 84.0 2.12 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.5 t -132.15 125.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 N-CA-C 104.111 -2.552 . . . . 0.0 104.111 173.519 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -76.65 137.53 39.5 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.061 2.144 . . . . 0.0 111.007 -179.238 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.7 p -145.39 178.6 7.98 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.83 0.824 . . . . 0.0 110.492 -165.506 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -149.64 19.5 0.92 Allowed 'General case' 0 C--N 1.355 0.846 0 C-N-CA 126.2 1.8 . . . . 0.0 106.65 169.526 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.1 p -172.92 155.7 3.01 Favored Pre-proline 0 C--N 1.363 1.182 0 C-N-CA 124.853 1.261 . . . . 0.0 107.975 -172.935 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -70.56 -18.44 33.22 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 125.143 3.895 . . . . 0.0 115.181 164.273 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.6 -16.13 59.66 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 127.013 2.125 . . . . 0.0 114.374 172.474 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.5 tp60 -89.53 -4.01 58.09 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.614 2.366 . . . . 0.0 110.186 172.996 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -114.09 -13.1 12.47 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 127.737 2.415 . . . . 0.0 108.982 178.762 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.2 m -85.73 -4.12 59.08 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.173 1.789 . . . . 0.0 111.026 174.997 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -78.02 -57.29 0.96 Allowed Pre-proline 0 N--CA 1.441 -0.892 0 C-N-CA 129.393 3.077 . . . . 0.0 112.092 170.795 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.59 -41.31 3.31 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 125.248 3.965 . . . . 0.0 113.943 173.711 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.16 -27.83 64.84 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 127.313 2.245 . . . . 0.0 114.838 -177.86 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -87.99 -10.5 50.2 Favored 'General case' 0 C--N 1.371 1.519 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 170.781 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.96 -19.75 29.97 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 125.639 1.576 . . . . 0.0 111.539 167.365 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.2 mt -93.7 -66.65 0.91 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 127.645 2.378 . . . . 0.0 111.013 177.758 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -96.91 -8.21 31.37 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.643 2.377 . . . . 0.0 112.326 -167.126 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.84 -80.99 0.51 Allowed Glycine 0 C--N 1.364 2.11 0 C-N-CA 125.015 1.293 . . . . 0.0 113.529 165.308 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.66 -8.67 0.42 Allowed 'General case' 0 C--N 1.354 0.782 0 C-N-CA 125.927 1.691 . . . . 0.0 107.153 -174.81 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -107.13 68.0 0.71 Allowed 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.934 2.093 . . . . 0.0 105.683 176.479 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.27 125.82 42.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 C-N-CA 125.815 1.646 . . . . 0.0 107.078 -173.849 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.28 88.51 0.58 Allowed Glycine 0 C--N 1.359 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.0 107.463 172.025 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.39 116.38 28.92 Favored 'General case' 0 C--N 1.358 0.935 0 C-N-CA 125.043 1.337 . . . . 0.0 109.7 -174.144 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -123.17 141.43 51.98 Favored 'General case' 0 C--N 1.36 1.053 0 N-CA-C 102.317 -3.216 . . . . 0.0 102.317 -174.464 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.92 112.63 10.8 Favored 'General case' 0 CA--C 1.505 -0.787 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.456 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.9 mmt -110.52 119.62 39.76 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 126.806 2.042 . . . . 0.0 106.449 -174.515 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.5 m120 77.26 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.378 1.825 0 C-N-CA 127.452 2.301 . . . . 0.0 111.558 177.492 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -164.55 48.68 0.29 Allowed Glycine 0 C--N 1.352 1.462 0 N-CA-C 106.984 -2.446 . . . . 0.0 106.984 171.47 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -151.22 153.06 34.18 Favored 'General case' 0 C--N 1.366 1.308 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 173.387 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -105.03 152.55 22.6 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 127.458 2.303 . . . . 0.0 110.417 -161.592 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.546 ' HE2' ' HH ' ' A' ' 37' ' ' TYR . 36.6 mtpt -133.92 141.43 47.33 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 127.411 2.285 . . . . 0.0 105.801 178.971 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.2 m -126.95 124.93 40.61 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.595 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.546 ' HH ' ' HE2' ' A' ' 35' ' ' LYS . 62.1 m-85 . . . . . 0 N--CA 1.435 -1.185 0 C-N-CA 126.879 2.072 . . . . 0.0 105.922 179.901 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.5 mt . . . . . 0 N--CA 1.444 -0.734 0 N-CA-C 103.521 -2.77 . . . . 0.0 103.521 . . . . . . . . . 0 0 . 1 . 036 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.7 pt -104.53 -171.8 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.242 0 C-N-CA 125.497 1.519 . . . . 0.0 108.681 177.045 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -135.04 78.63 1.74 Allowed 'General case' 0 C--N 1.36 1.032 0 C-N-CA 123.995 0.918 . . . . 0.0 108.542 -175.774 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 t -126.6 126.38 68.78 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 N-CA-C 104.392 -2.448 . . . . 0.0 104.392 172.677 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HZ3' ' HZ2' ' A' ' 33' ' ' LYS . 64.6 mmtt -88.61 129.7 35.44 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 125.971 1.708 . . . . 0.0 109.132 -171.529 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.9 p -133.85 -174.59 3.57 Favored 'General case' 0 C--N 1.358 0.975 0 C-N-CA 123.797 0.839 . . . . 0.0 109.265 -162.373 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -151.8 22.6 0.69 Allowed 'General case' 0 C--N 1.358 0.949 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 166.609 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 p -175.5 153.39 1.46 Allowed Pre-proline 0 C--N 1.365 1.269 0 C-N-CA 124.59 1.156 . . . . 0.0 108.242 -169.115 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -69.4 -17.89 38.99 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 125.286 3.99 . . . . 0.0 115.113 163.425 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -82.14 -7.33 59.62 Favored 'General case' 0 C--N 1.368 1.41 0 C-N-CA 126.682 1.993 . . . . 0.0 114.658 173.59 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -100.51 6.03 44.21 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.941 2.096 . . . . 0.0 109.156 170.699 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.6 t -120.3 -14.76 8.72 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 127.603 2.361 . . . . 0.0 108.447 177.846 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -84.61 1.09 47.67 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 126.406 1.882 . . . . 0.0 110.876 173.365 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.77 -59.79 0.43 Allowed Pre-proline 0 N--CA 1.44 -0.972 0 C-N-CA 129.454 3.101 . . . . 0.0 110.91 171.682 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.55 -38.91 4.01 Favored 'Trans proline' 0 C--N 1.365 1.415 0 C-N-CA 125.066 3.844 . . . . 0.0 113.561 173.987 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -71.6 -27.68 63.29 Favored 'General case' 0 C--N 1.368 1.397 0 C-N-CA 127.3 2.24 . . . . 0.0 114.378 -178.531 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.17 -6.54 57.8 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.92 1.236 . . . . 0.0 113.936 169.202 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -88.94 -18.8 26.74 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 125.833 1.653 . . . . 0.0 111.403 166.187 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.1 mt -99.46 -73.64 0.62 Allowed 'General case' 0 C--N 1.364 1.211 0 C-N-CA 127.418 2.287 . . . . 0.0 109.859 179.559 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -103.58 45.61 0.95 Allowed 'General case' 0 C--N 1.36 1.048 0 C-N-CA 129.079 2.952 . . . . 0.0 109.565 -173.638 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.59 81.57 1.23 Allowed Glycine 0 C--N 1.364 2.105 0 C-N-CA 126.492 1.996 . . . . 0.0 116.763 -170.778 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p 175.62 -47.26 0.01 OUTLIER 'General case' 0 C--N 1.358 0.945 0 C-N-CA 127.701 2.4 . . . . 0.0 104.856 175.701 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 t -133.11 76.39 1.68 Allowed 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -177.577 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.57 119.36 39.19 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 125.273 1.429 . . . . 0.0 108.624 178.336 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.37 85.71 0.62 Allowed Glycine 0 C--N 1.368 2.313 0 N-CA-C 108.34 -1.904 . . . . 0.0 108.34 170.515 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.86 115.79 28.2 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.332 1.453 . . . . 0.0 109.956 -172.817 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.3 mttm -125.43 143.84 50.8 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 104.564 -2.384 . . . . 0.0 104.564 -172.401 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -140.04 112.23 7.68 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -177.038 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.0 mmm -112.86 124.91 53.69 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.983 2.113 . . . . 0.0 105.814 -177.811 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.17 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.38 1.928 0 C-N-CA 127.55 2.34 . . . . 0.0 110.701 176.4 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.74 50.02 0.24 Allowed Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 169.795 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HZ2' ' HZ3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -149.39 148.11 29.08 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 175.59 . . . . . . . . 3 3 . 1 . 036 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.6 t -105.02 151.34 24.07 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.39 2.276 . . . . 0.0 110.124 -161.944 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 56.3 mtmt -134.0 135.1 43.19 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.489 1.915 . . . . 0.0 106.16 178.551 . . . . . . . . 2 2 . 1 . 036 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -120.36 119.74 33.97 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.441 1.096 . . . . 0.0 108.538 178.53 . . . . . . . . 1 1 . 1 . 036 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.474 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 60.3 m-85 . . . . . 0 N--CA 1.435 -1.188 0 C-N-CA 126.53 1.932 . . . . 0.0 106.219 -178.597 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.1 mt . . . . . 0 N--CA 1.445 -0.713 0 N-CA-C 102.492 -3.151 . . . . 0.0 102.492 . . . . . . . . . 0 0 . 1 . 037 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.6 pt -101.45 -179.29 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 124.721 1.208 . . . . 0.0 110.744 -175.972 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -121.77 78.45 1.46 Allowed 'General case' 0 C--N 1.362 1.15 0 C-N-CA 125.691 1.596 . . . . 0.0 107.27 -176.206 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -132.12 124.59 53.0 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 N-CA-C 103.674 -2.713 . . . . 0.0 103.674 170.888 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -87.96 140.94 28.99 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 126.18 1.792 . . . . 0.0 108.372 -175.739 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.01 -176.21 5.06 Favored 'General case' 0 C--N 1.357 0.919 0 CA-C-O 121.429 0.633 . . . . 0.0 110.059 -162.574 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.0 t -154.33 24.93 0.47 Allowed 'General case' 0 C--N 1.359 1.005 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 164.534 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.0 p -173.53 150.54 1.8 Allowed Pre-proline 0 C--N 1.365 1.271 0 C-N-CA 124.399 1.08 . . . . 0.0 108.524 -170.08 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -69.01 -15.22 39.73 Favored 'Trans proline' 0 C--N 1.362 1.277 1 C-N-CA 125.559 4.173 . . . . 0.0 115.119 164.96 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -88.09 5.18 42.38 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.253 1.821 . . . . 0.0 113.819 171.596 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -113.06 28.2 8.99 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.139 2.176 . . . . 0.0 106.671 168.245 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.0 t -147.46 -21.43 0.38 Allowed 'General case' 0 C--N 1.356 0.863 0 C-N-CA 125.693 1.597 . . . . 0.0 109.95 -175.864 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.7 p -86.27 0.27 54.2 Favored 'General case' 0 C--N 1.372 1.55 0 CA-C-N 121.434 1.924 . . . . 0.0 111.308 175.81 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -79.63 -58.53 0.63 Allowed Pre-proline 0 C--N 1.357 0.922 0 C-N-CA 129.737 3.215 . . . . 0.0 111.472 170.109 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.18 -40.31 4.79 Favored 'Trans proline' 0 C--N 1.365 1.441 1 C-N-CA 125.312 4.008 . . . . 0.0 113.787 174.041 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -70.08 -30.71 68.01 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.751 2.421 . . . . 0.0 114.727 -177.901 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -88.0 -7.17 57.45 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 124.836 1.254 . . . . 0.0 113.2 171.646 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -86.98 -18.92 29.54 Favored 'General case' 0 C--N 1.36 1.022 0 C-N-CA 125.697 1.599 . . . . 0.0 111.322 165.512 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -94.22 -66.63 0.9 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.596 2.358 . . . . 0.0 111.278 178.495 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -94.62 -9.46 34.97 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.998 2.519 . . . . 0.0 112.199 -167.892 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -77.95 0.29 Allowed Glycine 0 C--N 1.364 2.138 0 C-N-CA 124.953 1.264 . . . . 0.0 113.318 165.641 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.435 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.6 t -153.56 -7.43 0.17 Allowed 'General case' 0 C--N 1.355 0.806 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 -175.082 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 24' ' ' SER . . . . . 0.435 ' H ' ' H ' ' A' ' 23' ' ' SER . 18.6 t -108.68 70.93 0.76 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 126.766 2.026 . . . . 0.0 105.596 175.354 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.7 126.12 42.97 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.642 1.577 . . . . 0.0 107.002 -178.077 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.51 83.59 0.59 Allowed Glycine 0 C--N 1.362 1.981 0 N-CA-C 107.053 -2.419 . . . . 0.0 107.053 171.096 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.85 115.04 27.72 Favored 'General case' 0 C--N 1.359 1.0 0 C-N-CA 125.623 1.569 . . . . 0.0 109.748 -171.117 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -124.62 147.12 48.69 Favored 'General case' 0 CA--C 1.485 -1.534 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 -170.487 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.3 131.49 18.41 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -177.619 . . . . . . . . 2 2 . 1 . 037 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -109.43 84.89 2.0 Allowed 'General case' 0 C--N 1.359 1.021 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 171.992 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.271 5.4 p30 1.32 64.93 0.0 OUTLIER 'General case' 0 C--N 1.382 2.005 1 C-N-CA 134.438 5.095 . . . . 0.0 119.273 179.345 . . . . . . . . 3 2 . 1 . 037 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.0 -47.11 0.27 Allowed Glycine 0 C--N 1.354 1.54 0 N-CA-C 108.927 -1.669 . . . . 0.0 108.927 -162.63 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -154.0 154.98 34.72 Favored 'General case' 0 C--N 1.37 1.475 0 CA-C-N 119.398 1.599 . . . . 0.0 109.353 -177.036 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.4 t -107.75 152.43 24.36 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 129.45 3.1 . . . . 0.0 110.196 -166.913 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -133.61 139.84 46.75 Favored 'General case' 0 C--N 1.363 1.165 0 C-N-CA 126.808 2.043 . . . . 0.0 106.425 177.554 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.4 m -123.18 112.92 18.26 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 124.704 1.202 . . . . 0.0 108.816 178.877 . . . . . . . . 1 1 . 1 . 037 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 . . . . . 0 N--CA 1.439 -0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 106.539 177.084 . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 mt . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 . . . . . . . . . 0 0 . 1 . 038 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt -99.28 -174.84 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.212 0 C-N-CA 126.076 1.75 . . . . 0.0 110.113 -176.76 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -128.25 82.91 2.11 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -174.167 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.3 t -134.63 126.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 104.273 -2.491 . . . . 0.0 104.273 172.856 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -80.28 138.75 36.81 Favored 'General case' 0 C--N 1.366 1.315 0 C-N-CA 127.036 2.134 . . . . 0.0 110.253 -178.928 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.7 p -145.1 171.18 14.87 Favored 'General case' 0 C--N 1.356 0.883 0 CA-C-O 121.782 0.801 . . . . 0.0 109.356 -166.888 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -119.85 -22.84 6.64 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 127.04 2.136 . . . . 0.0 108.156 161.184 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.5 p -135.9 162.44 56.8 Favored Pre-proline 0 C--N 1.366 1.288 0 C-N-CA 125.951 1.7 . . . . 0.0 110.046 -169.132 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -69.62 -17.07 38.42 Favored 'Trans proline' 0 C--N 1.361 1.213 1 C-N-CA 125.364 4.043 . . . . 0.0 115.113 163.397 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.32 -11.12 59.94 Favored 'General case' 0 C--N 1.369 1.441 0 C-N-CA 127.101 2.16 . . . . 0.0 114.187 171.0 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -98.23 7.31 46.43 Favored 'General case' 0 C--N 1.372 1.564 0 C-N-CA 127.36 2.264 . . . . 0.0 109.43 172.245 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -123.79 -13.18 7.48 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 127.662 2.385 . . . . 0.0 108.602 177.767 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -85.36 -1.11 56.65 Favored 'General case' 0 C--N 1.371 1.525 0 C-N-CA 126.26 1.824 . . . . 0.0 110.905 173.679 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -81.88 -57.23 0.52 Allowed Pre-proline 0 N--CA 1.44 -0.974 0 C-N-CA 129.31 3.044 . . . . 0.0 111.112 172.827 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.76 -42.41 3.43 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 124.958 3.772 . . . . 0.0 113.962 172.568 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -70.0 -29.45 66.53 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.345 2.258 . . . . 0.0 114.845 -176.661 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -88.04 -8.62 55.31 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.784 1.234 . . . . 0.0 113.303 171.356 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -84.79 -25.88 27.9 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 125.732 1.613 . . . . 0.0 111.182 165.777 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.8 mt -89.78 -63.42 1.29 Allowed 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.516 2.326 . . . . 0.0 111.761 179.934 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -98.53 -8.98 25.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.629 2.371 . . . . 0.0 111.964 -167.645 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -80.95 0.47 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.039 1.304 . . . . 0.0 113.651 164.956 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.3 m -147.51 -9.69 0.42 Allowed 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.858 1.663 . . . . 0.0 106.965 -175.058 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -106.19 69.92 0.82 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 126.946 2.098 . . . . 0.0 105.726 176.326 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 127.15 42.55 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -175.363 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 87.19 0.51 Allowed Glycine 0 C--N 1.36 1.868 0 N-CA-C 107.211 -2.356 . . . . 0.0 107.211 172.219 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.56 117.31 28.36 Favored 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.328 1.451 . . . . 0.0 109.935 -174.089 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -122.99 140.15 53.33 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 102.986 -2.968 . . . . 0.0 102.986 -175.575 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.25 107.53 6.83 Favored 'General case' 0 CA--C 1.501 -0.935 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 -178.115 . . . . . . . . 2 2 . 1 . 038 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 62.4 mtt -110.61 123.89 50.84 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 127.295 2.238 . . . . 0.0 106.042 -174.377 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 80.39 -86.29 0.02 OUTLIER 'General case' 0 C--N 1.38 1.919 0 C-N-CA 127.403 2.281 . . . . 0.0 109.908 177.854 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.77 49.51 0.24 Allowed Glycine 0 N--CA 1.435 -1.429 0 N-CA-C 106.444 -2.662 . . . . 0.0 106.444 170.03 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -151.37 150.58 30.64 Favored 'General case' 0 C--N 1.367 1.335 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 177.822 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.9 t -105.03 150.29 25.08 Favored 'General case' 0 C--N 1.362 1.127 0 C-N-CA 127.137 2.175 . . . . 0.0 110.819 -160.712 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -131.98 144.47 50.83 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 127.437 2.295 . . . . 0.0 105.948 178.092 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.6 m -127.8 127.53 43.68 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 108.168 177.859 . . . . . . . . 1 1 . 1 . 038 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.437 -1.11 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 178.926 . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.9 mt . . . . . 0 N--CA 1.443 -0.786 0 N-CA-C 103.465 -2.791 . . . . 0.0 103.465 . . . . . . . . . 0 0 . 1 . 039 nuclear orig core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.0 pt -104.32 -176.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.261 0 C-N-CA 125.78 1.632 . . . . 0.0 108.906 178.738 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -134.97 104.01 5.8 Favored 'General case' 0 C--N 1.361 1.105 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -178.101 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.3 t -114.44 -50.06 5.14 Favored 'Isoleucine or valine' 0 C--N 1.364 1.228 0 C-N-CA 125.012 1.325 . . . . 0.0 110.851 -172.491 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 82.14 121.39 0.05 OUTLIER 'General case' 0 C--N 1.364 1.211 0 C-N-CA 131.638 3.975 . . . . 0.0 110.45 -167.192 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.8 p -148.0 -177.73 5.9 Favored 'General case' 0 C--N 1.356 0.877 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -166.227 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.1 t -152.71 24.23 0.59 Allowed 'General case' 0 C--N 1.358 0.96 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 167.008 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.2 p -173.04 150.41 1.95 Allowed Pre-proline 0 C--N 1.364 1.218 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 -171.086 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -69.77 -14.28 35.84 Favored 'Trans proline' 0 C--N 1.36 1.149 1 C-N-CA 125.428 4.086 . . . . 0.0 114.949 162.106 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.8 -15.26 59.79 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 127.674 2.389 . . . . 0.0 114.19 170.489 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -97.78 8.8 44.07 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.686 2.395 . . . . 0.0 109.222 173.149 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -124.51 -14.47 6.85 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.827 2.051 . . . . 0.0 109.446 -179.827 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.9 m -86.51 -6.87 58.79 Favored 'General case' 0 C--N 1.367 1.351 0 C-N-CA 125.712 1.605 . . . . 0.0 111.237 175.72 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -82.52 -54.45 0.6 Allowed Pre-proline 0 C--N 1.356 0.866 0 C-N-CA 129.3 3.04 . . . . 0.0 111.956 171.37 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.38 -46.0 4.61 Favored 'Trans proline' 0 C--N 1.367 1.504 1 C-N-CA 125.974 4.45 . . . . 0.0 113.802 172.92 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.05 -30.87 69.3 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.589 2.356 . . . . 0.0 115.353 -178.152 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -88.01 -6.06 58.18 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 124.662 1.185 . . . . 0.0 113.444 172.979 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -88.59 -21.43 24.04 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 126.003 1.721 . . . . 0.0 111.081 165.889 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.7 mt -92.64 -66.65 0.91 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.396 2.278 . . . . 0.0 111.196 178.51 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.1 -7.29 33.04 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 128.283 2.633 . . . . 0.0 112.34 -167.565 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.56 -79.9 0.57 Allowed Glycine 0 C--N 1.364 2.123 0 C-N-CA 125.05 1.31 . . . . 0.0 113.72 164.83 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.51 -9.61 0.42 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.854 1.661 . . . . 0.0 107.198 -175.684 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 t -105.79 69.0 0.8 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 126.875 2.07 . . . . 0.0 106.031 177.37 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.49 124.83 39.28 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.736 1.614 . . . . 0.0 106.985 -174.155 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.24 89.91 0.78 Allowed Glycine 0 C--N 1.363 2.043 0 N-CA-C 107.091 -2.403 . . . . 0.0 107.091 170.065 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.42 111.88 23.82 Favored 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.303 1.441 . . . . 0.0 109.894 -169.719 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -125.54 140.26 52.91 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 104.102 -2.555 . . . . 0.0 104.102 -173.382 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.16 110.28 9.47 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 -174.78 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.7 mmm -122.34 129.57 52.28 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.592 1.957 . . . . 0.0 105.747 -172.539 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m120 76.15 -7.25 1.85 Allowed 'General case' 0 C--N 1.382 1.98 0 C-N-CA 126.793 2.037 . . . . 0.0 115.342 168.972 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.27 42.0 3.58 Favored Glycine 0 C--N 1.362 2.017 0 C-N-CA 126.63 2.062 . . . . 0.0 111.082 -174.114 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.03 156.97 38.33 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 102.968 -2.975 . . . . 0.0 102.968 169.862 . . . . . . . . 2 2 . 1 . 039 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 39.0 t -105.05 155.58 18.85 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 126.305 1.842 . . . . 0.0 109.896 -166.077 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -132.56 134.51 45.04 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 176.95 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.3 m -123.02 117.34 25.25 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 . . . . . 0 N--CA 1.437 -1.084 0 C-N-CA 126.851 2.06 . . . . 0.0 106.21 -179.524 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 38.4 p . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt -127.27 130.56 70.91 Favored 'Isoleucine or valine' 0 C--N 1.363 1.157 0 N-CA-C 104.164 -2.532 . . . . 0.0 104.164 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -108.18 -174.42 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.175 1.39 . . . . 0.0 109.287 177.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -130.98 80.39 1.94 Allowed 'General case' 0 C--N 1.362 1.139 0 C-N-CA 124.984 1.314 . . . . 0.0 107.634 -176.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 t -131.16 129.75 63.09 Favored 'Isoleucine or valine' 0 C--N 1.361 1.093 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 172.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -79.88 135.72 36.5 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.017 1.727 . . . . 0.0 110.56 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.66 171.95 13.48 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -169.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.39 22.88 0.54 Allowed 'General case' 0 C--N 1.355 0.821 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.3 p -171.96 149.72 2.34 Favored Pre-proline 0 C--N 1.36 1.059 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -71.66 -16.88 30.04 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.197 3.264 . . . . 0.0 114.549 168.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -79.09 -10.75 59.91 Favored 'General case' 0 C--N 1.369 1.45 0 C-N-CA 127.516 2.326 . . . . 0.0 114.799 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -89.94 -11.53 41.46 Favored 'General case' 0 C--N 1.37 1.5 0 C-N-CA 127.735 2.414 . . . . 0.0 110.275 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.5 t -109.72 -13.63 14.46 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.289 2.236 . . . . 0.0 108.76 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.5 m -83.69 -1.39 53.94 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.182 1.793 . . . . 0.0 111.445 174.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -80.35 -59.06 0.54 Allowed Pre-proline 0 N--CA 1.44 -0.938 0 C-N-CA 129.545 3.138 . . . . 0.0 111.471 172.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -70.61 -40.35 4.08 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 125.097 3.865 . . . . 0.0 113.703 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.5 m -69.52 -31.45 69.69 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 127.6 2.36 . . . . 0.0 114.696 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -88.14 -7.17 57.31 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 124.837 1.255 . . . . 0.0 113.296 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.1 -19.21 28.87 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.746 1.618 . . . . 0.0 111.468 165.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 mt -93.9 -67.39 0.86 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 127.608 2.363 . . . . 0.0 111.14 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -94.72 -9.54 34.42 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.09 2.556 . . . . 0.0 112.4 -167.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -78.06 0.29 Allowed Glycine 0 C--N 1.365 2.153 0 C-N-CA 124.97 1.271 . . . . 0.0 113.161 166.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.423 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -152.99 -8.52 0.17 Allowed 'General case' 0 C--N 1.355 0.836 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.423 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -105.42 71.12 0.91 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 126.992 2.117 . . . . 0.0 105.748 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.38 123.24 31.21 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 125.684 1.594 . . . . 0.0 106.776 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.19 85.19 0.73 Allowed Glycine 0 C--N 1.364 2.098 0 N-CA-C 107.488 -2.245 . . . . 0.0 107.488 171.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.46 114.39 26.4 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.602 1.561 . . . . 0.0 109.949 -169.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.3 mttp -122.95 142.02 51.28 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -171.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.8 t -122.49 112.52 18.14 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.7 mmm -121.7 123.53 42.1 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.747 -2.316 . . . . 0.0 104.747 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.72 -84.61 0.02 OUTLIER 'General case' 0 C--N 1.381 1.964 0 C-N-CA 127.623 2.369 . . . . 0.0 111.099 176.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.83 54.47 0.19 Allowed Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 105.58 -3.008 . . . . 0.0 105.58 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mttm -154.04 152.19 30.21 Favored 'General case' 0 C--N 1.362 1.149 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.4 t -105.78 144.07 33.04 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 127.518 2.327 . . . . 0.0 109.465 -164.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -124.33 139.53 53.82 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.35 1.86 . . . . 0.0 106.671 174.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 67.7 m -125.2 111.45 15.28 Favored 'General case' 0 CA--C 1.5 -0.967 0 C-N-CA 124.09 0.956 . . . . 0.0 108.498 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -111.61 -148.23 0.43 Allowed 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 127.001 2.12 . . . . 0.0 106.647 178.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -134.62 156.12 49.28 Favored 'General case' 0 C--N 1.358 0.976 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 176.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -90.01 125.27 35.34 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 171.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.329 0 O-C-N 123.399 0.437 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 44.4 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.568 -0.16 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 39.7 mt -129.61 124.99 60.52 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.0 pt -112.88 -171.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 125.578 1.551 . . . . 0.0 108.208 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -131.9 80.29 1.91 Allowed 'General case' 0 C--N 1.363 1.156 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.3 t -130.62 129.52 64.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.082 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 171.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.64 134.26 35.16 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 125.734 1.614 . . . . 0.0 110.448 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.5 p -142.51 170.44 15.7 Favored 'General case' 0 C--N 1.36 1.029 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -167.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.03 22.37 0.76 Allowed 'General case' 0 C--N 1.355 0.843 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -170.42 150.16 3.31 Favored Pre-proline 0 C--N 1.362 1.121 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -71.46 -15.79 30.92 Favored 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 124.196 3.264 . . . . 0.0 114.891 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -82.66 -2.35 53.74 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.947 2.099 . . . . 0.0 114.315 171.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -101.87 7.53 41.56 Favored 'General case' 0 C--N 1.372 1.568 0 C-N-CA 127.195 2.198 . . . . 0.0 109.233 170.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.2 t -128.25 -14.3 4.86 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 127.229 2.212 . . . . 0.0 108.253 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.9 m -84.24 -1.15 54.72 Favored 'General case' 0 C--N 1.372 1.571 0 C-N-CA 126.064 1.746 . . . . 0.0 111.756 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -79.47 -58.67 0.64 Allowed Pre-proline 0 C--N 1.358 0.965 0 C-N-CA 128.926 2.89 . . . . 0.0 111.74 170.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -70.89 -39.66 4.16 Favored 'Trans proline' 0 C--N 1.364 1.366 0 C-N-CA 124.966 3.778 . . . . 0.0 113.522 175.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.6 m -69.42 -31.79 70.35 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.824 2.45 . . . . 0.0 114.679 -178.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -88.06 -6.38 57.97 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.853 1.261 . . . . 0.0 113.184 172.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -88.23 -19.65 26.57 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.814 1.646 . . . . 0.0 111.232 165.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.0 mt -93.38 -67.11 0.88 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 127.636 2.374 . . . . 0.0 111.059 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -94.89 -11.36 28.87 Favored 'General case' 0 C--N 1.362 1.14 0 C-N-CA 128.115 2.566 . . . . 0.0 112.277 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.86 -79.72 0.31 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 124.753 1.168 . . . . 0.0 113.284 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -146.42 -15.1 0.44 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 125.495 1.518 . . . . 0.0 107.097 -175.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.7 t -103.43 72.8 1.16 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 126.94 2.096 . . . . 0.0 106.14 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.0 122.58 30.37 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 125.792 1.637 . . . . 0.0 106.777 -174.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.9 85.25 0.75 Allowed Glycine 0 C--N 1.365 2.156 0 N-CA-C 107.647 -2.181 . . . . 0.0 107.647 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.09 115.07 27.34 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 125.567 1.547 . . . . 0.0 109.896 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -123.37 142.92 50.47 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -171.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.8 t -123.31 114.52 20.31 Favored 'General case' 0 C--N 1.351 0.645 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.45 123.0 39.67 Favored 'General case' 0 C--N 1.358 0.95 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 177.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 77.33 -84.6 0.02 OUTLIER 'General case' 0 C--N 1.381 1.949 0 C-N-CA 127.481 2.312 . . . . 0.0 111.27 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.59 54.52 0.19 Allowed Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 168.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -152.85 152.23 31.31 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.8 t -104.99 145.04 30.98 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 127.514 2.326 . . . . 0.0 109.038 -164.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.415 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 55.6 mtmt -125.97 138.07 53.73 Favored 'General case' 0 CA--C 1.5 -0.968 0 C-N-CA 126.074 1.749 . . . . 0.0 106.624 174.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.0 m -124.36 112.69 17.26 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 124.482 1.113 . . . . 0.0 108.573 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.415 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 70.8 m-85 -114.34 -147.05 0.41 Allowed 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 126.985 2.114 . . . . 0.0 106.396 179.517 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -135.87 155.61 50.05 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 105.821 -1.918 . . . . 0.0 105.821 176.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -88.08 122.13 31.3 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 107.321 -1.362 . . . . 0.0 107.321 172.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.366 0 CA-C-N 116.201 -0.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 87.6 m . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.3 mt -119.42 117.57 54.46 Favored 'Isoleucine or valine' 0 C--N 1.361 1.085 0 N-CA-C 104.066 -2.568 . . . . 0.0 104.066 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 pt -100.8 177.94 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.288 0 C-N-CA 125.188 1.395 . . . . 0.0 110.953 -176.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -113.38 71.4 0.74 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 126.273 1.829 . . . . 0.0 108.34 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t -133.56 143.92 37.48 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.179 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -103.25 139.97 38.01 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 126.827 2.051 . . . . 0.0 107.068 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.4 p -143.28 177.82 8.16 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 -170.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -155.02 22.99 0.44 Allowed 'General case' 0 C--N 1.355 0.815 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 174.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.2 p -174.79 148.01 1.14 Allowed Pre-proline 0 C--N 1.361 1.078 0 N-CA-C 105.235 -2.135 . . . . 0.0 105.235 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -71.81 -13.19 29.32 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.444 3.429 . . . . 0.0 114.157 167.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -73.97 -21.41 60.02 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 128.495 2.718 . . . . 0.0 114.833 170.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -87.4 -15.08 38.82 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.095 2.558 . . . . 0.0 110.743 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.45 -14.22 15.79 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 126.732 2.013 . . . . 0.0 109.955 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 p -87.97 3.33 49.09 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 120.498 -1.376 . . . . 0.0 111.371 174.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -79.16 -59.62 0.6 Allowed Pre-proline 0 C--N 1.361 1.099 0 C-N-CA 129.364 3.066 . . . . 0.0 111.221 169.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.75 -39.42 4.62 Favored 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 125.08 3.853 . . . . 0.0 113.653 174.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.99 -30.65 66.97 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.87 2.468 . . . . 0.0 114.653 -177.18 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -88.1 -7.37 57.05 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.766 1.226 . . . . 0.0 113.281 171.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.66 -18.98 29.95 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.702 1.601 . . . . 0.0 111.468 165.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.2 mt -94.04 -66.8 0.89 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 127.615 2.366 . . . . 0.0 111.153 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -95.25 -9.44 33.17 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 128.001 2.521 . . . . 0.0 112.329 -167.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.39 -79.79 0.32 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 124.868 1.223 . . . . 0.0 113.234 166.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.42 -14.2 0.39 Allowed 'General case' 0 C--N 1.354 0.78 0 C-N-CA 125.543 1.537 . . . . 0.0 106.949 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 t -103.51 72.46 1.14 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.022 2.129 . . . . 0.0 106.369 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.67 124.8 34.51 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 -175.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.71 84.47 0.67 Allowed Glycine 0 C--N 1.364 2.108 0 N-CA-C 107.493 -2.243 . . . . 0.0 107.493 172.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.35 116.15 28.7 Favored 'General case' 0 C--N 1.36 1.032 0 C-N-CA 125.563 1.545 . . . . 0.0 109.923 -170.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -122.99 139.73 53.76 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -171.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -121.01 111.94 18.11 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.89 -1.892 . . . . 0.0 105.89 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -119.91 123.17 42.91 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 77.58 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.382 2.004 0 C-N-CA 127.646 2.378 . . . . 0.0 111.027 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.54 55.95 0.19 Allowed Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 105.219 -3.152 . . . . 0.0 105.219 168.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -153.08 148.31 26.85 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.2 t -106.45 143.36 34.68 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 127.373 2.269 . . . . 0.0 109.529 -165.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.47 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 56.1 mtmt -125.99 142.28 51.59 Favored 'General case' 0 C--N 1.357 0.926 0 C-N-CA 126.575 1.95 . . . . 0.0 107.083 175.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.09 120.56 32.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.687 1.195 . . . . 0.0 108.399 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.47 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 67.9 m-85 -121.5 -147.43 0.39 Allowed 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 178.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -135.08 156.5 48.91 Favored 'General case' 0 C--N 1.358 0.961 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 177.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -90.38 126.8 36.0 Favored 'General case' 0 C--N 1.359 0.986 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 1.296 0 O-C-N 123.427 0.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 80.6 p . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 121.951 0.881 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.6 mt -124.48 116.87 48.85 Favored 'Isoleucine or valine' 0 C--N 1.36 1.039 0 N-CA-C 103.525 -2.769 . . . . 0.0 103.525 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.9 pt -103.63 -176.38 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.279 0 C-N-CA 125.357 1.463 . . . . 0.0 109.128 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.1 m-80 -129.38 79.23 1.9 Allowed 'General case' 0 C--N 1.361 1.102 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -176.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.6 t -129.55 127.83 65.18 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.621 -2.733 . . . . 0.0 103.621 171.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -82.37 133.82 35.23 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 126.183 1.793 . . . . 0.0 109.967 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.2 p -142.65 172.51 12.6 Favored 'General case' 0 C--N 1.357 0.904 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -167.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.0 26.91 0.48 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 170.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -170.4 148.29 2.83 Favored Pre-proline 0 C--N 1.36 1.039 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 -176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -71.34 -16.08 31.25 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 124.199 3.266 . . . . 0.0 114.672 169.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -80.75 -7.28 59.33 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 127.217 2.207 . . . . 0.0 114.636 171.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -94.55 -3.25 50.13 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.195 2.198 . . . . 0.0 109.945 170.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.3 t -116.69 -13.92 10.8 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.28 2.232 . . . . 0.0 108.238 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -83.97 -1.18 54.15 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 126.196 1.799 . . . . 0.0 111.394 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.11 -59.35 0.54 Allowed Pre-proline 0 C--N 1.357 0.931 0 C-N-CA 129.556 3.142 . . . . 0.0 111.322 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -70.68 -40.87 3.5 Favored 'Trans proline' 0 C--N 1.365 1.397 0 C-N-CA 125.079 3.853 . . . . 0.0 113.48 174.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.4 m -69.93 -31.33 69.03 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 127.736 2.415 . . . . 0.0 114.824 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -88.07 -7.37 57.09 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 124.624 1.169 . . . . 0.0 113.338 172.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -87.14 -20.66 26.72 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.649 1.58 . . . . 0.0 111.447 165.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.1 mt -92.74 -66.7 0.91 Allowed 'General case' 0 C--N 1.366 1.303 0 C-N-CA 127.553 2.341 . . . . 0.0 111.086 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -96.59 -7.86 33.28 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 128.107 2.563 . . . . 0.0 112.253 -167.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.81 -80.03 0.5 Allowed Glycine 0 C--N 1.365 2.167 0 C-N-CA 124.936 1.255 . . . . 0.0 113.621 165.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.1 m -147.63 -11.38 0.4 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.74 1.616 . . . . 0.0 107.093 -175.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 t -105.13 69.17 0.84 Allowed 'General case' 0 C--N 1.366 1.298 0 C-N-CA 126.907 2.083 . . . . 0.0 106.142 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.78 126.14 42.91 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 125.741 1.616 . . . . 0.0 106.855 -175.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.412 ' HA3' HD21 ' A' ' 39' ' ' ASN . . . -101.56 85.8 0.57 Allowed Glycine 0 C--N 1.363 2.054 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 170.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.08 112.88 24.53 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 125.327 1.451 . . . . 0.0 109.812 -169.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -121.91 141.78 50.94 Favored 'General case' 0 C--N 1.361 1.088 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -127.96 110.62 12.71 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -118.93 128.11 54.11 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 78.75 -85.54 0.02 OUTLIER 'General case' 0 C--N 1.383 2.023 0 C-N-CA 127.537 2.335 . . . . 0.0 111.023 173.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 55.6 0.18 Allowed Glycine 0 N--CA 1.432 -1.582 0 N-CA-C 106.083 -2.807 . . . . 0.0 106.083 169.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -153.45 151.99 30.5 Favored 'General case' 0 C--N 1.362 1.148 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -106.35 144.98 32.26 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.558 2.343 . . . . 0.0 109.239 -165.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.3 mtmm -127.11 139.02 53.28 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 126.059 1.744 . . . . 0.0 106.835 173.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.7 m -120.66 119.42 32.79 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 124.523 1.129 . . . . 0.0 108.16 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 -118.55 -160.98 0.81 Allowed 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 126.37 1.868 . . . . 0.0 106.008 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -130.97 94.25 3.56 Favored 'General case' 0 C--N 1.36 1.026 0 N-CA-C 106.198 -1.778 . . . . 0.0 106.198 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.412 HD21 ' HA3' ' A' ' 26' ' ' GLY . 69.5 m-80 -139.97 95.31 2.88 Favored 'General case' 0 C--N 1.356 0.878 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 175.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.375 0 CA-C-N 116.093 -0.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 45.5 p . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.6 mt -129.84 125.17 60.28 Favored 'Isoleucine or valine' 0 C--N 1.364 1.222 0 N-CA-C 104.311 -2.477 . . . . 0.0 104.311 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -113.56 -169.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.303 0 C-N-CA 125.631 1.572 . . . . 0.0 107.961 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.97 80.73 1.86 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 124.406 1.083 . . . . 0.0 108.431 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.35 126.97 66.7 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 103.665 -2.717 . . . . 0.0 103.665 172.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -78.56 134.19 37.26 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 126.395 1.878 . . . . 0.0 110.919 -175.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.2 p -145.95 168.82 19.93 Favored 'General case' 0 C--N 1.357 0.929 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -166.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.92 26.37 0.64 Allowed 'General case' 0 C--N 1.357 0.9 0 N-CA-C 105.445 -2.058 . . . . 0.0 105.445 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.7 p -168.85 149.77 4.31 Favored Pre-proline 0 C--N 1.361 1.074 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 -177.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -71.86 -13.46 29.27 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.257 3.304 . . . . 0.0 114.727 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -86.63 6.91 28.71 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 126.855 2.062 . . . . 0.0 113.582 170.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -113.09 22.23 14.56 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 127.38 2.272 . . . . 0.0 107.24 170.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.8 t -144.93 -19.01 0.5 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.4 m -82.58 -1.26 50.21 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 126.347 1.859 . . . . 0.0 111.798 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -82.6 -56.81 0.49 Allowed Pre-proline 0 C--N 1.357 0.919 0 C-N-CA 129.357 3.063 . . . . 0.0 111.424 172.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.34 -40.47 5.94 Favored 'Trans proline' 0 C--N 1.365 1.441 0 C-N-CA 124.939 3.759 . . . . 0.0 113.881 172.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.41 -31.8 70.39 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.698 2.399 . . . . 0.0 114.74 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -88.06 -6.73 57.78 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 124.992 1.317 . . . . 0.0 113.252 172.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -87.44 -19.51 27.92 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.749 1.619 . . . . 0.0 111.392 165.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -93.77 -67.38 0.86 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 127.598 2.359 . . . . 0.0 111.089 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -94.75 -10.61 31.07 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 128.089 2.555 . . . . 0.0 112.269 -167.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.22 -79.97 0.31 Allowed Glycine 0 C--N 1.365 2.142 0 C-N-CA 124.882 1.23 . . . . 0.0 113.106 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.4 ' H ' ' H ' ' A' ' 24' ' ' SER . 74.7 m -146.37 -15.39 0.44 Allowed 'General case' 0 C--N 1.355 0.824 0 C-N-CA 125.569 1.548 . . . . 0.0 107.092 -175.472 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.4 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.1 t -102.85 74.74 1.35 Allowed 'General case' 0 C--N 1.364 1.228 0 C-N-CA 127.005 2.122 . . . . 0.0 106.134 177.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.87 122.95 26.52 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 -174.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.59 86.51 0.76 Allowed Glycine 0 C--N 1.363 2.071 0 N-CA-C 107.565 -2.214 . . . . 0.0 107.565 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.72 116.0 28.21 Favored 'General case' 0 C--N 1.359 1.013 0 C-N-CA 125.504 1.521 . . . . 0.0 109.957 -169.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -123.93 143.41 50.4 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -171.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.3 t -122.83 114.87 21.09 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -125.62 124.15 40.55 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 104.429 -2.434 . . . . 0.0 104.429 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.43 -84.13 0.02 OUTLIER 'General case' 0 C--N 1.383 2.03 0 C-N-CA 127.579 2.352 . . . . 0.0 110.88 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.08 53.14 0.19 Allowed Glycine 0 N--CA 1.433 -1.538 0 N-CA-C 106.059 -2.816 . . . . 0.0 106.059 168.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -152.75 153.92 34.17 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 105.982 -1.858 . . . . 0.0 105.982 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.1 t -105.08 145.33 30.65 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 127.384 2.274 . . . . 0.0 108.73 -164.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.406 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 55.1 mtmt -126.37 138.67 53.58 Favored 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 126.225 1.81 . . . . 0.0 106.447 175.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.5 m -125.33 112.51 16.43 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 124.473 1.109 . . . . 0.0 108.51 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.406 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 70.2 m-85 -113.63 -146.23 0.4 Allowed 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 126.931 2.092 . . . . 0.0 106.546 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -135.68 155.97 49.58 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -89.35 123.8 33.85 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 171.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.401 0 CA-C-N 116.184 -0.462 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 81.2 p . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 121.956 0.884 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.0 mt -127.06 115.19 40.28 Favored 'Isoleucine or valine' 0 C--N 1.36 1.024 0 N-CA-C 102.955 -2.98 . . . . 0.0 102.955 175.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.0 pt -102.0 -177.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.32 0 C-N-CA 125.435 1.494 . . . . 0.0 109.831 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -126.87 76.8 1.67 Allowed 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.815 1.246 . . . . 0.0 108.196 -173.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.2 t -132.11 130.59 60.99 Favored 'Isoleucine or valine' 0 C--N 1.36 1.058 0 N-CA-C 103.957 -2.608 . . . . 0.0 103.957 173.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -80.56 137.11 36.37 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.202 1.801 . . . . 0.0 110.605 -178.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.82 172.51 12.92 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.83 27.85 0.43 Allowed 'General case' 0 C--N 1.355 0.82 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.4 p -171.23 149.14 2.55 Favored Pre-proline 0 C--N 1.36 1.037 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -71.35 -16.78 31.11 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 124.278 3.319 . . . . 0.0 114.775 169.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.62 -6.84 59.38 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.139 2.176 . . . . 0.0 114.647 172.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -94.49 -4.11 48.72 Favored 'General case' 0 C--N 1.37 1.48 0 C-N-CA 127.173 2.189 . . . . 0.0 110.1 170.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.6 t -116.19 -13.45 11.13 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 127.402 2.281 . . . . 0.0 108.048 -178.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.4 m -84.04 0.09 49.6 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 126.367 1.867 . . . . 0.0 111.304 173.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.27 -59.37 0.53 Allowed Pre-proline 0 C--N 1.358 0.94 0 C-N-CA 129.365 3.066 . . . . 0.0 111.14 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.22 -40.49 3.16 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 124.902 3.735 . . . . 0.0 113.509 174.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.79 -31.13 68.88 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 127.535 2.334 . . . . 0.0 114.747 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.09 -7.87 56.32 Favored 'General case' 0 C--N 1.371 1.516 0 C-N-CA 124.59 1.156 . . . . 0.0 113.289 172.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -86.92 -21.16 26.45 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 125.798 1.639 . . . . 0.0 111.528 165.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.7 mt -92.16 -66.46 0.92 Allowed 'General case' 0 C--N 1.366 1.301 0 C-N-CA 127.601 2.36 . . . . 0.0 111.04 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -95.72 -12.14 25.93 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 128.022 2.529 . . . . 0.0 112.106 -167.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.74 -74.59 0.4 Allowed Glycine 0 C--N 1.364 2.133 0 C-N-CA 124.915 1.245 . . . . 0.0 113.836 164.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -141.72 -36.59 0.43 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.584 1.553 . . . . 0.0 107.218 -170.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.6 t -90.5 75.07 6.78 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.86 2.464 . . . . 0.0 108.346 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.32 124.8 35.24 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -176.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.52 87.06 0.63 Allowed Glycine 0 C--N 1.362 1.992 0 N-CA-C 107.545 -2.222 . . . . 0.0 107.545 172.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.26 115.21 27.12 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.286 1.434 . . . . 0.0 109.721 -171.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -123.33 142.27 51.13 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.9 t -123.56 113.87 19.29 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 105.885 -1.894 . . . . 0.0 105.885 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 79.0 mtp -120.38 123.4 42.98 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 175.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 78.58 -84.78 0.02 OUTLIER 'General case' 0 C--N 1.383 2.039 0 C-N-CA 127.512 2.325 . . . . 0.0 110.936 174.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.8 55.28 0.2 Allowed Glycine 0 N--CA 1.434 -1.499 0 N-CA-C 105.806 -2.917 . . . . 0.0 105.806 168.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -154.04 152.5 30.57 Favored 'General case' 0 C--N 1.363 1.18 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.91 146.44 29.98 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 127.438 2.295 . . . . 0.0 109.568 -163.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.427 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 53.1 mtmt -126.13 141.82 51.78 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.294 1.838 . . . . 0.0 106.793 173.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -124.79 122.89 38.73 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.255 1.022 . . . . 0.0 108.261 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.427 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 64.6 m-85 -122.52 -159.72 0.85 Allowed 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 179.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 -132.36 90.68 2.83 Favored 'General case' 0 C--N 1.36 1.045 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -138.99 93.63 2.72 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.298 -2.112 . . . . 0.0 105.298 176.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.356 0 CA-C-N 116.038 -0.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 74.3 p . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 121.952 0.882 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.9 mt -124.89 119.45 56.01 Favored 'Isoleucine or valine' 0 C--N 1.361 1.067 0 N-CA-C 103.51 -2.774 . . . . 0.0 103.51 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.4 pt -104.16 -176.72 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.279 1.431 . . . . 0.0 109.299 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -127.73 77.19 1.73 Allowed 'General case' 0 C--N 1.362 1.115 0 C-N-CA 124.699 1.2 . . . . 0.0 107.8 -175.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.3 t -129.98 129.69 65.87 Favored 'Isoleucine or valine' 0 C--N 1.361 1.087 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 172.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -79.72 137.02 36.92 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 126.451 1.901 . . . . 0.0 110.447 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -145.86 173.43 12.14 Favored 'General case' 0 C--N 1.358 0.965 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.96 27.27 0.42 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 p -172.06 147.32 1.87 Allowed Pre-proline 0 C--N 1.359 1.017 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -71.07 -13.71 31.52 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.609 3.539 . . . . 0.0 114.28 167.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -72.18 -23.27 61.24 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 128.879 2.872 . . . . 0.0 114.438 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -89.42 -8.74 52.4 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 127.555 2.342 . . . . 0.0 110.931 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -110.45 -15.24 13.96 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 126.984 2.114 . . . . 0.0 109.417 -178.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.3 p -87.89 3.01 50.07 Favored 'General case' 0 C--N 1.369 1.422 0 O-C-N 120.179 -1.576 . . . . 0.0 111.156 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -79.87 -58.25 0.63 Allowed Pre-proline 0 C--N 1.359 1.002 0 C-N-CA 129.846 3.258 . . . . 0.0 111.347 170.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -70.15 -40.22 4.95 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 125.119 3.879 . . . . 0.0 113.756 173.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -69.78 -31.68 69.75 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.647 2.379 . . . . 0.0 114.796 -176.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -88.1 -8.0 56.11 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 124.952 1.301 . . . . 0.0 113.16 172.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -86.85 -20.16 27.89 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 125.81 1.644 . . . . 0.0 111.434 165.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.5 mt -92.02 -66.66 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.692 2.397 . . . . 0.0 111.097 177.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -96.9 -11.21 25.02 Favored 'General case' 0 C--N 1.362 1.129 0 C-N-CA 127.914 2.486 . . . . 0.0 112.288 -166.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -78.55 0.43 Allowed Glycine 0 C--N 1.363 2.08 0 C-N-CA 124.933 1.254 . . . . 0.0 113.097 166.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.47 -6.96 0.4 Allowed 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.764 1.625 . . . . 0.0 107.201 -175.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.7 t -107.39 64.46 0.63 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 126.77 2.028 . . . . 0.0 106.156 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -124.6 127.0 46.71 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 125.944 1.697 . . . . 0.0 107.227 -174.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.448 ' HA3' HD21 ' A' ' 39' ' ' ASN . . . -103.92 87.74 0.58 Allowed Glycine 0 C--N 1.362 1.983 0 N-CA-C 107.023 -2.431 . . . . 0.0 107.023 169.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.04 114.75 26.59 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 125.227 1.411 . . . . 0.0 109.868 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -124.42 140.53 52.86 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 -171.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.3 t -124.33 119.2 28.59 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.5 mtt -127.42 126.98 43.37 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.05 -84.24 0.02 OUTLIER 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.553 2.341 . . . . 0.0 110.82 173.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.3 55.94 0.17 Allowed Glycine 0 N--CA 1.432 -1.586 0 N-CA-C 106.088 -2.805 . . . . 0.0 106.088 167.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -154.0 151.54 29.49 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.5 t -106.81 146.69 30.6 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.543 2.337 . . . . 0.0 109.367 -163.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.464 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 31.0 mtmm -127.29 139.12 53.11 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 106.701 174.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.8 m -123.81 116.15 22.51 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 124.458 1.103 . . . . 0.0 108.043 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.464 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 63.3 m-85 -114.55 -168.05 1.31 Allowed 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 126.51 1.924 . . . . 0.0 106.883 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -124.42 88.97 2.99 Favored 'General case' 0 C--N 1.359 1.012 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.448 HD21 ' HA3' ' A' ' 26' ' ' GLY . 69.7 m-80 -137.68 95.61 3.09 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 177.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.376 0 CA-C-N 116.054 -0.521 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 122.026 0.917 . . . . 0.0 109.956 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 45.5 mt -119.67 119.37 60.21 Favored 'Isoleucine or valine' 0 C--N 1.36 1.06 0 N-CA-C 103.728 -2.693 . . . . 0.0 103.728 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 33.6 pt -103.21 -173.11 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.39 1.476 . . . . 0.0 109.015 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -134.95 78.16 1.72 Allowed 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.244 1.018 . . . . 0.0 108.379 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.3 t -128.31 128.1 68.05 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.725 -2.694 . . . . 0.0 103.725 172.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -79.2 134.62 36.68 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.354 1.861 . . . . 0.0 110.472 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -144.39 169.47 17.86 Favored 'General case' 0 C--N 1.358 0.961 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -167.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -148.8 18.86 1.01 Allowed 'General case' 0 C--N 1.353 0.733 0 C-N-CA 125.874 1.67 . . . . 0.0 106.515 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.7 p -169.6 151.19 4.25 Favored Pre-proline 0 C--N 1.36 1.033 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 -175.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -71.26 -15.15 31.68 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 124.597 3.531 . . . . 0.0 114.326 166.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -73.63 -19.61 60.81 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.306 2.642 . . . . 0.0 114.744 170.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.0 tp60 -88.96 -13.76 38.2 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.415 2.686 . . . . 0.0 110.883 175.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.7 t -106.29 -13.79 15.29 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.11 2.164 . . . . 0.0 109.407 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.2 p -87.82 4.41 44.61 Favored 'General case' 0 C--N 1.368 1.398 0 O-C-N 120.303 -1.498 . . . . 0.0 111.251 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.04 -59.33 0.63 Allowed Pre-proline 0 C--N 1.361 1.107 0 C-N-CA 129.279 3.032 . . . . 0.0 111.139 169.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.72 -39.41 4.68 Favored 'Trans proline' 0 C--N 1.366 1.484 0 C-N-CA 125.089 3.859 . . . . 0.0 113.651 174.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.7 m -70.78 -30.32 66.77 Favored 'General case' 0 C--N 1.368 1.398 0 C-N-CA 127.57 2.348 . . . . 0.0 114.818 -176.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -88.08 -8.85 54.89 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 124.787 1.235 . . . . 0.0 112.682 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -86.43 -19.93 28.91 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 125.731 1.612 . . . . 0.0 111.696 166.098 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.1 mt -94.01 -67.9 0.83 Allowed 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.521 2.328 . . . . 0.0 110.873 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -93.99 -10.47 33.51 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 128.169 2.587 . . . . 0.0 112.2 -168.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.1 -79.71 0.42 Allowed Glycine 0 C--N 1.364 2.136 0 C-N-CA 124.897 1.237 . . . . 0.0 113.69 164.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.3 m -145.2 -15.39 0.51 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.681 1.592 . . . . 0.0 107.284 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.0 t -105.6 72.66 0.98 Allowed 'General case' 0 C--N 1.364 1.239 0 C-N-CA 126.835 2.054 . . . . 0.0 105.89 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.43 121.9 30.08 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 125.687 1.595 . . . . 0.0 106.864 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.97 84.27 0.64 Allowed Glycine 0 C--N 1.365 2.178 0 N-CA-C 107.672 -2.171 . . . . 0.0 107.672 171.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.04 117.08 29.66 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.532 1.533 . . . . 0.0 110.141 -170.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -124.64 140.33 53.04 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 -171.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.2 t -124.62 119.4 28.92 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 -178.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.402 ' HG2' ' HZ2' ' A' ' 35' ' ' LYS . 26.2 mmt -129.39 126.3 38.51 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 103.857 -2.646 . . . . 0.0 103.857 176.093 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.2 m120 78.6 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.008 0 C-N-CA 127.564 2.346 . . . . 0.0 110.968 174.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.34 55.64 0.18 Allowed Glycine 0 N--CA 1.432 -1.567 0 N-CA-C 106.069 -2.812 . . . . 0.0 106.069 168.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -154.01 153.16 31.46 Favored 'General case' 0 C--N 1.362 1.141 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -107.54 146.07 32.33 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 127.596 2.358 . . . . 0.0 109.092 -164.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.503 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 28.1 mtmm -127.65 139.47 52.7 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.391 1.876 . . . . 0.0 106.451 174.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -121.58 118.72 29.94 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 124.563 1.145 . . . . 0.0 108.149 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.503 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 64.5 m-85 -119.5 -149.18 0.43 Allowed 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 179.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -134.96 154.92 51.53 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -88.48 122.37 31.89 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 172.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 5.3 t . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 85.4 mt -104.88 124.34 59.48 Favored 'Isoleucine or valine' 0 C--N 1.367 1.356 0 C-N-CA 126.777 2.031 . . . . 0.0 105.82 -174.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.6 pt -102.47 179.22 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.082 0 C-N-CA 125.272 1.429 . . . . 0.0 111.113 -171.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -120.41 67.96 0.85 Allowed 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.741 1.616 . . . . 0.0 108.42 -172.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.2 t -125.91 129.64 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -87.68 133.73 33.78 Favored 'General case' 0 C--N 1.363 1.185 0 C-N-CA 125.98 1.712 . . . . 0.0 108.991 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -138.5 175.26 9.72 Favored 'General case' 0 C--N 1.358 0.947 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -168.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -154.54 23.12 0.47 Allowed 'General case' 0 C--N 1.356 0.855 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.3 p -173.68 149.39 1.58 Allowed Pre-proline 0 C--N 1.361 1.1 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -173.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -71.4 -16.34 31.01 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.189 3.259 . . . . 0.0 114.617 168.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -78.31 -13.75 59.71 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 127.624 2.37 . . . . 0.0 114.897 173.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -88.2 -11.26 47.23 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 127.962 2.505 . . . . 0.0 110.324 171.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -110.13 -12.34 14.5 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 127.322 2.249 . . . . 0.0 108.758 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.6 m -85.68 -1.65 57.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.535 1.934 . . . . 0.0 111.12 173.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -79.08 -59.27 0.63 Allowed Pre-proline 0 C--N 1.359 0.979 0 C-N-CA 129.203 3.001 . . . . 0.0 111.319 171.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.22 -41.9 2.3 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 125.004 3.803 . . . . 0.0 113.551 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.32 -29.05 65.66 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.656 2.383 . . . . 0.0 114.813 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -88.0 -8.39 55.7 Favored 'General case' 0 C--N 1.37 1.476 0 CA-C-N 120.069 1.304 . . . . 0.0 113.545 170.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -86.55 -20.74 27.53 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.694 1.598 . . . . 0.0 111.536 166.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.9 mt -93.96 -66.21 0.93 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.549 2.339 . . . . 0.0 111.141 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -95.4 -7.76 37.5 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.812 2.445 . . . . 0.0 112.212 -167.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.8 -78.77 0.37 Allowed Glycine 0 C--N 1.366 2.196 0 C-N-CA 125.124 1.345 . . . . 0.0 113.334 165.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.9 t -153.12 -7.92 0.17 Allowed 'General case' 0 C--N 1.354 0.787 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.3 t -104.93 69.7 0.88 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.103 2.161 . . . . 0.0 105.687 175.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.99 127.49 41.76 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 125.709 1.604 . . . . 0.0 106.691 -175.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.56 89.57 0.66 Allowed Glycine 0 C--N 1.36 1.91 0 N-CA-C 107.084 -2.406 . . . . 0.0 107.084 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.11 116.52 29.11 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 125.144 1.378 . . . . 0.0 109.736 -171.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -123.44 141.73 51.7 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 -173.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -123.03 110.29 15.16 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 -178.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 49.9 mtt -117.38 122.8 44.83 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 79.12 -85.34 0.02 OUTLIER 'General case' 0 C--N 1.383 2.022 0 C-N-CA 127.561 2.345 . . . . 0.0 110.204 175.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.28 56.49 0.18 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 105.218 -3.153 . . . . 0.0 105.218 169.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -152.37 149.88 29.09 Favored 'General case' 0 C--N 1.362 1.135 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.0 t -105.83 142.33 35.74 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.238 2.215 . . . . 0.0 109.086 -165.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -120.82 146.14 46.86 Favored 'General case' 0 CA--C 1.5 -0.96 0 C-N-CA 126.219 1.807 . . . . 0.0 107.168 172.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.88 142.84 48.31 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -138.67 -160.6 1.08 Allowed 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 103.631 -2.729 . . . . 0.0 103.631 177.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -132.36 96.66 3.91 Favored 'General case' 0 C--N 1.358 0.974 0 N-CA-C 105.845 -1.909 . . . . 0.0 105.845 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -138.31 98.59 3.64 Favored 'General case' 0 C--N 1.356 0.868 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.382 0 CA-C-N 116.103 -0.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 40.1 p . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 38.1 mt -125.2 128.84 73.13 Favored 'Isoleucine or valine' 0 C--N 1.363 1.166 0 N-CA-C 104.377 -2.453 . . . . 0.0 104.377 -176.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -107.65 -174.88 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.295 0 C-N-CA 125.143 1.377 . . . . 0.0 109.189 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 -131.63 80.05 1.91 Allowed 'General case' 0 C--N 1.361 1.101 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.8 t -129.16 126.46 64.2 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -85.75 138.19 32.27 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.902 1.681 . . . . 0.0 108.872 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 p -146.74 171.07 15.71 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -162.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.63 21.73 0.71 Allowed 'General case' 0 C--N 1.355 0.817 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 174.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.8 p -170.15 149.96 3.44 Favored Pre-proline 0 C--N 1.36 1.036 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -70.98 -17.37 32.09 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.443 3.429 . . . . 0.0 114.55 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -79.8 -10.86 59.83 Favored 'General case' 0 C--N 1.369 1.455 0 C-N-CA 127.353 2.261 . . . . 0.0 114.923 173.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -89.03 -10.64 46.77 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 127.685 2.394 . . . . 0.0 110.248 170.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.5 t -108.83 -14.6 14.55 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.193 2.197 . . . . 0.0 108.646 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.6 m -83.97 -0.68 52.52 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 126.208 1.803 . . . . 0.0 111.358 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -79.15 -59.65 0.6 Allowed Pre-proline 0 C--N 1.358 0.969 0 C-N-CA 128.85 2.86 . . . . 0.0 111.277 170.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.04 -42.51 3.05 Favored 'Trans proline' 0 C--N 1.366 1.451 0 C-N-CA 125.017 3.812 . . . . 0.0 113.423 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.5 -32.59 72.67 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 127.442 2.297 . . . . 0.0 115.135 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -88.06 -7.41 57.04 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 124.429 1.092 . . . . 0.0 112.605 173.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -87.82 -22.57 24.41 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 125.795 1.638 . . . . 0.0 111.73 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.06 -66.68 0.91 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 127.527 2.331 . . . . 0.0 110.964 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -91.95 -18.65 23.4 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 128.21 2.604 . . . . 0.0 111.685 -169.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.96 -75.21 0.46 Allowed Glycine 0 C--N 1.365 2.192 0 C-N-CA 125.081 1.324 . . . . 0.0 113.211 165.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.3 m -144.95 -9.48 0.6 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.227 1.811 . . . . 0.0 107.694 -171.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.6 t -111.31 61.99 0.61 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 126.353 1.861 . . . . 0.0 106.216 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.8 124.09 45.27 Favored 'General case' 0 C--N 1.358 0.959 0 C-N-CA 126.063 1.745 . . . . 0.0 107.458 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.11 85.77 0.47 Allowed Glycine 0 C--N 1.362 2.012 0 N-CA-C 106.652 -2.579 . . . . 0.0 106.652 168.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.84 111.96 23.72 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 125.224 1.409 . . . . 0.0 110.094 -168.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -119.68 146.23 45.77 Favored 'General case' 0 CA--C 1.497 -1.089 0 C-N-CA 125.194 1.397 . . . . 0.0 107.268 -171.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.5 t -129.97 114.87 16.37 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.1 mmt -126.78 127.02 44.39 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 176.496 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 80.11 -83.65 0.02 OUTLIER 'General case' 0 C--N 1.383 2.048 0 C-N-CA 127.469 2.308 . . . . 0.0 109.946 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.26 56.83 0.12 Allowed Glycine 0 N--CA 1.431 -1.675 0 N-CA-C 105.42 -3.072 . . . . 0.0 105.42 168.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -153.68 152.08 30.4 Favored 'General case' 0 C--N 1.364 1.198 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -106.19 142.72 35.41 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 127.713 2.405 . . . . 0.0 109.314 -164.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.459 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 27.2 mtmm -124.87 138.01 54.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 126.045 1.738 . . . . 0.0 106.887 173.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.1 m -121.27 110.71 16.47 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 124.428 1.091 . . . . 0.0 108.103 178.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.459 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 61.5 m-85 -107.73 -173.78 2.37 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 126.744 2.018 . . . . 0.0 107.858 -179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -118.27 86.12 2.47 Favored 'General case' 0 C--N 1.361 1.071 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -134.58 97.26 3.75 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 105.893 -1.892 . . . . 0.0 105.893 178.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.394 0 CA-C-N 116.089 -0.505 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 65.6 p . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.3 mt -104.99 115.3 46.61 Favored 'Isoleucine or valine' 0 C--N 1.365 1.255 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 -171.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.9 pt -101.67 -178.41 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.221 0 C-N-CA 125.819 1.648 . . . . 0.0 109.852 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.71 76.63 1.69 Allowed 'General case' 0 C--N 1.362 1.132 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.4 t -127.23 126.08 67.23 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 172.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -83.49 132.54 34.94 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.962 1.705 . . . . 0.0 110.151 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -141.66 171.56 13.89 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -165.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.43 26.93 0.51 Allowed 'General case' 0 C--N 1.356 0.87 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 170.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -170.13 148.76 3.11 Favored Pre-proline 0 C--N 1.359 1.006 0 N-CA-C 105.196 -2.15 . . . . 0.0 105.196 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -71.58 -15.93 30.51 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.216 3.278 . . . . 0.0 114.764 169.452 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -79.43 -11.04 59.92 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.493 2.317 . . . . 0.0 114.356 171.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -92.23 -2.23 56.62 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 127.216 2.207 . . . . 0.0 110.238 171.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.81 -13.55 9.53 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.254 2.221 . . . . 0.0 108.243 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -85.1 -0.84 55.83 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 126.077 1.751 . . . . 0.0 111.251 174.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.9 mmmm -81.45 -57.31 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.927 0 C-N-CA 128.915 2.886 . . . . 0.0 111.282 171.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -70.04 -41.36 3.98 Favored 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 124.796 3.664 . . . . 0.0 113.832 173.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.75 -30.59 68.22 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.522 2.329 . . . . 0.0 114.824 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.05 -7.62 56.74 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 124.747 1.219 . . . . 0.0 113.071 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.69 -20.26 26.51 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 125.656 1.582 . . . . 0.0 111.706 165.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.0 mt -94.9 -67.86 0.83 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.499 2.32 . . . . 0.0 110.967 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -91.65 -13.22 32.18 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 128.373 2.669 . . . . 0.0 111.789 -169.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.95 -75.63 0.29 Allowed Glycine 0 C--N 1.365 2.148 0 C-N-CA 124.916 1.246 . . . . 0.0 113.942 162.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.41 -34.76 0.48 Allowed 'General case' 0 C--N 1.354 0.795 0 C-N-CA 125.543 1.537 . . . . 0.0 107.071 -170.054 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 t -92.61 78.93 4.86 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.877 2.471 . . . . 0.0 107.778 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -132.82 120.13 21.17 Favored 'General case' 0 C--N 1.361 1.077 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.32 85.53 0.73 Allowed Glycine 0 C--N 1.363 2.076 0 N-CA-C 107.638 -2.185 . . . . 0.0 107.638 172.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.18 117.6 30.26 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.65 1.58 . . . . 0.0 110.095 -169.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -123.99 141.39 52.09 Favored 'General case' 0 C--N 1.362 1.146 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -171.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.5 t -122.68 111.0 16.22 Favored 'General case' 0 C--N 1.351 0.671 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.3 mtp -117.81 123.67 46.52 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 105.109 -2.182 . . . . 0.0 105.109 175.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.58 -84.3 0.02 OUTLIER 'General case' 0 C--N 1.383 2.026 0 C-N-CA 127.641 2.376 . . . . 0.0 110.826 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.04 56.07 0.18 Allowed Glycine 0 N--CA 1.432 -1.571 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -154.0 152.36 30.44 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 175.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.9 t -105.58 145.5 30.88 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 127.262 2.225 . . . . 0.0 109.574 -164.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -126.04 143.62 51.04 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 126.225 1.81 . . . . 0.0 106.964 173.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -127.59 116.6 20.58 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 124.949 1.3 . . . . 0.0 108.298 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -117.58 -146.45 0.4 Allowed 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 126.429 1.892 . . . . 0.0 105.935 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.21 154.69 51.51 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -86.64 120.43 27.94 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 172.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.33 0 CA-C-N 116.187 -0.46 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 77.0 p . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 122.015 0.912 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.4 mt -126.49 117.99 49.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 175.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 pt -103.42 -171.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.273 0 C-N-CA 125.442 1.497 . . . . 0.0 109.335 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -133.48 77.71 1.74 Allowed 'General case' 0 C--N 1.361 1.077 0 C-N-CA 124.464 1.106 . . . . 0.0 108.685 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -129.49 127.7 65.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 171.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -82.43 132.78 35.2 Favored 'General case' 0 C--N 1.366 1.289 0 C-N-CA 125.964 1.706 . . . . 0.0 109.9 -176.657 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.0 p -141.38 166.62 24.25 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 123.821 1.772 . . . . 0.0 110.079 -165.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 83.3 m -128.91 -49.11 1.23 Allowed 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 129.634 3.174 . . . . 0.0 104.699 -174.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.9 p -114.23 163.24 19.64 Favored Pre-proline 0 C--N 1.36 1.058 0 C-N-CA 127.443 2.297 . . . . 0.0 109.011 -177.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -72.6 -17.31 26.51 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.546 3.497 . . . . 0.0 114.409 164.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.68 -14.98 60.36 Favored 'General case' 0 C--N 1.372 1.57 0 C-N-CA 127.681 2.392 . . . . 0.0 114.469 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -84.81 -14.63 47.46 Favored 'General case' 0 C--N 1.37 1.491 0 C-N-CA 128.399 2.679 . . . . 0.0 110.62 172.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -107.46 -14.08 14.94 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 127.343 2.257 . . . . 0.0 109.077 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.7 m -84.52 -2.06 56.75 Favored 'General case' 0 C--N 1.369 1.413 0 C-N-CA 126.067 1.747 . . . . 0.0 111.386 174.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -80.43 -57.29 0.63 Allowed Pre-proline 0 N--CA 1.442 -0.866 0 C-N-CA 129.042 2.937 . . . . 0.0 111.5 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.63 -41.52 4.37 Favored 'Trans proline' 0 C--N 1.365 1.434 0 C-N-CA 124.984 3.789 . . . . 0.0 114.049 173.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.75 -30.9 68.59 Favored 'General case' 0 C--N 1.368 1.379 0 C-N-CA 127.579 2.352 . . . . 0.0 114.815 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -88.08 -7.7 56.58 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 124.921 1.288 . . . . 0.0 113.33 172.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -86.99 -20.12 27.71 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 125.654 1.582 . . . . 0.0 111.436 165.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.4 mt -92.39 -66.51 0.92 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 127.51 2.324 . . . . 0.0 111.168 177.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.2 -8.83 29.04 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 128.032 2.533 . . . . 0.0 112.245 -166.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.64 0.46 Allowed Glycine 0 C--N 1.364 2.109 0 C-N-CA 125.042 1.306 . . . . 0.0 113.377 165.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.42 -8.65 0.38 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 125.843 1.657 . . . . 0.0 107.143 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.1 t -106.56 67.78 0.73 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 126.822 2.049 . . . . 0.0 105.933 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.74 126.26 43.16 Favored 'General case' 0 CA--C 1.5 -0.969 0 C-N-CA 125.748 1.619 . . . . 0.0 106.946 -174.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.414 ' HA3' HD21 ' A' ' 39' ' ' ASN . . . -102.79 88.07 0.63 Allowed Glycine 0 C--N 1.361 1.97 0 N-CA-C 107.372 -2.291 . . . . 0.0 107.372 170.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.97 114.17 25.86 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 125.048 1.339 . . . . 0.0 109.84 -171.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.65 141.95 48.88 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -173.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.0 t -122.2 110.37 15.64 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -120.9 123.42 42.47 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.02 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.591 2.356 . . . . 0.0 110.901 177.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.91 54.62 0.17 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.631 -2.988 . . . . 0.0 105.631 168.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -152.55 152.3 31.71 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.6 t -105.15 144.29 32.16 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.16 2.184 . . . . 0.0 109.417 -165.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -125.28 139.69 53.49 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 126.463 1.905 . . . . 0.0 107.181 173.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.9 m -123.76 118.97 28.39 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.361 1.064 . . . . 0.0 108.319 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -117.75 -161.63 0.83 Allowed 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 126.569 1.948 . . . . 0.0 106.381 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -129.54 94.32 3.74 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.414 HD21 ' HA3' ' A' ' 26' ' ' GLY . 69.5 m-80 -139.98 92.01 2.51 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.09 -2.189 . . . . 0.0 105.09 175.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.417 0 CA-C-N 116.031 -0.531 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 95.1 m . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt -120.13 122.14 67.63 Favored 'Isoleucine or valine' 0 C--N 1.361 1.099 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt -103.54 -170.77 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.337 0 C-N-CA 125.601 1.56 . . . . 0.0 109.142 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -135.01 78.43 1.73 Allowed 'General case' 0 C--N 1.361 1.07 0 C-N-CA 124.33 1.052 . . . . 0.0 108.555 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.0 t -128.87 127.21 66.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.7 133.13 34.82 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 125.613 1.565 . . . . 0.0 110.201 -174.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -142.12 171.71 13.68 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -165.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -153.28 27.33 0.51 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 169.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.3 p -170.53 149.22 2.97 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -71.31 -14.25 31.14 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 124.228 3.286 . . . . 0.0 114.822 168.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -87.75 9.43 21.7 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 126.71 2.004 . . . . 0.0 113.464 171.259 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -113.1 19.55 17.08 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.189 2.196 . . . . 0.0 107.614 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.3 t -142.58 -16.06 0.72 Allowed 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.36 1.864 . . . . 0.0 109.001 -175.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.8 m -83.83 -0.7 52.2 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 126.333 1.853 . . . . 0.0 111.717 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.1 mptp? -83.13 -57.3 0.44 Allowed Pre-proline 0 C--N 1.358 0.959 0 C-N-CA 129.069 2.947 . . . . 0.0 110.885 173.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.83 -40.01 5.71 Favored 'Trans proline' 0 C--N 1.367 1.521 0 C-N-CA 124.877 3.718 . . . . 0.0 113.714 174.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -70.07 -31.44 69.05 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 127.805 2.442 . . . . 0.0 114.782 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -88.07 -5.02 58.69 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 124.78 1.232 . . . . 0.0 113.463 171.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -87.05 -24.92 24.45 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 125.98 1.712 . . . . 0.0 110.655 164.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.9 mt -89.78 -63.38 1.29 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.473 2.309 . . . . 0.0 111.913 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -98.21 -9.05 26.24 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 127.797 2.439 . . . . 0.0 111.893 -167.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.56 -80.12 0.36 Allowed Glycine 0 C--N 1.365 2.176 0 C-N-CA 124.898 1.237 . . . . 0.0 113.407 165.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 24' ' ' SER . 74.8 m -146.31 -15.79 0.44 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.458 1.503 . . . . 0.0 107.006 -176.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.5 t -102.71 74.3 1.34 Allowed 'General case' 0 C--N 1.365 1.265 0 C-N-CA 126.948 2.099 . . . . 0.0 106.435 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -130.27 125.45 34.83 Favored 'General case' 0 C--N 1.36 1.025 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 -176.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.99 85.91 0.65 Allowed Glycine 0 C--N 1.362 2.016 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 171.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.05 117.74 30.53 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.49 1.516 . . . . 0.0 109.964 -170.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -124.51 144.32 50.18 Favored 'General case' 0 C--N 1.362 1.138 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -170.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -122.96 113.46 19.11 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -126.01 125.85 43.32 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 104.438 -2.43 . . . . 0.0 104.438 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 81.04 -86.25 0.02 OUTLIER 'General case' 0 C--N 1.384 2.068 0 C-N-CA 127.592 2.357 . . . . 0.0 109.158 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -173.23 54.51 0.16 Allowed Glycine 0 N--CA 1.432 -1.593 0 N-CA-C 104.923 -3.271 . . . . 0.0 104.923 166.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -150.23 152.95 35.39 Favored 'General case' 0 C--N 1.365 1.27 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.9 t -105.05 144.12 32.3 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 126.771 2.029 . . . . 0.0 109.297 -164.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -124.32 142.31 51.37 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 126.179 1.792 . . . . 0.0 106.774 174.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.8 m -125.97 119.01 26.58 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 124.342 1.057 . . . . 0.0 108.198 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -120.08 -147.01 0.39 Allowed 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.769 -1.938 . . . . 0.0 105.769 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.09 156.77 48.45 Favored 'General case' 0 C--N 1.359 0.98 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 177.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -88.66 124.32 33.97 Favored 'General case' 0 C--N 1.36 1.029 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 171.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.367 0 CA-C-N 116.168 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 122.115 0.959 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.6 mt -124.65 113.69 37.32 Favored 'Isoleucine or valine' 0 C--N 1.36 1.036 0 N-CA-C 102.897 -3.001 . . . . 0.0 102.897 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.0 pt -99.5 -177.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.314 0 C-N-CA 125.556 1.543 . . . . 0.0 110.235 -178.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.39 74.47 1.52 Allowed 'General case' 0 C--N 1.362 1.146 0 C-N-CA 124.813 1.245 . . . . 0.0 107.957 -174.607 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.4 t -126.81 122.6 60.95 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 N-CA-C 103.36 -2.83 . . . . 0.0 103.36 171.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -85.62 136.45 33.37 Favored 'General case' 0 C--N 1.364 1.226 0 C-N-CA 125.771 1.628 . . . . 0.0 109.029 -173.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 p -145.61 170.47 16.39 Favored 'General case' 0 C--N 1.356 0.891 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 -160.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.43 22.63 0.72 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.789 -1.93 . . . . 0.0 105.789 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 p -170.62 148.36 2.71 Favored Pre-proline 0 C--N 1.36 1.054 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -174.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -71.52 -13.36 30.13 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 124.632 3.554 . . . . 0.0 114.291 165.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -75.57 -15.22 60.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 128.156 2.582 . . . . 0.0 114.786 170.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -91.85 -9.8 42.05 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 128.052 2.541 . . . . 0.0 110.332 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.7 t -112.64 -12.86 13.35 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.857 2.063 . . . . 0.0 109.456 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.2 p -87.96 0.43 55.9 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 125.71 1.604 . . . . 0.0 111.345 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -78.96 -58.05 0.73 Allowed Pre-proline 0 C--N 1.36 1.053 0 C-N-CA 128.42 2.688 . . . . 0.0 111.775 169.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.98 -41.41 2.74 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.945 3.763 . . . . 0.0 113.204 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -69.89 -31.66 69.58 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.831 2.452 . . . . 0.0 114.971 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -88.01 -6.64 57.88 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 124.659 1.184 . . . . 0.0 113.304 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.09 -22.32 22.96 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 126.255 1.822 . . . . 0.0 111.638 165.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.2 mt -91.3 -68.17 0.81 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.287 2.235 . . . . 0.0 110.966 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.24 -30.07 15.37 Favored 'General case' 0 C--N 1.36 1.055 0 C-N-CA 128.001 2.52 . . . . 0.0 111.672 -167.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.48 -169.64 14.88 Favored Glycine 0 C--N 1.36 1.883 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 34.2 m -69.23 -4.92 19.73 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 128.496 2.719 . . . . 0.0 116.302 -174.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 t -109.57 67.1 0.64 Allowed 'General case' 0 C--N 1.363 1.159 0 C-N-CA 126.717 2.007 . . . . 0.0 106.196 167.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.47 140.73 49.04 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.055 1.742 . . . . 0.0 106.6 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.82 87.11 0.62 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.476 -2.25 . . . . 0.0 107.476 173.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.94 112.59 24.29 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.357 1.463 . . . . 0.0 109.425 -171.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -123.23 139.0 54.5 Favored 'General case' 0 C--N 1.362 1.111 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -171.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.9 t -119.88 112.45 19.23 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -121.97 123.52 41.86 Favored 'General case' 0 C--N 1.358 0.957 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 37.7 t30 79.23 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.381 1.963 0 C-N-CA 127.285 2.234 . . . . 0.0 110.217 175.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.48 55.35 0.17 Allowed Glycine 0 N--CA 1.432 -1.599 0 N-CA-C 105.495 -3.042 . . . . 0.0 105.495 168.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -154.05 153.95 32.81 Favored 'General case' 0 C--N 1.363 1.175 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -105.03 148.47 26.72 Favored 'General case' 0 C--N 1.359 0.983 0 C-N-CA 127.23 2.212 . . . . 0.0 109.454 -165.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -128.15 142.66 51.12 Favored 'General case' 0 CA--C 1.501 -0.921 0 C-N-CA 126.238 1.815 . . . . 0.0 106.89 174.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.8 m -123.67 123.72 41.17 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -123.35 -154.5 0.61 Allowed 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -130.55 22.53 5.1 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 125.042 1.337 . . . . 0.0 108.89 -175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -94.97 76.82 3.56 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.84 1.256 . . . . 0.0 109.629 -176.238 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.391 0 CA-C-N 116.227 -0.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 122.112 0.958 . . . . 0.0 109.815 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt -123.73 114.86 43.29 Favored 'Isoleucine or valine' 0 C--N 1.36 1.062 0 N-CA-C 102.995 -2.965 . . . . 0.0 102.995 174.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.1 pt -99.8 -178.93 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.287 0 C-N-CA 125.576 1.55 . . . . 0.0 109.858 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -127.21 75.66 1.6 Allowed 'General case' 0 C--N 1.363 1.183 0 C-N-CA 124.541 1.137 . . . . 0.0 107.935 -174.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.6 t -129.38 129.22 67.08 Favored 'Isoleucine or valine' 0 C--N 1.36 1.055 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 172.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -82.59 140.88 32.98 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 125.914 1.686 . . . . 0.0 109.613 -175.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.9 p -147.67 167.35 24.83 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -167.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -148.83 22.12 1.0 Allowed 'General case' 0 C--N 1.355 0.81 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 171.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.0 p -169.01 150.73 4.53 Favored Pre-proline 0 C--N 1.361 1.067 0 N-CA-C 105.304 -2.109 . . . . 0.0 105.304 -175.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -71.62 -16.32 30.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.114 3.21 . . . . 0.0 114.815 169.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.51 -4.82 57.02 Favored 'General case' 0 C--N 1.369 1.437 0 C-N-CA 127.009 2.123 . . . . 0.0 114.569 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -99.14 3.01 46.42 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 127.161 2.184 . . . . 0.0 109.648 171.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -122.99 -14.04 7.68 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 127.465 2.306 . . . . 0.0 108.007 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 m -85.66 0.66 52.06 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 126.195 1.798 . . . . 0.0 110.81 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.45 -57.21 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.965 0 C-N-CA 129.297 3.039 . . . . 0.0 110.92 172.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -70.05 -42.04 3.43 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 124.867 3.711 . . . . 0.0 113.919 171.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.3 -28.98 65.61 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.293 2.237 . . . . 0.0 114.941 -175.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -88.09 -11.08 48.12 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.589 1.156 . . . . 0.0 113.026 171.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -84.78 -20.37 31.13 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 125.527 1.531 . . . . 0.0 111.872 166.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.5 mt -93.42 -67.01 0.88 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.626 2.37 . . . . 0.0 111.03 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -96.78 -6.61 35.75 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 127.866 2.466 . . . . 0.0 112.518 -166.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.22 -78.73 0.52 Allowed Glycine 0 C--N 1.366 2.203 0 C-N-CA 125.074 1.321 . . . . 0.0 113.672 164.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.1 t -153.2 -7.96 0.17 Allowed 'General case' 0 C--N 1.354 0.776 0 N-CA-C 106.528 -1.656 . . . . 0.0 106.528 -174.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -106.21 68.71 0.77 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.001 2.12 . . . . 0.0 105.66 174.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.86 128.88 48.32 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.013 1.725 . . . . 0.0 106.892 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.46 87.53 0.54 Allowed Glycine 0 C--N 1.362 2.005 0 N-CA-C 106.965 -2.454 . . . . 0.0 106.965 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.42 113.45 25.11 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.235 1.414 . . . . 0.0 109.704 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -124.03 140.36 53.04 Favored 'General case' 0 C--N 1.36 1.054 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -171.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 45.3 t -121.24 113.62 20.21 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.6 mmm -124.23 123.62 40.66 Favored 'General case' 0 C--N 1.359 1.003 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 79.23 -85.73 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.463 2.305 . . . . 0.0 110.266 175.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.76 54.12 0.19 Allowed Glycine 0 N--CA 1.433 -1.522 0 N-CA-C 105.453 -3.059 . . . . 0.0 105.453 169.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -154.02 154.35 33.57 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.2 t -106.1 147.15 29.28 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.368 2.267 . . . . 0.0 109.407 -164.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -126.81 141.06 51.93 Favored 'General case' 0 CA--C 1.501 -0.916 0 C-N-CA 126.165 1.786 . . . . 0.0 106.794 173.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.4 m -123.56 124.42 42.77 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -123.83 -159.38 0.86 Allowed 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -131.99 86.91 2.38 Favored 'General case' 0 C--N 1.359 1.011 0 N-CA-C 106.449 -1.685 . . . . 0.0 106.449 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -113.61 98.72 7.23 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 173.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.362 0 CA-C-N 116.245 -0.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 40.0 p . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 88.1 mt -104.88 121.65 57.04 Favored 'Isoleucine or valine' 0 C--N 1.364 1.197 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 -170.266 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -105.38 -177.56 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.117 0 C-N-CA 125.938 1.695 . . . . 0.0 109.933 -172.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -127.26 75.93 1.62 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 124.918 1.287 . . . . 0.0 107.686 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 t -126.76 125.66 67.28 Favored 'Isoleucine or valine' 0 C--N 1.362 1.126 0 N-CA-C 103.909 -2.626 . . . . 0.0 103.909 173.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -80.58 133.13 35.73 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.13 1.772 . . . . 0.0 110.067 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.0 169.94 16.66 Favored 'General case' 0 C--N 1.357 0.934 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -166.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.49 22.07 0.72 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.918 -1.882 . . . . 0.0 105.918 174.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 p -170.06 149.51 3.37 Favored Pre-proline 0 C--N 1.36 1.044 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 -175.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -71.64 -16.64 30.16 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.317 3.345 . . . . 0.0 114.601 168.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -82.27 -3.43 55.19 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.931 2.093 . . . . 0.0 114.628 171.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -94.23 -5.81 46.05 Favored 'General case' 0 C--N 1.37 1.499 0 C-N-CA 127.319 2.248 . . . . 0.0 109.827 169.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.0 t -116.35 -13.05 11.03 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 126.921 2.089 . . . . 0.0 108.795 -177.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -86.25 -2.38 58.33 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 126.655 1.982 . . . . 0.0 110.604 172.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HZ2' ' HB3' ' A' ' 15' ' ' LYS . 9.7 mtpm? -79.15 -57.97 0.72 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.099 2.959 . . . . 0.0 111.389 171.027 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.18 -45.01 0.96 Allowed 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 124.984 3.789 . . . . 0.0 113.577 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.2 m -69.43 -28.93 66.55 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 127.296 2.238 . . . . 0.0 115.048 -177.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -88.05 -9.3 53.79 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.73 170.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -86.04 -23.28 26.84 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 125.651 1.58 . . . . 0.0 111.319 167.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.8 mt -87.99 -61.16 1.78 Allowed 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.785 2.434 . . . . 0.0 111.389 176.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -107.34 1.71 23.94 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.664 1.986 . . . . 0.0 112.323 -162.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.84 -82.79 0.75 Allowed Glycine 0 C--N 1.365 2.163 0 C-N-CA 125.163 1.363 . . . . 0.0 113.711 165.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -148.2 -6.75 0.42 Allowed 'General case' 0 C--N 1.355 0.81 0 C-N-CA 125.909 1.684 . . . . 0.0 106.797 -178.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.0 t -102.65 77.89 1.65 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.392 2.277 . . . . 0.0 106.316 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -145.36 125.9 14.12 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.21 87.35 0.66 Allowed Glycine 0 C--N 1.366 2.208 0 N-CA-C 107.535 -2.226 . . . . 0.0 107.535 171.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.1 113.18 25.36 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 125.171 1.388 . . . . 0.0 110.71 -168.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -117.91 145.62 44.52 Favored 'General case' 0 C--N 1.363 1.177 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -125.09 112.95 17.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 105.469 -2.048 . . . . 0.0 105.469 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.85 123.91 41.49 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 104.4 -2.445 . . . . 0.0 104.4 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.0 m120 77.65 -84.03 0.03 OUTLIER 'General case' 0 C--N 1.383 2.027 0 C-N-CA 127.617 2.367 . . . . 0.0 111.09 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.64 55.44 0.16 Allowed Glycine 0 N--CA 1.433 -1.505 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 169.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -152.51 153.02 32.62 Favored 'General case' 0 C--N 1.364 1.197 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.0 t -104.99 142.98 33.82 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.347 2.259 . . . . 0.0 109.238 -165.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -125.63 145.53 50.11 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 126.031 1.732 . . . . 0.0 108.107 174.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 16.6 m -117.43 135.44 53.89 Favored 'General case' 0 C--N 1.36 1.049 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -117.44 -27.22 6.43 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.801 1.24 . . . . 0.0 109.097 -174.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 81.52 39.28 0.06 Allowed 'General case' 0 C--N 1.365 1.272 0 C-N-CA 128.376 2.67 . . . . 0.0 111.676 173.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -85.02 -79.99 0.22 Allowed 'General case' 0 C--N 1.357 0.929 0 C-N-CA 125.738 1.615 . . . . 0.0 110.011 -174.63 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.335 0 O-C-N 123.025 0.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 38.6 p . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.8 mt -125.44 129.29 72.94 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 N-CA-C 104.318 -2.475 . . . . 0.0 104.318 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.3 pt -106.68 -172.58 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.249 0 C-N-CA 125.385 1.474 . . . . 0.0 108.949 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -133.33 85.74 2.24 Favored 'General case' 0 C--N 1.361 1.085 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.0 t -131.42 129.45 62.15 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 N-CA-C 103.473 -2.788 . . . . 0.0 103.473 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.425 ' HZ3' ' HB3' ' A' ' 6' ' ' LYS . 2.6 mmmp? -79.29 135.38 36.73 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 126.283 1.833 . . . . 0.0 110.187 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.72 173.06 12.17 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -168.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.01 27.34 0.42 Allowed 'General case' 0 C--N 1.355 0.844 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 169.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.3 p -171.32 148.54 2.38 Favored Pre-proline 0 C--N 1.361 1.075 0 N-CA-C 105.1 -2.185 . . . . 0.0 105.1 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -70.7 -17.46 33.28 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 124.286 3.324 . . . . 0.0 114.857 169.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.63 -8.77 59.41 Favored 'General case' 0 C--N 1.368 1.392 0 C-N-CA 127.556 2.342 . . . . 0.0 114.204 172.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -93.96 -1.84 54.03 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 126.954 2.102 . . . . 0.0 110.193 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.8 t -118.51 -12.97 9.74 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 127.157 2.183 . . . . 0.0 108.209 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.3 m -83.47 -1.94 54.75 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 125.987 1.715 . . . . 0.0 112.099 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -80.99 -56.96 0.6 Allowed Pre-proline 0 C--N 1.361 1.067 0 C-N-CA 128.304 2.642 . . . . 0.0 111.358 171.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.26 -40.81 4.16 Favored 'Trans proline' 0 C--N 1.366 1.456 0 C-N-CA 124.78 3.653 . . . . 0.0 113.59 175.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.7 m -69.19 -31.87 70.78 Favored 'General case' 0 C--N 1.368 1.391 0 C-N-CA 127.787 2.435 . . . . 0.0 114.888 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -88.07 -6.01 58.16 Favored 'General case' 0 C--N 1.369 1.436 0 C-N-CA 124.852 1.261 . . . . 0.0 113.267 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -88.59 -20.31 25.16 Favored 'General case' 0 C--N 1.36 1.053 0 C-N-CA 125.906 1.682 . . . . 0.0 111.243 165.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.7 mt -93.1 -67.09 0.88 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.571 2.348 . . . . 0.0 111.119 178.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -95.56 -10.07 30.58 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 128.163 2.585 . . . . 0.0 112.121 -167.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.62 -79.55 0.39 Allowed Glycine 0 C--N 1.365 2.139 0 C-N-CA 125.01 1.29 . . . . 0.0 113.404 165.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.69 -13.38 0.44 Allowed 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.65 1.58 . . . . 0.0 107.071 -175.048 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 t -104.43 70.18 0.94 Allowed 'General case' 0 C--N 1.366 1.321 0 C-N-CA 126.862 2.065 . . . . 0.0 106.1 177.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.45 126.25 43.47 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.738 1.615 . . . . 0.0 106.826 -175.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.25 86.54 0.57 Allowed Glycine 0 C--N 1.361 1.95 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 171.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.36 114.73 26.83 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 125.185 1.394 . . . . 0.0 109.822 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -121.34 145.54 47.78 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -173.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.1 t -127.93 112.08 14.29 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 65.9 mtt -131.92 130.85 42.11 Favored 'General case' 0 C--N 1.359 1.009 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 79.36 -14.36 0.87 Allowed 'General case' 0 C--N 1.384 2.072 0 C-N-CA 126.869 2.068 . . . . 0.0 114.516 172.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.22 41.18 4.06 Favored Glycine 0 C--N 1.361 1.952 0 C-N-CA 127.36 2.41 . . . . 0.0 110.451 -171.101 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -148.54 151.33 34.92 Favored 'General case' 0 C--N 1.365 1.246 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.5 t -104.94 140.09 38.69 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.583 1.953 . . . . 0.0 109.462 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -121.76 140.53 52.23 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 126.128 1.771 . . . . 0.0 107.066 173.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.2 m -125.72 113.2 17.01 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -112.87 -155.86 0.58 Allowed 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 127.243 2.217 . . . . 0.0 106.767 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -133.76 103.55 5.92 Favored 'General case' 0 C--N 1.359 1.006 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -142.47 100.15 3.63 Favored 'General case' 0 C--N 1.355 0.835 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.401 0 CA-C-N 116.155 -0.475 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp -123.86 120.54 59.96 Favored 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 103.9 -2.63 . . . . 0.0 103.9 178.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -102.52 -179.73 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.318 0 C-N-CA 125.715 1.606 . . . . 0.0 110.013 -178.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -123.77 71.9 1.12 Allowed 'General case' 0 C--N 1.363 1.157 0 C-N-CA 125.075 1.35 . . . . 0.0 108.323 -173.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.1 t -128.94 131.18 68.44 Favored 'Isoleucine or valine' 0 C--N 1.362 1.111 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 173.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.73 140.18 30.71 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 125.868 1.667 . . . . 0.0 109.308 -173.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 p -146.3 168.56 20.78 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -168.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -153.38 26.02 0.52 Allowed 'General case' 0 C--N 1.355 0.848 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 167.388 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.4 p -167.46 148.22 4.88 Favored Pre-proline 0 C--N 1.361 1.068 0 N-CA-C 105.19 -2.152 . . . . 0.0 105.19 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -72.59 -14.74 27.52 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 123.966 3.111 . . . . 0.0 114.844 171.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -76.88 -15.97 59.54 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 127.234 2.214 . . . . 0.0 114.28 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -88.65 -3.76 58.71 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 127.262 2.225 . . . . 0.0 110.636 173.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.2 t -117.41 -13.84 10.36 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 127.556 2.342 . . . . 0.0 108.433 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -85.99 -1.85 57.73 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 126.184 1.793 . . . . 0.0 111.075 174.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -77.4 -59.01 0.9 Allowed Pre-proline 0 C--N 1.357 0.895 0 C-N-CA 129.006 2.923 . . . . 0.0 111.813 170.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -71.32 -41.04 2.7 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 124.961 3.774 . . . . 0.0 113.676 174.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.47 -29.31 65.83 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 127.509 2.324 . . . . 0.0 114.566 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -88.06 -9.91 51.89 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 124.732 1.213 . . . . 0.0 113.103 171.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -85.5 -20.08 30.22 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 125.613 1.565 . . . . 0.0 111.706 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.1 mt -93.81 -66.53 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.681 2.393 . . . . 0.0 111.092 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -96.12 -7.63 35.44 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.875 2.47 . . . . 0.0 112.346 -167.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.14 -78.91 0.4 Allowed Glycine 0 C--N 1.364 2.125 0 C-N-CA 124.982 1.277 . . . . 0.0 113.445 165.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.7 t -153.06 -8.43 0.17 Allowed 'General case' 0 C--N 1.354 0.775 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 t -106.3 68.78 0.77 Allowed 'General case' 0 C--N 1.365 1.272 0 C-N-CA 126.947 2.099 . . . . 0.0 105.649 175.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.57 126.57 45.01 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 125.956 1.702 . . . . 0.0 106.725 -174.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.29 86.32 0.56 Allowed Glycine 0 C--N 1.361 1.962 0 N-CA-C 107.326 -2.31 . . . . 0.0 107.326 171.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.07 113.09 24.99 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.356 1.462 . . . . 0.0 109.534 -172.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -121.61 137.7 54.63 Favored 'General case' 0 C--N 1.36 1.032 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 -171.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.5 t -115.0 126.62 54.97 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 -177.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 95.9 mmm -110.42 69.14 0.68 Allowed 'General case' 0 C--N 1.359 1.02 0 N-CA-C 104.349 -2.463 . . . . 0.0 104.349 172.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -2.9 71.32 0.0 OUTLIER 'General case' 0 C--N 1.38 1.927 1 C-N-CA 134.678 5.191 . . . . 0.0 118.433 -172.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.48 -39.38 0.58 Allowed Glycine 0 C--N 1.354 1.545 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -164.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -154.06 158.27 40.26 Favored 'General case' 0 C--N 1.37 1.474 0 CA-C-N 119.443 1.622 . . . . 0.0 108.666 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -107.46 153.81 22.27 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 128.661 2.784 . . . . 0.0 109.688 -166.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.409 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 54.1 mtmt -131.46 142.77 50.06 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.04 2.136 . . . . 0.0 106.896 175.019 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.1 m -125.6 122.58 36.87 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.301 1.04 . . . . 0.0 108.748 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.409 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 66.0 m-85 -122.17 -160.72 0.89 Allowed 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 126.443 1.897 . . . . 0.0 105.911 179.169 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -131.63 89.39 2.7 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 73.1 m-80 -135.32 86.58 2.26 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 105.192 -2.151 . . . . 0.0 105.192 175.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.438 0 CA-C-N 115.93 -0.577 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 63.3 m . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 72.1 mt -104.94 121.14 56.51 Favored 'Isoleucine or valine' 0 C--N 1.365 1.266 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 -171.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.8 pt -103.72 -176.55 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.597 1.559 . . . . 0.0 110.354 -173.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -127.41 79.86 1.92 Allowed 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -128.37 123.07 59.2 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.038 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 170.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -81.82 130.28 35.01 Favored 'General case' 0 C--N 1.366 1.285 0 C-N-CA 125.954 1.702 . . . . 0.0 109.651 -175.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.1 p -139.01 171.48 14.26 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -164.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.87 22.85 0.68 Allowed 'General case' 0 C--N 1.355 0.847 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 174.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.4 p -171.52 148.01 2.2 Favored Pre-proline 0 C--N 1.36 1.043 0 N-CA-C 105.526 -2.028 . . . . 0.0 105.526 -174.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -71.56 -13.63 30.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.632 3.554 . . . . 0.0 114.173 165.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -75.28 -16.15 60.46 Favored 'General case' 0 C--N 1.369 1.447 0 C-N-CA 128.35 2.66 . . . . 0.0 114.76 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -89.8 -12.05 40.35 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 128.225 2.61 . . . . 0.0 110.441 174.396 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.8 t -111.82 -12.92 13.75 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 126.797 2.039 . . . . 0.0 109.636 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.2 p -88.04 -1.22 57.86 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 125.613 1.565 . . . . 0.0 111.61 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -78.03 -58.49 0.85 Allowed Pre-proline 0 C--N 1.36 1.03 0 C-N-CA 128.586 2.754 . . . . 0.0 111.668 169.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.9 -43.92 2.27 Favored 'Trans proline' 0 C--N 1.365 1.438 0 C-N-CA 124.98 3.787 . . . . 0.0 113.198 177.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 66.0 m -67.58 -33.58 75.3 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 128.26 2.624 . . . . 0.0 115.411 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -88.06 -5.04 58.69 Favored 'General case' 0 C--N 1.37 1.465 0 CA-C-N 119.628 1.103 . . . . 0.0 113.337 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -88.97 -23.44 22.65 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.97 1.708 . . . . 0.0 111.628 164.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.6 mt -90.77 -64.14 1.17 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 127.41 2.284 . . . . 0.0 111.611 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -90.05 -32.82 16.56 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.154 2.581 . . . . 0.0 110.797 -168.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.66 92.6 1.37 Allowed Glycine 0 C--N 1.364 2.116 0 C-N-CA 124.966 1.27 . . . . 0.0 114.299 163.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . 0.259 20.1 m 83.57 -53.01 0.15 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 128.439 2.696 . . . . 0.0 114.554 169.438 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.1 t -109.31 71.74 0.78 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 126.652 1.981 . . . . 0.0 107.103 -177.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.96 146.84 34.55 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 125.559 1.544 . . . . 0.0 107.572 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.5 89.44 0.78 Allowed Glycine 0 C--N 1.359 1.854 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.46 115.94 28.12 Favored 'General case' 0 C--N 1.355 0.827 0 C-N-CA 125.283 1.433 . . . . 0.0 109.438 -172.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.6 mtpt -122.81 140.29 53.09 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.1 t -119.44 110.45 16.94 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -120.05 122.91 42.14 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 178.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.44 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.635 2.374 . . . . 0.0 111.195 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.15 55.27 0.18 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 105.38 -3.088 . . . . 0.0 105.38 169.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -153.67 152.2 30.55 Favored 'General case' 0 C--N 1.364 1.203 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 176.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.2 t -105.22 143.15 33.8 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 127.119 2.167 . . . . 0.0 109.214 -166.021 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -122.06 148.15 45.22 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 126.045 1.738 . . . . 0.0 107.232 172.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 m -126.02 133.69 51.67 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -132.89 -160.13 1.02 Allowed 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 104.561 -2.385 . . . . 0.0 104.561 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -135.12 62.06 1.65 Allowed 'General case' 0 C--N 1.36 1.062 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -102.17 121.01 41.4 Favored 'General case' 0 C--N 1.358 0.954 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 178.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 44.8 p . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 110.711 -0.107 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.9 mt -130.0 126.33 61.9 Favored 'Isoleucine or valine' 0 C--N 1.364 1.224 0 N-CA-C 104.398 -2.445 . . . . 0.0 104.398 -177.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -111.53 -171.65 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.631 1.572 . . . . 0.0 108.305 174.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -131.45 82.01 2.01 Favored 'General case' 0 C--N 1.364 1.22 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.0 t -132.89 130.0 58.37 Favored 'Isoleucine or valine' 0 C--N 1.361 1.092 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 171.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.68 135.05 35.53 Favored 'General case' 0 C--N 1.366 1.297 0 C-N-CA 125.866 1.666 . . . . 0.0 110.357 -177.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.2 p -143.72 171.8 13.7 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -168.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -153.72 27.28 0.49 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 105.307 -2.109 . . . . 0.0 105.307 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 76.1 p -170.71 149.16 2.84 Favored Pre-proline 0 C--N 1.36 1.04 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -71.69 -13.1 29.58 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 124.46 3.44 . . . . 0.0 114.081 167.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.05 -13.72 59.92 Favored 'General case' 0 C--N 1.371 1.501 0 C-N-CA 128.793 2.837 . . . . 0.0 113.915 172.001 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -98.17 0.71 46.42 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 127.719 2.408 . . . . 0.0 109.913 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.5 t -122.51 -17.5 6.97 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 126.504 1.922 . . . . 0.0 108.669 -175.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 p -87.04 1.58 52.41 Favored 'General case' 0 C--N 1.369 1.416 0 O-C-N 120.155 -1.591 . . . . 0.0 111.095 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.86 -56.81 0.54 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 129.67 3.188 . . . . 0.0 110.942 170.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.35 -46.8 2.59 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 124.863 3.709 . . . . 0.0 113.646 171.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -62.87 -37.79 88.28 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.984 2.514 . . . . 0.0 115.517 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.1 -3.25 58.91 Favored 'General case' 0 C--N 1.368 1.4 0 C-N-CA 125.012 1.325 . . . . 0.0 113.447 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -89.02 -25.85 21.76 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 125.401 1.48 . . . . 0.0 111.911 162.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.5 mt -94.58 -61.85 1.43 Allowed 'General case' 0 C--N 1.367 1.332 0 C-N-CA 127.044 2.137 . . . . 0.0 112.844 -173.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -91.41 -33.59 15.19 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 127.092 2.157 . . . . 0.0 112.416 -161.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 173.88 -113.39 0.46 Allowed Glycine 0 C--N 1.356 1.661 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 176.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -148.52 -10.5 0.36 Allowed 'General case' 0 C--N 1.356 0.877 0 C-N-CA 126.258 1.823 . . . . 0.0 106.51 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -128.54 73.87 1.52 Allowed 'General case' 0 C--N 1.362 1.116 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.88 153.37 19.91 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.908 1.683 . . . . 0.0 108.687 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.55 87.35 0.94 Allowed Glycine 0 C--N 1.364 2.124 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.75 115.82 28.09 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 125.239 1.416 . . . . 0.0 109.459 -171.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -124.91 140.6 52.77 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 -172.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -121.33 114.7 21.71 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 -178.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -124.94 124.14 41.4 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 78.41 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.007 0 C-N-CA 127.592 2.357 . . . . 0.0 110.916 176.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.6 54.34 0.18 Allowed Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 105.48 -3.048 . . . . 0.0 105.48 168.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -153.99 151.74 29.73 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 105.631 -1.989 . . . . 0.0 105.631 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.5 t -104.96 145.92 29.76 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 127.44 2.296 . . . . 0.0 109.067 -164.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -125.77 138.86 53.87 Favored 'General case' 0 CA--C 1.499 -1.003 0 C-N-CA 126.34 1.856 . . . . 0.0 106.441 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 66.5 m -125.5 116.11 21.28 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.286 1.034 . . . . 0.0 108.717 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -116.16 -167.92 1.35 Allowed 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.197 2.199 . . . . 0.0 106.536 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -126.97 78.1 1.78 Allowed 'General case' 0 C--N 1.36 1.037 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.7 m120 -117.85 -97.33 0.46 Allowed 'General case' 0 C--N 1.357 0.934 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 176.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.39 0 CA-C-N 117.822 0.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.9 mt -127.84 120.9 55.19 Favored 'Isoleucine or valine' 0 C--N 1.365 1.28 0 N-CA-C 103.106 -2.924 . . . . 0.0 103.106 177.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.0 pt -105.8 -175.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.269 0 C-N-CA 125.307 1.443 . . . . 0.0 109.445 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -129.63 78.42 1.85 Allowed 'General case' 0 C--N 1.362 1.114 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.66 127.62 66.9 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 N-CA-C 103.772 -2.677 . . . . 0.0 103.772 172.557 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -80.35 132.84 35.85 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.218 1.807 . . . . 0.0 110.409 -176.116 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.8 p -142.85 173.13 11.82 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 123.219 1.485 . . . . 0.0 109.009 -165.938 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 96.3 m -142.05 -52.73 0.42 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 102.625 -3.102 . . . . 0.0 102.625 -168.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.7 p -107.98 162.74 18.82 Favored Pre-proline 0 C--N 1.362 1.127 0 C-N-CA 127.635 2.374 . . . . 0.0 109.351 179.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -72.12 -18.35 27.32 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.685 3.59 . . . . 0.0 114.417 164.27 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.43 -2.29 48.96 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.735 2.014 . . . . 0.0 114.505 171.759 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -93.13 -10.27 36.52 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.162 2.585 . . . . 0.0 109.773 169.762 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.6 t -112.74 -14.67 13.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 127.511 2.324 . . . . 0.0 108.159 -177.031 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -82.91 -0.69 49.6 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 126.749 2.019 . . . . 0.0 111.25 173.426 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -82.09 -57.65 0.49 Allowed Pre-proline 0 N--CA 1.439 -1.01 0 C-N-CA 129.272 3.029 . . . . 0.0 110.881 172.78 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.07 -43.69 3.07 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 124.911 3.741 . . . . 0.0 113.796 171.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -68.1 -30.39 69.54 Favored 'General case' 0 C--N 1.367 1.36 0 C-N-CA 127.138 2.175 . . . . 0.0 115.215 -176.01 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -88.05 -9.31 53.78 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.946 1.298 . . . . 0.0 113.076 173.108 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -87.5 -22.13 25.07 Favored 'General case' 0 C--N 1.362 1.114 0 C-N-CA 125.917 1.687 . . . . 0.0 112.219 165.735 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.8 mt -96.54 -71.13 0.69 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.214 2.206 . . . . 0.0 110.756 -177.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -89.45 -25.89 21.25 Favored 'General case' 0 C--N 1.361 1.102 0 C-N-CA 128.568 2.747 . . . . 0.0 111.531 -169.851 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.73 -155.86 20.14 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 125.669 1.604 . . . . 0.0 109.826 177.333 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.4 m -72.46 -4.51 30.72 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 128.337 2.655 . . . . 0.0 114.911 179.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.7 t -104.52 71.78 1.01 Allowed 'General case' 0 C--N 1.365 1.245 0 C-N-CA 127.261 2.224 . . . . 0.0 105.73 165.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.46 127.07 36.63 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.433 ' HA3' HD21 ' A' ' 39' ' ' ASN . . . -101.6 87.45 0.65 Allowed Glycine 0 C--N 1.361 1.96 0 N-CA-C 107.085 -2.406 . . . . 0.0 107.085 170.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.81 111.37 23.16 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.473 1.509 . . . . 0.0 109.754 -170.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -120.81 141.63 50.36 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -170.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.2 t -122.59 111.77 17.18 Favored 'General case' 0 C--N 1.352 0.675 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 -178.194 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.8 mmm -120.59 124.79 46.15 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 104.415 -2.439 . . . . 0.0 104.415 178.55 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.47 12.5 p30 70.41 -79.07 0.04 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 128.647 2.779 . . . . 0.0 113.596 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.23 54.0 0.14 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.854 -2.898 . . . . 0.0 105.854 169.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -153.23 151.49 30.13 Favored 'General case' 0 C--N 1.361 1.095 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 176.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.11 144.37 32.0 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.212 2.205 . . . . 0.0 109.295 -163.656 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -124.99 140.63 52.75 Favored 'General case' 0 CA--C 1.501 -0.912 0 C-N-CA 126.01 1.724 . . . . 0.0 107.027 174.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -125.31 110.79 14.42 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.307 1.043 . . . . 0.0 108.492 179.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -107.78 -161.42 0.78 Allowed 'General case' 0 C--N 1.357 0.928 0 C-N-CA 127.23 2.212 . . . . 0.0 106.829 177.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -132.29 95.72 3.71 Favored 'General case' 0 C--N 1.36 1.025 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 178.791 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.433 HD21 ' HA3' ' A' ' 26' ' ' GLY . 68.9 m-80 -139.63 100.35 3.94 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.01 -2.218 . . . . 0.0 105.01 176.841 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.425 0 CA-C-N 116.1 -0.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 122.081 0.943 . . . . 0.0 109.809 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt -121.78 117.43 52.45 Favored 'Isoleucine or valine' 0 C--N 1.361 1.098 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 174.8 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.7 pt -101.01 -172.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.286 0 C-N-CA 125.422 1.489 . . . . 0.0 109.644 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -133.38 73.15 1.5 Allowed 'General case' 0 C--N 1.36 1.049 0 C-N-CA 124.424 1.09 . . . . 0.0 108.669 -173.1 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.8 t -125.32 125.48 69.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.461 ' HZ1' ' HE3' ' A' ' 33' ' ' LYS . 58.3 mmtt -88.77 125.0 34.68 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 125.264 1.426 . . . . 0.0 108.813 -171.107 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 p -131.37 176.09 8.58 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.177 0.991 . . . . 0.0 109.314 -162.931 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.84 23.27 0.45 Allowed 'General case' 0 C--N 1.356 0.88 0 N-CA-C 105.734 -1.951 . . . . 0.0 105.734 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -173.47 149.56 1.67 Allowed Pre-proline 0 C--N 1.359 1.002 0 N-CA-C 105.118 -2.179 . . . . 0.0 105.118 -173.59 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -70.58 -17.33 33.9 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.538 3.492 . . . . 0.0 114.36 167.847 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -78.02 -14.28 59.57 Favored 'General case' 0 C--N 1.37 1.473 0 C-N-CA 128.584 2.754 . . . . 0.0 114.001 174.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -88.66 -11.44 45.29 Favored 'General case' 0 C--N 1.372 1.574 0 C-N-CA 127.852 2.461 . . . . 0.0 110.263 172.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.5 t -109.08 -13.41 14.7 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.04 2.136 . . . . 0.0 109.135 -179.144 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -84.8 -0.41 53.77 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.021 1.728 . . . . 0.0 111.202 173.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -80.09 -59.06 0.56 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.108 2.963 . . . . 0.0 111.266 171.21 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -70.88 -41.77 2.65 Favored 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 125.023 3.815 . . . . 0.0 113.509 174.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.59 -30.06 66.65 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 127.482 2.313 . . . . 0.0 114.941 -176.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -88.07 -8.94 54.79 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.823 1.192 . . . . 0.0 112.792 171.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -86.27 -21.37 27.39 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.836 1.654 . . . . 0.0 111.586 166.471 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.9 mt -91.92 -66.27 0.94 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 127.563 2.345 . . . . 0.0 111.023 178.006 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.16 -8.57 29.75 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.863 2.465 . . . . 0.0 112.263 -167.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.38 -79.64 0.58 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 125.099 1.333 . . . . 0.0 113.655 164.92 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.8 m -147.97 -7.13 0.43 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.005 1.722 . . . . 0.0 107.225 -174.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.3 t -108.73 66.6 0.64 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 126.733 2.013 . . . . 0.0 105.886 177.372 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.58 125.31 42.98 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.715 1.606 . . . . 0.0 106.838 -175.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.43 ' HA3' HD21 ' A' ' 39' ' ' ASN . . . -103.16 83.59 0.43 Allowed Glycine 0 C--N 1.362 2.018 0 N-CA-C 106.897 -2.481 . . . . 0.0 106.897 170.177 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.89 113.59 25.34 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.291 1.437 . . . . 0.0 110.172 -168.427 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -119.78 149.28 42.3 Favored 'General case' 0 CA--C 1.495 -1.148 0 C-N-CA 125.197 1.399 . . . . 0.0 108.026 -171.165 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -131.33 115.34 16.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 -179.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 94.7 mtp -124.34 127.37 47.49 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 173.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.44 -83.31 0.02 OUTLIER 'General case' 0 C--N 1.384 2.104 0 C-N-CA 127.562 2.345 . . . . 0.0 110.533 174.518 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.54 57.14 0.11 Allowed Glycine 0 N--CA 1.43 -1.756 0 N-CA-C 105.558 -3.017 . . . . 0.0 105.558 167.527 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.461 ' HE3' ' HZ1' ' A' ' 6' ' ' LYS . 53.8 mttp -152.09 150.21 29.66 Favored 'General case' 0 C--N 1.365 1.25 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 175.758 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -105.04 142.88 34.04 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.28 2.232 . . . . 0.0 109.555 -164.747 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -123.58 140.6 52.83 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.83 1.652 . . . . 0.0 107.315 173.008 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -120.62 119.26 32.35 Favored 'General case' 0 C--N 1.361 1.082 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.385 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -117.5 -168.0 1.42 Allowed 'General case' 0 N--CA 1.438 -1.061 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 178.039 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -126.18 89.38 3.0 Favored 'General case' 0 C--N 1.36 1.022 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -177.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.43 HD21 ' HA3' ' A' ' 26' ' ' GLY . 70.0 m-80 -137.74 94.85 2.95 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 177.494 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.385 0 CA-C-N 116.063 -0.517 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.0 mt -124.8 119.66 56.66 Favored 'Isoleucine or valine' 0 C--N 1.366 1.304 0 N-CA-C 103.064 -2.939 . . . . 0.0 103.064 176.344 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.1 pt -103.78 -175.85 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.248 0 C-N-CA 125.12 1.368 . . . . 0.0 109.679 -179.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -128.73 78.69 1.86 Allowed 'General case' 0 C--N 1.362 1.12 0 C-N-CA 124.913 1.285 . . . . 0.0 107.589 -175.061 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.26 124.37 62.11 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -80.87 134.94 35.84 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 126.904 2.082 . . . . 0.0 110.125 -177.87 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.3 p -142.33 -179.18 6.12 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.726 0.774 . . . . 0.0 110.079 -164.253 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.5 t -148.94 18.64 0.99 Allowed 'General case' 0 C--N 1.355 0.839 0 C-N-CA 126.064 1.746 . . . . 0.0 106.772 168.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.2 p -172.96 155.96 3.03 Favored Pre-proline 0 C--N 1.363 1.189 0 C-N-CA 124.651 1.181 . . . . 0.0 108.196 -172.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -69.75 -18.22 37.17 Favored 'Trans proline' 0 C--N 1.361 1.198 1 C-N-CA 125.395 4.064 . . . . 0.0 114.804 163.224 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -76.09 -17.11 59.76 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 128.161 2.584 . . . . 0.0 113.744 174.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.5 tp60 -91.6 -7.86 48.94 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 128.499 2.72 . . . . 0.0 110.179 174.293 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 t -109.06 -13.54 14.69 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.522 2.329 . . . . 0.0 109.144 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.1 m -84.39 -1.88 56.24 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 126.332 1.853 . . . . 0.0 111.295 174.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -79.95 -59.37 0.55 Allowed Pre-proline 0 C--N 1.357 0.907 0 C-N-CA 129.331 3.053 . . . . 0.0 111.314 171.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -70.61 -41.02 3.47 Favored 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 125.114 3.876 . . . . 0.0 113.584 175.332 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.12 -31.44 70.13 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 127.684 2.394 . . . . 0.0 114.735 -177.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.08 -6.4 57.95 Favored 'General case' 0 C--N 1.37 1.486 0 C-N-CA 124.651 1.18 . . . . 0.0 113.2 172.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -88.65 -20.44 24.91 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.68 1.592 . . . . 0.0 111.471 165.632 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -93.36 -66.88 0.89 Allowed 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.506 2.322 . . . . 0.0 111.111 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -92.68 -14.92 27.4 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 128.181 2.592 . . . . 0.0 111.705 -169.416 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.0 -74.29 0.29 Allowed Glycine 0 C--N 1.365 2.154 0 C-N-CA 124.9 1.238 . . . . 0.0 113.746 163.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.39 -35.22 0.47 Allowed 'General case' 0 C--N 1.354 0.766 0 C-N-CA 125.588 1.555 . . . . 0.0 107.13 -169.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.8 t -93.14 75.64 4.66 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.823 2.449 . . . . 0.0 108.034 176.466 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.53 121.15 28.16 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 -177.24 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.36 85.08 0.78 Allowed Glycine 0 C--N 1.364 2.104 0 N-CA-C 107.783 -2.127 . . . . 0.0 107.783 172.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.65 114.55 27.14 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 125.556 1.542 . . . . 0.0 109.843 -170.841 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -123.99 143.21 50.55 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 -172.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.8 113.38 8.54 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -176.696 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.5 mmt -115.0 122.32 45.85 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 -175.003 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 77.92 -83.91 0.03 OUTLIER 'General case' 0 C--N 1.38 1.895 0 C-N-CA 127.491 2.316 . . . . 0.0 111.152 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.76 49.44 0.25 Allowed Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 107.194 -2.362 . . . . 0.0 107.194 170.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.9 mttm -151.28 149.25 29.15 Favored 'General case' 0 C--N 1.367 1.343 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.173 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -104.97 150.11 25.19 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.91 2.484 . . . . 0.0 110.076 -161.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 55.8 mtmt -132.31 138.39 47.8 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.559 1.943 . . . . 0.0 106.035 177.743 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.4 m -124.41 113.43 18.16 Favored 'General case' 0 C--N 1.359 1.001 0 C-N-CA 124.336 1.054 . . . . 0.0 108.685 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.444 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 74.5 m-85 -113.0 -148.36 0.43 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 127.112 2.165 . . . . 0.0 106.311 178.312 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -133.77 155.93 48.91 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 175.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -86.98 121.09 28.96 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 172.351 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 122.069 0.938 . . . . 0.0 109.837 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.9 mt -123.75 115.7 45.96 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 174.647 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.6 pt -99.88 -177.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.382 0 C-N-CA 125.367 1.467 . . . . 0.0 109.777 -179.094 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -127.36 77.58 1.75 Allowed 'General case' 0 C--N 1.362 1.123 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -173.853 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.7 t -128.63 125.44 63.51 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.535 -2.395 . . . . 0.0 104.535 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -78.27 138.78 38.78 Favored 'General case' 0 C--N 1.367 1.338 0 C-N-CA 127.091 2.156 . . . . 0.0 110.914 -177.705 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 p -147.96 -176.35 5.24 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-O 121.421 0.629 . . . . 0.0 109.606 -166.865 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.11 27.3 0.42 Allowed 'General case' 0 C--N 1.359 0.984 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 163.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.9 p -174.44 151.25 1.57 Allowed Pre-proline 0 C--N 1.364 1.213 0 C-N-CA 124.669 1.188 . . . . 0.0 108.137 -170.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -69.12 -17.15 40.62 Favored 'Trans proline' 0 C--N 1.361 1.185 1 C-N-CA 125.333 4.022 . . . . 0.0 115.305 165.059 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.02 6.89 33.83 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 126.093 1.757 . . . . 0.0 113.746 172.385 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -113.0 25.42 11.41 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 126.917 2.087 . . . . 0.0 107.366 167.129 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.9 t -145.2 -18.26 0.49 Allowed 'General case' 0 C--N 1.356 0.857 0 C-N-CA 126.329 1.852 . . . . 0.0 109.549 -175.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -88.02 1.26 54.62 Favored 'General case' 0 C--N 1.37 1.496 0 CA-C-N 121.147 1.794 . . . . 0.0 110.464 177.26 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -82.79 -55.34 0.53 Allowed Pre-proline 0 C--N 1.359 1.011 0 C-N-CA 129.346 3.058 . . . . 0.0 110.955 171.155 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.83 -39.09 6.77 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 124.99 3.793 . . . . 0.0 113.79 172.724 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.8 m -70.18 -29.42 66.29 Favored 'General case' 0 C--N 1.367 1.347 0 C-N-CA 127.601 2.36 . . . . 0.0 114.828 -179.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -88.08 -8.27 55.75 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.922 1.289 . . . . 0.0 113.204 170.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -87.71 -20.42 26.25 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 125.797 1.639 . . . . 0.0 111.157 167.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.3 mt -92.91 -66.47 0.92 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.663 2.385 . . . . 0.0 111.016 177.578 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.42 -7.48 31.6 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.682 2.393 . . . . 0.0 112.447 -167.055 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.56 -80.75 0.52 Allowed Glycine 0 C--N 1.364 2.1 0 C-N-CA 124.953 1.263 . . . . 0.0 113.738 165.318 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.29 -11.2 0.42 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.762 1.625 . . . . 0.0 107.167 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t -105.78 70.59 0.87 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 126.811 2.045 . . . . 0.0 105.842 176.694 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.81 129.39 48.21 Favored 'General case' 0 C--N 1.36 1.033 0 C-N-CA 125.718 1.607 . . . . 0.0 107.042 -174.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 89.37 0.61 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.208 -2.357 . . . . 0.0 107.208 171.39 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.48 115.66 27.87 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 125.253 1.421 . . . . 0.0 109.653 -173.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -128.89 142.97 50.78 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 -171.501 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.7 115.37 9.07 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -174.236 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 92.1 mtp -113.29 121.92 45.86 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 126.28 1.832 . . . . 0.0 106.183 -177.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 78.58 -84.34 0.02 OUTLIER 'General case' 0 C--N 1.38 1.899 0 C-N-CA 127.385 2.274 . . . . 0.0 111.332 173.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -165.11 48.95 0.28 Allowed Glycine 0 N--CA 1.434 -1.471 0 N-CA-C 107.54 -2.224 . . . . 0.0 107.54 171.71 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -151.75 150.86 30.66 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 171.078 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.01 154.05 20.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.016 2.526 . . . . 0.0 110.472 -162.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.479 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 53.2 mtmt -134.74 140.81 46.22 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 126.623 1.969 . . . . 0.0 105.945 177.502 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -125.86 128.02 46.96 Favored 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.417 1.087 . . . . 0.0 108.067 178.247 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.479 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 61.0 m-85 -128.42 -157.73 0.84 Allowed 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -177.841 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -132.66 89.81 2.69 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -115.82 99.44 7.3 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 105.002 -2.221 . . . . 0.0 105.002 172.897 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.377 0 CA-C-N 116.174 -0.466 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 81.3 p . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 122.035 0.921 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.3 mt -125.71 113.38 34.45 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 N-CA-C 102.832 -3.025 . . . . 0.0 102.832 175.303 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.6 pt -100.64 -179.05 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.17 -177.849 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -124.52 73.94 1.29 Allowed 'General case' 0 C--N 1.363 1.156 0 C-N-CA 124.952 1.301 . . . . 0.0 108.397 -173.071 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.96 126.51 64.76 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 174.009 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -84.26 140.96 31.31 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 126.424 1.89 . . . . 0.0 109.146 -175.944 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.96 -178.79 6.38 Favored 'General case' 0 C--N 1.357 0.909 0 CA-C-O 121.552 0.692 . . . . 0.0 110.41 -164.822 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -154.94 25.19 0.43 Allowed 'General case' 0 C--N 1.358 0.959 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 167.233 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.5 p -173.81 152.07 1.93 Allowed Pre-proline 0 C--N 1.365 1.274 0 C-N-CA 124.653 1.181 . . . . 0.0 107.975 -172.776 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -69.79 -17.89 37.18 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 125.269 3.98 . . . . 0.0 115.288 164.512 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.2 tptt -78.89 -13.74 59.63 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.676 1.99 . . . . 0.0 114.374 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -90.37 -3.71 57.54 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 127.239 2.215 . . . . 0.0 110.077 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.19 -14.15 12.33 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.285 2.234 . . . . 0.0 109.138 179.725 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -85.14 -3.77 58.92 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 126.071 1.748 . . . . 0.0 111.013 174.874 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -77.83 -59.33 0.8 Allowed Pre-proline 0 N--CA 1.441 -0.906 0 C-N-CA 129.408 3.083 . . . . 0.0 111.907 170.832 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -71.14 -39.96 3.62 Favored 'Trans proline' 0 C--N 1.364 1.344 0 C-N-CA 125.138 3.892 . . . . 0.0 113.841 175.111 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.72 -29.7 66.04 Favored 'General case' 0 C--N 1.367 1.369 0 C-N-CA 127.487 2.315 . . . . 0.0 114.294 -177.115 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -88.04 -8.19 55.92 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 124.889 1.276 . . . . 0.0 113.143 171.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -87.07 -19.94 27.87 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 125.608 1.563 . . . . 0.0 111.443 165.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.4 mt -92.83 -66.51 0.92 Allowed 'General case' 0 C--N 1.364 1.227 0 C-N-CA 127.666 2.386 . . . . 0.0 111.122 178.211 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -95.53 -10.4 29.77 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.991 2.516 . . . . 0.0 112.247 -167.769 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.35 -79.97 0.37 Allowed Glycine 0 C--N 1.366 2.198 0 C-N-CA 124.863 1.221 . . . . 0.0 113.351 165.517 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.76 -14.01 0.43 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.661 1.584 . . . . 0.0 107.072 -174.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.7 t -104.56 70.1 0.93 Allowed 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.866 2.066 . . . . 0.0 106.146 176.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.1 122.89 38.47 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.134 1.774 . . . . 0.0 106.813 -176.276 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.23 84.01 0.68 Allowed Glycine 0 C--N 1.364 2.097 0 N-CA-C 107.597 -2.201 . . . . 0.0 107.597 171.718 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.86 115.8 28.45 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.298 1.439 . . . . 0.0 109.689 -171.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -122.57 145.55 48.24 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 102.984 -2.969 . . . . 0.0 102.984 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.89 132.05 28.09 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.747 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 96.8 mtp -105.46 73.39 1.02 Allowed 'General case' 0 C--N 1.359 1.009 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 175.259 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -0.76 68.28 0.0 OUTLIER 'General case' 0 C--N 1.378 1.813 1 C-N-CA 135.193 5.397 . . . . 0.0 118.537 -175.354 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 160.61 -42.24 0.43 Allowed Glycine 0 C--N 1.355 1.624 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -161.799 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -153.96 155.4 35.53 Favored 'General case' 0 C--N 1.37 1.482 0 CA-C-N 119.264 1.532 . . . . 0.0 109.369 179.74 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.8 t -107.02 153.63 22.31 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 129.275 3.03 . . . . 0.0 110.519 -165.266 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -133.37 137.18 45.75 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 126.79 2.036 . . . . 0.0 106.557 176.148 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 63.4 m -121.11 122.7 40.6 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 124.369 1.067 . . . . 0.0 108.721 177.935 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -123.63 -149.7 0.43 Allowed 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 178.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -133.26 156.73 47.03 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 105.761 -1.94 . . . . 0.0 105.761 177.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -88.31 124.34 33.8 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 171.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 90.4 m . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.8 mt -120.37 121.02 64.53 Favored 'Isoleucine or valine' 0 C--N 1.361 1.093 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 177.832 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.5 pt -103.15 -171.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.289 0 C-N-CA 125.538 1.535 . . . . 0.0 108.936 177.554 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -134.99 91.62 2.77 Favored 'General case' 0 C--N 1.36 1.046 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.941 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.46 124.37 48.37 Favored 'Isoleucine or valine' 0 C--N 1.359 1.007 0 N-CA-C 103.251 -2.87 . . . . 0.0 103.251 169.746 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -79.32 134.63 36.61 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 126.689 1.996 . . . . 0.0 109.814 -178.485 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.5 p -143.32 -177.87 5.59 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-O 121.505 0.669 . . . . 0.0 110.052 -163.453 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.3 t -152.42 22.29 0.63 Allowed 'General case' 0 C--N 1.358 0.948 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 168.556 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.2 p -173.49 151.84 2.03 Favored Pre-proline 0 C--N 1.364 1.237 0 C-N-CA 124.455 1.102 . . . . 0.0 108.28 -171.102 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -69.45 -17.79 38.79 Favored 'Trans proline' 0 C--N 1.36 1.177 1 C-N-CA 125.377 4.051 . . . . 0.0 115.153 164.139 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -77.91 -15.28 59.13 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.02 2.128 . . . . 0.0 114.455 172.483 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -89.67 -4.49 57.73 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 127.256 2.222 . . . . 0.0 110.005 171.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.5 t -113.18 -13.49 12.99 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 127.236 2.214 . . . . 0.0 109.245 178.923 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.4 m -85.29 -4.03 59.02 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 126.128 1.771 . . . . 0.0 111.057 174.6 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -78.61 -58.85 0.73 Allowed Pre-proline 0 C--N 1.356 0.882 0 C-N-CA 129.499 3.119 . . . . 0.0 111.7 171.05 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.21 -42.23 3.11 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 125.253 3.969 . . . . 0.0 113.725 174.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -69.43 -30.77 68.78 Favored 'General case' 0 C--N 1.367 1.367 0 C-N-CA 127.451 2.3 . . . . 0.0 114.888 -177.458 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -87.97 -7.02 57.7 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 124.817 1.247 . . . . 0.0 113.495 171.915 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -85.79 -25.74 26.16 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 125.913 1.685 . . . . 0.0 110.956 165.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.7 mt -89.36 -63.3 1.31 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.553 2.341 . . . . 0.0 111.781 179.706 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.77 -8.84 25.31 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.786 2.434 . . . . 0.0 111.898 -167.495 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.14 -79.94 0.48 Allowed Glycine 0 C--N 1.365 2.189 0 C-N-CA 125.048 1.309 . . . . 0.0 113.551 165.237 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -147.31 -11.45 0.42 Allowed 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.711 1.604 . . . . 0.0 106.98 -175.43 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -105.26 69.51 0.85 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 126.887 2.075 . . . . 0.0 106.132 177.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.22 128.13 46.73 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 125.842 1.657 . . . . 0.0 106.723 -175.956 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.18 86.03 0.5 Allowed Glycine 0 C--N 1.362 1.975 0 N-CA-C 107.017 -2.433 . . . . 0.0 107.017 170.999 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.84 113.8 25.91 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 125.14 1.376 . . . . 0.0 109.832 -171.483 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -121.52 144.13 48.89 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 -173.595 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.82 110.76 6.23 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 -178.491 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.7 mtt -115.26 126.06 54.06 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.751 2.02 . . . . 0.0 105.695 -175.797 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 t30 81.67 -85.64 0.02 OUTLIER 'General case' 0 C--N 1.382 1.991 0 C-N-CA 127.32 2.248 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -168.86 50.84 0.22 Allowed Glycine 0 N--CA 1.433 -1.525 0 N-CA-C 106.527 -2.629 . . . . 0.0 106.527 169.363 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -151.41 149.98 29.91 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 174.595 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.4 t -104.94 150.06 25.21 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 127.686 2.395 . . . . 0.0 110.368 -162.785 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -132.36 138.88 47.9 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 126.812 2.045 . . . . 0.0 106.395 177.111 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -123.16 121.99 37.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 124.334 1.053 . . . . 0.0 108.546 178.087 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -120.6 -158.98 0.77 Allowed 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.156 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -133.32 89.14 2.57 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 -178.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -115.87 100.59 8.1 Favored 'General case' 0 C--N 1.358 0.963 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 173.479 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.397 0 CA-C-N 116.247 -0.433 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 121.548 0.689 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 57.1 mt -105.07 124.08 59.58 Favored 'Isoleucine or valine' 0 C--N 1.363 1.193 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 178.598 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.7 pt -100.87 -171.62 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 126.098 1.759 . . . . 0.0 110.111 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -130.99 82.46 2.05 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -176.309 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 t -132.84 128.05 56.44 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.56 -2.755 . . . . 0.0 103.56 172.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -83.03 132.0 35.15 Favored 'General case' 0 C--N 1.364 1.234 0 C-N-CA 126.084 1.754 . . . . 0.0 109.551 -177.328 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -140.83 170.03 16.51 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -166.018 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -152.14 25.91 0.62 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 170.577 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -168.73 149.31 4.23 Favored Pre-proline 0 C--N 1.36 1.032 0 N-CA-C 105.175 -2.158 . . . . 0.0 105.175 -177.686 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -71.43 -15.48 31.06 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.469 3.446 . . . . 0.0 114.394 168.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.43 -11.65 59.96 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.047 2.539 . . . . 0.0 113.736 172.24 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -94.24 -3.93 49.8 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.509 2.324 . . . . 0.0 110.138 173.478 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.5 t -118.12 -13.41 9.95 Favored 'General case' 0 C--N 1.36 1.061 0 C-N-CA 126.886 2.074 . . . . 0.0 108.895 -177.383 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -88.03 1.0 55.26 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 125.897 1.679 . . . . 0.0 110.949 172.651 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -79.69 -58.8 0.61 Allowed Pre-proline 0 C--N 1.359 1.003 0 C-N-CA 129.165 2.986 . . . . 0.0 111.592 170.871 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.23 -40.02 3.49 Favored 'Trans proline' 0 C--N 1.365 1.404 0 C-N-CA 125.024 3.816 . . . . 0.0 113.668 175.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -74.3 -25.67 59.72 Favored 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.591 2.356 . . . . 0.0 114.669 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.13 -8.16 55.84 Favored 'General case' 0 C--N 1.371 1.531 0 CA-C-N 120.15 1.341 . . . . 0.0 113.248 168.122 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -86.91 -19.71 28.45 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 125.565 1.546 . . . . 0.0 111.398 166.56 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.9 mt -93.54 -65.92 0.96 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.575 2.35 . . . . 0.0 111.133 177.606 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -95.41 -6.73 40.23 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 127.797 2.439 . . . . 0.0 112.35 -167.407 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.64 -80.11 0.45 Allowed Glycine 0 C--N 1.365 2.188 0 C-N-CA 125.103 1.335 . . . . 0.0 113.392 165.459 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -146.68 -5.87 0.54 Allowed 'General case' 0 C--N 1.353 0.745 0 C-N-CA 125.722 1.609 . . . . 0.0 106.903 -177.164 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 t -102.22 73.24 1.34 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.092 2.157 . . . . 0.0 106.907 179.375 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -152.02 116.55 5.06 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.253 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -108.97 72.61 0.2 Allowed Glycine 0 C--N 1.36 1.862 0 N-CA-C 106.481 -2.648 . . . . 0.0 106.481 169.035 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.11 140.54 34.98 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 128.366 2.666 . . . . 0.0 111.484 -167.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -122.13 142.97 49.83 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.787 1.235 . . . . 0.0 107.79 -163.41 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.5 t -117.91 103.73 10.23 Favored 'General case' 0 C--N 1.353 0.732 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 178.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.7 mtp -111.83 121.94 46.43 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 176.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 78.32 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.383 2.051 0 C-N-CA 127.781 2.432 . . . . 0.0 110.706 178.618 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 53.56 0.18 Allowed Glycine 0 N--CA 1.433 -1.5 0 N-CA-C 105.299 -3.121 . . . . 0.0 105.299 168.574 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -151.88 151.82 31.78 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 179.031 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.98 141.2 36.99 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 126.497 1.919 . . . . 0.0 109.907 -163.296 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -120.08 146.64 45.73 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.669 1.988 . . . . 0.0 106.746 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.1 m -117.13 137.7 52.13 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.114 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -132.41 -179.98 5.77 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 105.112 -2.181 . . . . 0.0 105.112 -178.554 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -126.34 88.01 2.77 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 -177.545 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -131.5 98.66 4.57 Favored 'General case' 0 C--N 1.357 0.893 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 178.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.377 0 CA-C-N 116.133 -0.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 98.3 mt -105.05 126.44 60.01 Favored 'Isoleucine or valine' 0 C--N 1.368 1.389 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 -176.531 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.3 pt -106.13 -174.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.037 0 C-N-CA 125.751 1.62 . . . . 0.0 110.093 -172.622 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -130.1 82.34 2.06 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -177.206 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 t -130.79 126.17 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.123 0 N-CA-C 103.101 -2.926 . . . . 0.0 103.101 171.457 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -83.23 131.59 35.09 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 125.673 1.589 . . . . 0.0 109.519 -175.953 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.8 p -138.72 171.84 13.75 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -165.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -152.88 26.73 0.55 Allowed 'General case' 0 C--N 1.356 0.886 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 170.202 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.8 p -170.18 148.39 2.98 Favored Pre-proline 0 C--N 1.36 1.056 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -177.443 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -71.14 -16.29 31.91 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 124.293 3.329 . . . . 0.0 114.801 168.965 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -84.08 -0.36 51.51 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.564 1.946 . . . . 0.0 114.449 171.525 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -97.17 -0.64 46.54 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 127.115 2.166 . . . . 0.0 109.619 168.118 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.6 t -122.69 -12.52 8.08 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 127.013 2.125 . . . . 0.0 108.866 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -87.68 1.11 54.64 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 126.797 2.039 . . . . 0.0 110.16 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -81.4 -58.73 0.48 Allowed Pre-proline 0 N--CA 1.44 -0.957 0 C-N-CA 129.347 3.059 . . . . 0.0 111.096 171.342 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -71.52 -40.33 3.04 Favored 'Trans proline' 0 C--N 1.364 1.393 0 C-N-CA 124.972 3.782 . . . . 0.0 113.534 173.762 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.0 m -71.88 -23.96 61.58 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 127.353 2.261 . . . . 0.0 114.764 -179.325 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -88.09 -9.06 54.46 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.471 1.487 . . . . 0.0 114.117 166.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -88.08 -20.07 26.22 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 125.525 1.53 . . . . 0.0 111.445 167.948 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.7 mt -98.8 -71.79 0.68 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.437 2.295 . . . . 0.0 110.292 179.368 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.82 40.48 1.56 Allowed 'General case' 0 C--N 1.359 1.004 0 C-N-CA 128.643 2.777 . . . . 0.0 109.963 -169.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.84 83.97 1.5 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 126.212 1.863 . . . . 0.0 116.051 -167.59 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.3 m -154.95 -61.48 0.12 Allowed 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 103.508 -2.775 . . . . 0.0 103.508 171.237 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.7 t -137.35 71.78 1.41 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 104.184 -2.525 . . . . 0.0 104.184 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.45 135.85 34.52 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 125.311 1.444 . . . . 0.0 111.899 177.079 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.51 148.62 18.38 Favored Glycine 0 C--N 1.362 2.002 0 N-CA-C 106.686 -2.566 . . . . 0.0 106.686 164.558 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.98 118.5 4.51 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 -170.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -122.28 147.15 46.58 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.5 t -123.05 107.93 12.33 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 177.763 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.2 mmm -119.54 123.69 44.57 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.755 -2.313 . . . . 0.0 104.755 177.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.08 -84.35 0.02 OUTLIER 'General case' 0 C--N 1.382 1.983 0 C-N-CA 127.645 2.378 . . . . 0.0 110.904 177.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.67 55.92 0.16 Allowed Glycine 0 N--CA 1.433 -1.51 0 N-CA-C 104.808 -3.317 . . . . 0.0 104.808 168.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -152.91 152.18 31.2 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -104.93 138.36 41.29 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.122 2.169 . . . . 0.0 108.882 -166.73 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -115.56 145.85 42.28 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 125.814 1.646 . . . . 0.0 107.227 169.769 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.7 m -114.42 148.51 37.61 Favored 'General case' 0 C--N 1.357 0.905 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 169.747 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -139.69 155.28 47.47 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -174.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -111.38 111.61 22.77 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 126.42 1.888 . . . . 0.0 107.142 -176.375 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -117.37 165.96 12.88 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 176.934 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.379 0 CA-C-N 116.027 -0.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 122.064 0.935 . . . . 0.0 109.973 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.8 mt -121.63 117.16 51.67 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 174.433 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.8 pt -101.9 -174.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.345 0 C-N-CA 125.435 1.494 . . . . 0.0 108.773 177.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -135.01 86.6 2.27 Favored 'General case' 0 C--N 1.361 1.1 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -179.198 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.2 t -127.69 124.72 63.88 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 N-CA-C 103.573 -2.751 . . . . 0.0 103.573 170.687 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -85.69 129.76 34.74 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 126.191 1.796 . . . . 0.0 109.521 -171.824 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.4 p -138.36 -175.72 4.21 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.36 0.664 . . . . 0.0 109.607 -160.561 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -153.79 26.02 0.5 Allowed 'General case' 0 C--N 1.359 0.982 0 N-CA-C 105.585 -2.005 . . . . 0.0 105.585 164.938 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.5 p -173.87 150.55 1.69 Allowed Pre-proline 0 C--N 1.363 1.162 0 C-N-CA 124.604 1.162 . . . . 0.0 108.241 -171.525 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -68.54 -17.84 43.27 Favored 'Trans proline' 0 C--N 1.36 1.16 1 C-N-CA 125.331 4.021 . . . . 0.0 115.444 164.217 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -75.26 -20.74 59.02 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.015 2.126 . . . . 0.0 114.148 171.713 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.95 1.55 55.28 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.239 2.216 . . . . 0.0 110.541 173.878 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.5 t -117.44 -12.27 10.44 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 127.616 2.366 . . . . 0.0 108.785 177.264 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.4 m -86.02 -4.75 59.24 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 125.934 1.694 . . . . 0.0 111.831 174.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -56.79 1.19 Allowed Pre-proline 0 C--N 1.359 1.016 0 C-N-CA 127.382 2.273 . . . . 0.0 112.634 167.797 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.86 -41.62 2.77 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 124.88 3.72 . . . . 0.0 113.587 176.981 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.6 m -70.71 -29.66 66.0 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.757 2.423 . . . . 0.0 114.593 -178.059 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -88.12 -6.64 57.79 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.623 1.169 . . . . 0.0 113.332 171.591 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -88.68 -21.11 24.08 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 125.723 1.609 . . . . 0.0 111.068 166.347 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.3 mt -92.39 -65.65 0.99 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 127.525 2.33 . . . . 0.0 111.26 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -97.69 -5.62 34.83 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.964 2.506 . . . . 0.0 112.26 -167.611 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.26 -79.33 0.52 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.027 1.298 . . . . 0.0 113.891 164.331 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.8 t -152.93 -7.53 0.18 Allowed 'General case' 0 C--N 1.353 0.75 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 -175.345 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.5 t -107.2 68.02 0.71 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.014 2.126 . . . . 0.0 105.528 174.769 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.1 126.62 47.41 Favored 'General case' 0 C--N 1.359 1.016 0 C-N-CA 125.806 1.642 . . . . 0.0 106.87 -176.599 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.24 85.37 0.56 Allowed Glycine 0 C--N 1.361 1.969 0 N-CA-C 107.265 -2.334 . . . . 0.0 107.265 170.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.9 113.02 24.95 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 125.253 1.421 . . . . 0.0 109.539 -171.963 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.08 143.15 49.69 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 -171.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -143.7 115.63 8.31 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -177.028 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' MET . . . . . 0.459 ' HG2' ' HZ2' ' A' ' 35' ' ' LYS . 26.3 mmt -121.0 127.41 51.74 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 -176.164 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 79.72 -85.17 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.544 2.337 . . . . 0.0 110.571 175.386 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.44 51.91 0.21 Allowed Glycine 0 N--CA 1.434 -1.464 0 N-CA-C 106.635 -2.586 . . . . 0.0 106.635 169.717 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -151.61 148.83 28.44 Favored 'General case' 0 C--N 1.369 1.426 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.009 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -105.1 154.05 20.68 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 128.022 2.529 . . . . 0.0 109.963 -163.44 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.496 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 32.4 mtmm -138.21 137.06 37.2 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 178.713 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 57.7 m -120.65 124.42 45.18 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 124.355 1.062 . . . . 0.0 108.179 178.353 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.496 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 59.2 m-85 -124.54 -158.78 0.84 Allowed 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 105.702 -1.962 . . . . 0.0 105.702 -179.329 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -132.09 95.76 3.75 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 70.1 m-80 -139.85 93.42 2.65 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 104.807 -2.294 . . . . 0.0 104.807 174.407 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.384 0 CA-C-N 116.038 -0.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 86.8 m . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.9 mt -120.35 116.92 51.68 Favored 'Isoleucine or valine' 0 C--N 1.361 1.083 0 N-CA-C 104.199 -2.519 . . . . 0.0 104.199 178.853 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.3 pt -101.12 179.52 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.335 0 C-N-CA 125.419 1.488 . . . . 0.0 110.236 -178.757 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -119.81 73.89 0.99 Allowed 'General case' 0 C--N 1.361 1.088 0 C-N-CA 125.412 1.485 . . . . 0.0 108.546 -172.379 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -130.57 126.39 60.59 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 N-CA-C 105.521 -2.029 . . . . 0.0 105.521 175.289 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -83.58 138.18 33.5 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 127.131 2.172 . . . . 0.0 109.611 179.847 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -143.26 -177.75 5.52 Favored 'General case' 0 C--N 1.359 1.006 0 CA-C-O 121.735 0.779 . . . . 0.0 109.844 -165.957 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.9 t -149.08 18.73 0.97 Allowed 'General case' 0 C--N 1.356 0.876 0 C-N-CA 126.06 1.744 . . . . 0.0 106.495 168.566 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 51.9 p -173.67 155.52 2.57 Favored Pre-proline 0 C--N 1.364 1.236 0 C-N-CA 124.673 1.189 . . . . 0.0 108.292 -171.933 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -69.68 -18.59 37.29 Favored 'Trans proline' 0 C--N 1.362 1.24 1 C-N-CA 125.41 4.073 . . . . 0.0 115.025 163.767 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -79.26 -11.22 59.95 Favored 'General case' 0 C--N 1.369 1.431 0 C-N-CA 126.999 2.12 . . . . 0.0 114.768 173.416 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -94.02 -4.79 48.9 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 127.902 2.481 . . . . 0.0 109.974 171.791 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.3 t -111.69 -14.45 13.61 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.468 2.307 . . . . 0.0 108.65 179.605 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -84.79 -1.19 56.04 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 126.655 1.982 . . . . 0.0 110.753 173.038 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -81.77 -57.47 0.52 Allowed Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 129.056 2.942 . . . . 0.0 110.928 172.17 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.33 -45.37 1.85 Allowed 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 124.876 3.717 . . . . 0.0 113.68 172.011 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.88 -29.42 67.71 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 127.416 2.286 . . . . 0.0 115.081 -175.158 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -88.04 -10.83 49.05 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 124.436 1.094 . . . . 0.0 113.429 172.641 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -85.98 -21.22 27.96 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 125.858 1.663 . . . . 0.0 112.086 166.375 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 mt -94.97 -69.05 0.77 Allowed 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.307 2.243 . . . . 0.0 110.942 -178.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -91.4 -27.83 18.07 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 128.035 2.534 . . . . 0.0 111.856 -167.97 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.75 -171.02 15.83 Favored Glycine 0 C--N 1.362 1.997 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.417 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.1 m -71.8 -4.88 30.32 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 128.003 2.521 . . . . 0.0 115.571 -174.897 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.3 t -108.65 64.08 0.61 Allowed 'General case' 0 C--N 1.363 1.193 0 C-N-CA 127.059 2.144 . . . . 0.0 106.411 168.359 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.62 143.35 43.95 Favored 'General case' 0 C--N 1.364 1.205 0 C-N-CA 126.399 1.879 . . . . 0.0 106.924 176.557 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.71 85.49 0.52 Allowed Glycine 0 C--N 1.361 1.927 0 N-CA-C 107.559 -2.216 . . . . 0.0 107.559 171.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.55 111.07 23.06 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 125.246 1.418 . . . . 0.0 109.037 -173.368 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -123.14 141.92 51.45 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 104.181 -2.525 . . . . 0.0 104.181 -171.111 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.82 109.25 6.19 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 -175.662 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -110.15 123.54 49.93 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 127.071 2.148 . . . . 0.0 106.122 -176.862 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.7 m120 78.54 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.554 2.342 . . . . 0.0 111.05 177.076 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.03 49.77 0.25 Allowed Glycine 0 N--CA 1.435 -1.407 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 170.352 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.453 ' HB3' ' HZ2' ' A' ' 33' ' ' LYS . 9.2 mtpm? -150.52 147.99 28.16 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.308 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.94 151.74 23.53 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 127.842 2.457 . . . . 0.0 110.506 -161.97 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -134.34 139.43 45.64 Favored 'General case' 0 C--N 1.361 1.083 0 C-N-CA 126.726 2.01 . . . . 0.0 106.241 177.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.8 m -121.78 125.77 47.3 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 124.375 1.07 . . . . 0.0 108.576 176.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -126.1 -163.68 1.24 Allowed 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.282 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -132.67 69.6 1.48 Allowed 'General case' 0 C--N 1.36 1.054 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -179.642 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -90.15 -84.74 0.23 Allowed 'General case' 0 C--N 1.359 1.005 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 176.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.411 0 O-C-N 123.048 0.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 122.073 0.94 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp -124.75 116.47 47.46 Favored 'Isoleucine or valine' 0 C--N 1.36 1.051 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 173.894 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -99.87 -179.99 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 125.945 1.698 . . . . 0.0 110.38 -176.071 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -123.36 70.9 1.05 Allowed 'General case' 0 C--N 1.363 1.165 0 C-N-CA 125.021 1.328 . . . . 0.0 108.422 -173.17 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.7 t -128.63 132.71 67.57 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.154 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 173.682 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -84.66 140.99 30.93 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 125.869 1.668 . . . . 0.0 109.425 -174.999 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.5 p -147.07 160.76 42.02 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 121.656 0.741 . . . . 0.0 109.289 -169.379 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.3 t -133.13 -0.29 3.36 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 126.589 1.956 . . . . 0.0 108.171 169.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -152.55 157.36 33.59 Favored Pre-proline 0 C--N 1.364 1.205 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -176.087 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -71.99 -16.16 29.1 Favored 'Trans proline' 0 C--N 1.359 1.095 0 C-N-CA 124.418 3.412 . . . . 0.0 114.702 169.446 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.433 ' HA ' ' HG ' ' A' ' 14' ' ' SER . 75.5 mmtt -83.0 -1.71 53.35 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 126.595 1.958 . . . . 0.0 114.579 170.788 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -99.71 -0.77 39.42 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.773 2.429 . . . . 0.0 109.627 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.9 t -124.34 -14.71 6.89 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.89 2.076 . . . . 0.0 108.439 -173.079 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.433 ' HG ' ' HA ' ' A' ' 11' ' ' LYS . 78.4 p -87.92 3.13 49.71 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 125.44 1.496 . . . . 0.0 110.927 173.278 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -77.49 -59.2 0.86 Allowed Pre-proline 0 C--N 1.359 1.001 0 C-N-CA 129.757 3.223 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -71.23 -38.42 4.85 Favored 'Trans proline' 0 C--N 1.364 1.357 0 C-N-CA 125.121 3.881 . . . . 0.0 113.878 174.156 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -71.68 -29.07 64.19 Favored 'General case' 0 C--N 1.366 1.326 0 C-N-CA 127.647 2.379 . . . . 0.0 114.46 -176.938 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -88.04 -9.0 54.77 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 125.148 1.379 . . . . 0.0 113.135 170.339 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -86.51 -20.53 27.9 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.632 1.573 . . . . 0.0 111.489 166.498 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.4 mt -92.78 -66.63 0.91 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.704 2.402 . . . . 0.0 110.962 177.962 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -95.84 -8.91 32.87 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.972 2.509 . . . . 0.0 112.175 -167.383 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.99 -79.83 0.54 Allowed Glycine 0 C--N 1.364 2.087 0 C-N-CA 125.289 1.423 . . . . 0.0 113.46 165.125 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.1 -6.29 0.44 Allowed 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.064 1.746 . . . . 0.0 106.929 -175.568 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 t -107.02 63.81 0.63 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 126.948 2.099 . . . . 0.0 106.212 177.552 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.73 140.23 52.55 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 125.973 1.709 . . . . 0.0 106.732 -176.875 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.79 -76.07 1.17 Allowed Glycine 0 C--N 1.361 1.962 0 C-N-CA 126.316 1.913 . . . . 0.0 110.943 172.373 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 84.97 98.9 0.04 OUTLIER 'General case' 0 C--N 1.367 1.336 0 C-N-CA 126.823 2.049 . . . . 0.0 110.984 169.024 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -125.44 141.37 52.09 Favored 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -171.552 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.4 t -116.24 124.8 51.12 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -176.171 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.2 mtp -109.34 72.17 0.8 Allowed 'General case' 0 C--N 1.36 1.058 0 N-CA-C 104.43 -2.433 . . . . 0.0 104.43 170.302 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -5.39 72.33 0.0 OUTLIER 'General case' 0 C--N 1.377 1.782 1 C-N-CA 134.63 5.172 . . . . 0.0 118.749 -171.8 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.76 -38.05 0.61 Allowed Glycine 0 C--N 1.354 1.536 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -166.185 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -154.05 157.68 39.38 Favored 'General case' 0 C--N 1.37 1.472 0 CA-C-N 119.45 1.625 . . . . 0.0 108.419 -175.833 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.26 154.62 20.98 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 128.66 2.784 . . . . 0.0 109.56 -166.156 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -129.82 147.49 51.6 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.733 2.013 . . . . 0.0 106.444 173.902 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.5 m -123.14 122.34 38.21 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 175.207 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -115.65 -177.73 3.22 Favored 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 126.541 1.936 . . . . 0.0 106.141 177.383 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -122.56 96.35 5.0 Favored 'General case' 0 C--N 1.359 0.99 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 -177.332 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -134.74 96.83 3.63 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 178.612 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.408 0 CA-C-N 116.097 -0.501 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 53.2 mt -125.61 119.36 54.8 Favored 'Isoleucine or valine' 0 C--N 1.366 1.298 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 176.398 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.4 pt -106.06 -172.63 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.276 0 C-N-CA 125.129 1.372 . . . . 0.0 109.25 178.873 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -135.04 77.49 1.68 Allowed 'General case' 0 C--N 1.361 1.093 0 C-N-CA 124.325 1.05 . . . . 0.0 108.207 -177.23 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.4 t -121.06 122.52 67.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 172.205 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -80.9 133.98 35.65 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 126.757 2.023 . . . . 0.0 110.185 -172.733 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.16 -176.64 5.18 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 121.399 0.618 . . . . 0.0 110.252 -162.634 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -155.0 26.25 0.43 Allowed 'General case' 0 C--N 1.358 0.971 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 165.428 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.7 p -173.63 149.87 1.67 Allowed Pre-proline 0 C--N 1.364 1.23 0 C-N-CA 124.498 1.119 . . . . 0.0 108.369 -170.751 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -68.69 -16.62 42.3 Favored 'Trans proline' 0 C--N 1.362 1.245 1 C-N-CA 125.505 4.137 . . . . 0.0 115.29 165.479 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.01 7.98 28.7 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 126.128 1.771 . . . . 0.0 113.824 171.006 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -113.06 27.75 9.36 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.09 2.156 . . . . 0.0 107.127 166.417 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.6 t -148.12 -19.63 0.34 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.688 1.595 . . . . 0.0 110.189 -175.111 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -85.99 0.85 52.25 Favored 'General case' 0 C--N 1.369 1.424 0 CA-C-N 121.527 1.967 . . . . 0.0 111.476 175.968 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -81.31 -56.49 0.6 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.124 2.97 . . . . 0.0 110.807 170.438 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.1 -42.13 4.4 Favored 'Trans proline' 0 C--N 1.368 1.596 0 C-N-CA 124.964 3.776 . . . . 0.0 113.725 173.08 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.0 m -68.08 -31.61 71.35 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.81 2.444 . . . . 0.0 115.188 -177.873 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -88.06 -8.03 56.13 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 124.986 1.314 . . . . 0.0 112.92 172.928 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -87.84 -20.48 25.99 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 125.679 1.592 . . . . 0.0 111.374 166.508 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -92.85 -66.48 0.92 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.54 2.336 . . . . 0.0 111.116 178.706 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.15 -10.26 28.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 127.908 2.483 . . . . 0.0 111.999 -168.197 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.94 0.46 Allowed Glycine 0 C--N 1.364 2.086 0 C-N-CA 125.011 1.291 . . . . 0.0 113.672 164.685 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.52 -10.63 0.47 Allowed 'General case' 0 C--N 1.355 0.806 0 C-N-CA 125.851 1.661 . . . . 0.0 107.266 -174.14 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.07 69.49 0.76 Allowed 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.88 2.072 . . . . 0.0 105.681 176.509 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.89 125.44 41.6 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 125.695 1.598 . . . . 0.0 106.826 -174.768 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.64 87.42 0.57 Allowed Glycine 0 C--N 1.362 2.0 0 N-CA-C 107.276 -2.33 . . . . 0.0 107.276 170.698 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.79 113.54 25.84 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.238 1.415 . . . . 0.0 109.667 -172.236 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -124.43 146.39 48.94 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 103.963 -2.606 . . . . 0.0 103.963 -172.577 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.45 116.1 7.19 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 -175.912 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 68.9 mtt -121.11 126.39 49.65 Favored 'General case' 0 C--N 1.361 1.074 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 -176.04 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.33 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.505 2.322 . . . . 0.0 110.906 173.946 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.88 50.65 0.25 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 107.388 -2.285 . . . . 0.0 107.388 171.105 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -151.99 150.61 30.19 Favored 'General case' 0 C--N 1.368 1.39 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.846 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.0 151.96 23.3 Favored 'General case' 0 C--N 1.36 1.029 0 C-N-CA 128.499 2.72 . . . . 0.0 109.644 -165.305 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -135.4 137.63 42.48 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 179.013 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.68 110.65 14.64 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 124.465 1.106 . . . . 0.0 108.437 -179.321 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -108.36 -160.73 0.74 Allowed 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 127.431 2.292 . . . . 0.0 107.189 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 56.7 m-80 -130.19 98.55 4.76 Favored 'General case' 0 C--N 1.359 1.003 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -135.34 -98.18 0.24 Allowed 'General case' 0 C--N 1.357 0.925 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 175.248 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.395 0 CA-C-N 117.847 0.294 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 41.3 p . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 56.0 mt -104.97 128.1 59.0 Favored 'Isoleucine or valine' 0 C--N 1.364 1.204 0 C-N-CA 125.631 1.572 . . . . 0.0 107.019 -170.327 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 pt -106.28 -173.21 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 126.229 1.811 . . . . 0.0 109.74 -175.478 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -130.96 79.95 1.92 Allowed 'General case' 0 C--N 1.362 1.112 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -175.971 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.8 127.07 63.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 173.615 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -80.83 131.8 35.42 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 126.133 1.773 . . . . 0.0 110.155 -176.515 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -141.28 171.08 14.56 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -166.316 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.77 22.37 0.69 Allowed 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 174.194 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 p -171.09 149.23 2.63 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -174.781 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -71.84 -15.37 29.8 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 124.22 3.28 . . . . 0.0 114.747 168.685 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -79.3 -11.75 59.94 Favored 'General case' 0 C--N 1.371 1.508 0 C-N-CA 127.231 2.212 . . . . 0.0 114.323 171.525 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -89.77 -5.17 57.22 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 127.335 2.254 . . . . 0.0 110.178 171.357 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.0 t -118.19 -11.78 10.07 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.162 2.185 . . . . 0.0 108.592 -176.685 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -88.0 1.26 54.58 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 126.497 1.919 . . . . 0.0 110.38 171.569 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -80.93 -58.03 0.54 Allowed Pre-proline 0 C--N 1.356 0.89 0 C-N-CA 129.121 2.969 . . . . 0.0 111.301 170.998 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -72.04 -39.44 3.15 Favored 'Trans proline' 0 C--N 1.364 1.377 0 C-N-CA 125.072 3.848 . . . . 0.0 113.582 173.883 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -73.16 -22.69 60.45 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 127.185 2.194 . . . . 0.0 114.571 -179.427 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -88.14 -9.73 52.26 Favored 'General case' 0 C--N 1.374 1.633 0 CA-C-N 120.455 1.48 . . . . 0.0 114.068 166.141 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.39 -19.36 28.21 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.663 1.585 . . . . 0.0 111.334 168.337 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.6 mt -98.69 -71.33 0.69 Allowed 'General case' 0 C--N 1.365 1.25 0 C-N-CA 127.539 2.336 . . . . 0.0 110.221 178.27 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -106.42 42.43 1.28 Allowed 'General case' 0 C--N 1.361 1.072 0 C-N-CA 128.655 2.782 . . . . 0.0 109.955 -169.781 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -79.47 89.04 1.22 Allowed Glycine 0 C--N 1.365 2.171 0 C-N-CA 126.488 1.994 . . . . 0.0 115.939 -169.078 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.0 t -168.06 -61.37 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 103.275 -2.861 . . . . 0.0 103.275 174.308 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -137.28 70.33 1.4 Allowed 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 179.352 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.61 138.93 31.83 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.532 1.533 . . . . 0.0 111.606 177.261 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -106.31 152.66 17.04 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 105.893 -2.883 . . . . 0.0 105.893 165.568 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.31 121.96 4.86 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -171.407 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -124.73 141.27 52.22 Favored 'General case' 0 C--N 1.361 1.071 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 -179.128 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.2 t -117.56 103.37 10.0 Favored 'General case' 0 C--N 1.352 0.71 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.913 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.6 mmt -108.84 121.61 45.46 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 178.857 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.466 3.6 p-10 68.66 -78.06 0.05 OUTLIER 'General case' 0 C--N 1.38 1.905 0 C-N-CA 128.718 2.807 . . . . 0.0 113.95 -177.842 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.28 54.46 0.14 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 105.407 -3.077 . . . . 0.0 105.407 170.664 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -153.92 152.12 30.24 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.2 t -104.99 141.32 36.78 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.637 1.975 . . . . 0.0 109.435 -164.016 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -119.86 147.04 45.17 Favored 'General case' 0 CA--C 1.499 -0.989 0 C-N-CA 126.571 1.948 . . . . 0.0 106.27 172.486 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -116.33 143.47 45.5 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 172.01 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -133.34 152.76 51.94 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 -174.617 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -113.14 102.8 10.73 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.361 1.865 . . . . 0.0 106.592 -175.989 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -102.26 160.0 14.91 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 177.8 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.362 0 CA-C-N 115.817 -0.629 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 94.1 m . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 26.3 mt -126.49 125.84 68.0 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 174.248 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.2 pt -102.41 -170.53 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 125.966 1.707 . . . . 0.0 109.429 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.98 76.6 1.63 Allowed 'General case' 0 C--N 1.36 1.056 0 C-N-CA 124.333 1.053 . . . . 0.0 108.378 -175.48 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.0 t -129.59 133.26 65.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.132 0 N-CA-C 103.938 -2.615 . . . . 0.0 103.938 173.301 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.75 134.75 35.48 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 125.847 1.659 . . . . 0.0 110.447 -177.041 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.7 p -140.25 -178.98 5.73 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 -169.227 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 55.4 m -154.93 -53.36 0.09 Allowed 'General case' 0 N--CA 1.432 -1.366 0 N-CA-C 100.969 -3.715 . . . . 0.0 100.969 -163.057 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.6 p -111.25 161.91 23.17 Favored Pre-proline 0 C--N 1.362 1.112 0 C-N-CA 127.647 2.379 . . . . 0.0 108.661 177.893 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -71.88 -16.2 29.45 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.468 3.446 . . . . 0.0 114.535 165.803 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -74.73 -17.05 60.71 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 127.759 2.424 . . . . 0.0 114.146 168.941 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -88.85 -2.93 58.83 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 127.649 2.38 . . . . 0.0 110.485 174.864 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.5 t -118.93 -12.45 9.56 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 128.068 2.547 . . . . 0.0 108.207 179.697 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.3 m -86.2 -0.78 56.52 Favored 'General case' 0 C--N 1.371 1.536 0 C-N-CA 126.317 1.847 . . . . 0.0 111.06 172.867 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -77.87 -58.06 0.92 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.193 2.997 . . . . 0.0 111.795 170.817 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.08 -37.7 4.53 Favored 'Trans proline' 0 C--N 1.363 1.309 0 C-N-CA 125.111 3.874 . . . . 0.0 113.886 174.496 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.54 -27.6 64.28 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.309 2.244 . . . . 0.0 114.298 -179.531 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -88.04 -8.94 54.85 Favored 'General case' 0 C--N 1.371 1.534 0 C-N-CA 125.341 1.456 . . . . 0.0 113.141 170.236 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -87.44 -19.58 27.84 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.791 1.636 . . . . 0.0 111.357 167.182 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 mt -95.11 -67.35 0.86 Allowed 'General case' 0 C--N 1.365 1.252 0 C-N-CA 127.696 2.398 . . . . 0.0 110.94 178.694 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -93.37 -11.21 32.84 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 128.198 2.599 . . . . 0.0 112.032 -168.542 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.19 -81.09 0.44 Allowed Glycine 0 C--N 1.364 2.131 0 C-N-CA 125.067 1.318 . . . . 0.0 113.573 164.224 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.6 m -148.46 -8.59 0.38 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 125.952 1.701 . . . . 0.0 106.927 -173.81 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 t -108.25 63.59 0.61 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.969 2.107 . . . . 0.0 105.386 175.391 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.16 130.73 53.15 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 125.959 1.703 . . . . 0.0 107.878 -172.916 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.74 153.16 18.76 Favored Glycine 0 C--N 1.359 1.829 0 N-CA-C 105.837 -2.905 . . . . 0.0 105.837 161.175 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.21 120.39 5.36 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 105.024 -2.213 . . . . 0.0 105.024 -171.457 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -124.7 137.65 54.34 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 -177.181 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -117.94 106.81 13.34 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.443 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.7 mtp -111.34 121.97 46.62 Favored 'General case' 0 C--N 1.361 1.089 0 N-CA-C 105.312 -2.107 . . . . 0.0 105.312 176.69 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.467 12.0 p30 69.99 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.382 1.981 0 C-N-CA 128.627 2.771 . . . . 0.0 113.704 -179.617 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 53.5 0.17 Allowed Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 105.591 -3.003 . . . . 0.0 105.591 170.686 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -152.47 150.77 29.98 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 105.369 -2.085 . . . . 0.0 105.369 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.99 144.58 31.61 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 126.746 2.018 . . . . 0.0 109.788 -162.73 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.412 ' HE2' ' HH ' ' A' ' 37' ' ' TYR . 39.2 mtpt -122.63 145.45 48.35 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 127.145 2.178 . . . . 0.0 106.119 173.544 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 85.8 m -123.84 127.64 48.34 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 122.25 1.024 . . . . 0.0 109.411 177.202 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.412 ' HH ' ' HE2' ' A' ' 35' ' ' LYS . 46.7 m-85 -123.74 -165.77 1.39 Allowed 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 127.762 2.425 . . . . 0.0 105.383 -178.962 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -130.15 128.96 42.84 Favored 'General case' 0 C--N 1.359 0.988 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 177.839 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -111.95 86.54 2.36 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 170.833 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.417 0 CA-C-N 116.13 -0.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 81.2 p . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.75 0.786 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 mt -127.62 124.18 62.9 Favored 'Isoleucine or valine' 0 C--N 1.36 1.05 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 174.902 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.0 pt -104.47 -171.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 126.009 1.723 . . . . 0.0 108.936 177.686 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -132.5 84.0 2.12 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.922 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.5 t -132.15 125.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 N-CA-C 104.111 -2.552 . . . . 0.0 104.111 173.519 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -76.65 137.53 39.5 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.061 2.144 . . . . 0.0 111.007 -179.238 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.7 p -145.39 178.6 7.98 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.83 0.824 . . . . 0.0 110.492 -165.506 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -149.64 19.5 0.92 Allowed 'General case' 0 C--N 1.355 0.846 0 C-N-CA 126.2 1.8 . . . . 0.0 106.65 169.526 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.1 p -172.92 155.7 3.01 Favored Pre-proline 0 C--N 1.363 1.182 0 C-N-CA 124.853 1.261 . . . . 0.0 107.975 -172.935 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -70.56 -18.44 33.22 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 125.143 3.895 . . . . 0.0 115.181 164.273 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.6 -16.13 59.66 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 127.013 2.125 . . . . 0.0 114.374 172.474 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.5 tp60 -89.53 -4.01 58.09 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.614 2.366 . . . . 0.0 110.186 172.996 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -114.09 -13.1 12.47 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 127.737 2.415 . . . . 0.0 108.982 178.762 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.2 m -85.73 -4.12 59.08 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.173 1.789 . . . . 0.0 111.026 174.997 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -78.02 -57.29 0.96 Allowed Pre-proline 0 N--CA 1.441 -0.892 0 C-N-CA 129.393 3.077 . . . . 0.0 112.092 170.795 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.59 -41.31 3.31 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 125.248 3.965 . . . . 0.0 113.943 173.711 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.16 -27.83 64.84 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 127.313 2.245 . . . . 0.0 114.838 -177.86 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -87.99 -10.5 50.2 Favored 'General case' 0 C--N 1.371 1.519 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 170.781 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.96 -19.75 29.97 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 125.639 1.576 . . . . 0.0 111.539 167.365 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.2 mt -93.7 -66.65 0.91 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 127.645 2.378 . . . . 0.0 111.013 177.758 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -96.91 -8.21 31.37 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.643 2.377 . . . . 0.0 112.326 -167.126 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.84 -80.99 0.51 Allowed Glycine 0 C--N 1.364 2.11 0 C-N-CA 125.015 1.293 . . . . 0.0 113.529 165.308 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.66 -8.67 0.42 Allowed 'General case' 0 C--N 1.354 0.782 0 C-N-CA 125.927 1.691 . . . . 0.0 107.153 -174.81 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -107.13 68.0 0.71 Allowed 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.934 2.093 . . . . 0.0 105.683 176.479 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.27 125.82 42.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 C-N-CA 125.815 1.646 . . . . 0.0 107.078 -173.849 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.408 ' HA3' HD21 ' A' ' 39' ' ' ASN . . . -105.28 88.51 0.58 Allowed Glycine 0 C--N 1.359 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.0 107.463 172.025 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.39 116.38 28.92 Favored 'General case' 0 C--N 1.358 0.935 0 C-N-CA 125.043 1.337 . . . . 0.0 109.7 -174.144 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -123.17 141.43 51.98 Favored 'General case' 0 C--N 1.36 1.053 0 N-CA-C 102.317 -3.216 . . . . 0.0 102.317 -174.464 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.92 112.63 10.8 Favored 'General case' 0 CA--C 1.505 -0.787 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.456 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.9 mmt -110.52 119.62 39.76 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 126.806 2.042 . . . . 0.0 106.449 -174.515 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.5 m120 77.26 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.378 1.825 0 C-N-CA 127.452 2.301 . . . . 0.0 111.558 177.492 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -164.55 48.68 0.29 Allowed Glycine 0 C--N 1.352 1.462 0 N-CA-C 106.984 -2.446 . . . . 0.0 106.984 171.47 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -151.22 153.06 34.18 Favored 'General case' 0 C--N 1.366 1.308 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 173.387 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -105.03 152.55 22.6 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 127.458 2.303 . . . . 0.0 110.417 -161.592 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.546 ' HE2' ' HH ' ' A' ' 37' ' ' TYR . 36.6 mtpt -133.92 141.43 47.33 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 127.411 2.285 . . . . 0.0 105.801 178.971 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.2 m -126.95 124.93 40.61 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.595 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.546 ' HH ' ' HE2' ' A' ' 35' ' ' LYS . 62.1 m-85 -123.01 -165.27 1.29 Allowed 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 126.879 2.072 . . . . 0.0 105.922 179.901 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -127.55 93.28 3.67 Favored 'General case' 0 C--N 1.359 1.006 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 178.787 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.408 HD21 ' HA3' ' A' ' 26' ' ' GLY . 71.1 m-80 -133.54 -99.38 0.26 Allowed 'General case' 0 C--N 1.356 0.88 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 175.874 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.372 0 CA-C-N 117.836 0.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 82.3 p . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 121.909 0.862 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.5 mt -123.76 120.16 59.03 Favored 'Isoleucine or valine' 0 C--N 1.361 1.075 0 N-CA-C 103.521 -2.77 . . . . 0.0 103.521 175.897 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.7 pt -104.53 -171.8 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.242 0 C-N-CA 125.497 1.519 . . . . 0.0 108.681 177.045 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -135.04 78.63 1.74 Allowed 'General case' 0 C--N 1.36 1.032 0 C-N-CA 123.995 0.918 . . . . 0.0 108.542 -175.774 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 t -126.6 126.38 68.78 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 N-CA-C 104.392 -2.448 . . . . 0.0 104.392 172.677 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.421 ' HZ3' ' HZ2' ' A' ' 33' ' ' LYS . 64.6 mmtt -88.61 129.7 35.44 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 125.971 1.708 . . . . 0.0 109.132 -171.529 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.9 p -133.85 -174.59 3.57 Favored 'General case' 0 C--N 1.358 0.975 0 C-N-CA 123.797 0.839 . . . . 0.0 109.265 -162.373 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -151.8 22.6 0.69 Allowed 'General case' 0 C--N 1.358 0.949 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 166.609 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 p -175.5 153.39 1.46 Allowed Pre-proline 0 C--N 1.365 1.269 0 C-N-CA 124.59 1.156 . . . . 0.0 108.242 -169.115 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -69.4 -17.89 38.99 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 125.286 3.99 . . . . 0.0 115.113 163.425 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -82.14 -7.33 59.62 Favored 'General case' 0 C--N 1.368 1.41 0 C-N-CA 126.682 1.993 . . . . 0.0 114.658 173.59 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -100.51 6.03 44.21 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.941 2.096 . . . . 0.0 109.156 170.699 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.6 t -120.3 -14.76 8.72 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 127.603 2.361 . . . . 0.0 108.447 177.846 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -84.61 1.09 47.67 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 126.406 1.882 . . . . 0.0 110.876 173.365 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.77 -59.79 0.43 Allowed Pre-proline 0 N--CA 1.44 -0.972 0 C-N-CA 129.454 3.101 . . . . 0.0 110.91 171.682 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.55 -38.91 4.01 Favored 'Trans proline' 0 C--N 1.365 1.415 0 C-N-CA 125.066 3.844 . . . . 0.0 113.561 173.987 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -71.6 -27.68 63.29 Favored 'General case' 0 C--N 1.368 1.397 0 C-N-CA 127.3 2.24 . . . . 0.0 114.378 -178.531 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.17 -6.54 57.8 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.92 1.236 . . . . 0.0 113.936 169.202 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -88.94 -18.8 26.74 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 125.833 1.653 . . . . 0.0 111.403 166.187 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.1 mt -99.46 -73.64 0.62 Allowed 'General case' 0 C--N 1.364 1.211 0 C-N-CA 127.418 2.287 . . . . 0.0 109.859 179.559 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -103.58 45.61 0.95 Allowed 'General case' 0 C--N 1.36 1.048 0 C-N-CA 129.079 2.952 . . . . 0.0 109.565 -173.638 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.59 81.57 1.23 Allowed Glycine 0 C--N 1.364 2.105 0 C-N-CA 126.492 1.996 . . . . 0.0 116.763 -170.778 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p 175.62 -47.26 0.01 OUTLIER 'General case' 0 C--N 1.358 0.945 0 C-N-CA 127.701 2.4 . . . . 0.0 104.856 175.701 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.433 ' HG ' ' H ' ' A' ' 39' ' ' ASN . 22.9 t -133.11 76.39 1.68 Allowed 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -177.577 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.57 119.36 39.19 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 125.273 1.429 . . . . 0.0 108.624 178.336 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.37 85.71 0.62 Allowed Glycine 0 C--N 1.368 2.313 0 N-CA-C 108.34 -1.904 . . . . 0.0 108.34 170.515 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.86 115.79 28.2 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.332 1.453 . . . . 0.0 109.956 -172.817 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.3 mttm -125.43 143.84 50.8 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 104.564 -2.384 . . . . 0.0 104.564 -172.401 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -140.04 112.23 7.68 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -177.038 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.0 mmm -112.86 124.91 53.69 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.983 2.113 . . . . 0.0 105.814 -177.811 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.17 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.38 1.928 0 C-N-CA 127.55 2.34 . . . . 0.0 110.701 176.4 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.74 50.02 0.24 Allowed Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 169.795 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.421 ' HZ2' ' HZ3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -149.39 148.11 29.08 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 175.59 . . . . . . . . 3 3 . 1 . 036 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.6 t -105.02 151.34 24.07 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.39 2.276 . . . . 0.0 110.124 -161.944 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.474 ' HD2' ' HH ' ' A' ' 37' ' ' TYR . 56.3 mtmt -134.0 135.1 43.19 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.489 1.915 . . . . 0.0 106.16 178.551 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -120.36 119.74 33.97 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.441 1.096 . . . . 0.0 108.538 178.53 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.474 ' HH ' ' HD2' ' A' ' 35' ' ' LYS . 60.3 m-85 -123.0 -158.64 0.8 Allowed 'General case' 0 N--CA 1.435 -1.188 0 C-N-CA 126.53 1.932 . . . . 0.0 106.219 -178.597 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -127.45 153.32 46.42 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 105.391 -2.077 . . . . 0.0 105.391 172.956 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.433 ' H ' ' HG ' ' A' ' 24' ' ' SER . 87.7 m-20 -84.93 117.92 24.22 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.828 1.251 . . . . 0.0 107.966 175.564 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 . . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.1 mt -125.22 113.32 34.94 Favored 'Isoleucine or valine' 0 C--N 1.366 1.307 0 N-CA-C 102.492 -3.151 . . . . 0.0 102.492 174.361 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.6 pt -101.45 -179.29 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 124.721 1.208 . . . . 0.0 110.744 -175.972 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -121.77 78.45 1.46 Allowed 'General case' 0 C--N 1.362 1.15 0 C-N-CA 125.691 1.596 . . . . 0.0 107.27 -176.206 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -132.12 124.59 53.0 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 N-CA-C 103.674 -2.713 . . . . 0.0 103.674 170.888 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -87.96 140.94 28.99 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 126.18 1.792 . . . . 0.0 108.372 -175.739 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.01 -176.21 5.06 Favored 'General case' 0 C--N 1.357 0.919 0 CA-C-O 121.429 0.633 . . . . 0.0 110.059 -162.574 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.0 t -154.33 24.93 0.47 Allowed 'General case' 0 C--N 1.359 1.005 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 164.534 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.0 p -173.53 150.54 1.8 Allowed Pre-proline 0 C--N 1.365 1.271 0 C-N-CA 124.399 1.08 . . . . 0.0 108.524 -170.08 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -69.01 -15.22 39.73 Favored 'Trans proline' 0 C--N 1.362 1.277 1 C-N-CA 125.559 4.173 . . . . 0.0 115.119 164.96 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -88.09 5.18 42.38 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.253 1.821 . . . . 0.0 113.819 171.596 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -113.06 28.2 8.99 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.139 2.176 . . . . 0.0 106.671 168.245 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.0 t -147.46 -21.43 0.38 Allowed 'General case' 0 C--N 1.356 0.863 0 C-N-CA 125.693 1.597 . . . . 0.0 109.95 -175.864 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.7 p -86.27 0.27 54.2 Favored 'General case' 0 C--N 1.372 1.55 0 CA-C-N 121.434 1.924 . . . . 0.0 111.308 175.81 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -79.63 -58.53 0.63 Allowed Pre-proline 0 C--N 1.357 0.922 0 C-N-CA 129.737 3.215 . . . . 0.0 111.472 170.109 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.18 -40.31 4.79 Favored 'Trans proline' 0 C--N 1.365 1.441 1 C-N-CA 125.312 4.008 . . . . 0.0 113.787 174.041 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -70.08 -30.71 68.01 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.751 2.421 . . . . 0.0 114.727 -177.901 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -88.0 -7.17 57.45 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 124.836 1.254 . . . . 0.0 113.2 171.646 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -86.98 -18.92 29.54 Favored 'General case' 0 C--N 1.36 1.022 0 C-N-CA 125.697 1.599 . . . . 0.0 111.322 165.512 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -94.22 -66.63 0.9 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.596 2.358 . . . . 0.0 111.278 178.495 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -94.62 -9.46 34.97 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.998 2.519 . . . . 0.0 112.199 -167.892 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -77.95 0.29 Allowed Glycine 0 C--N 1.364 2.138 0 C-N-CA 124.953 1.264 . . . . 0.0 113.318 165.641 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.435 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.6 t -153.56 -7.43 0.17 Allowed 'General case' 0 C--N 1.355 0.806 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 -175.082 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 24' ' ' SER . . . . . 0.435 ' H ' ' H ' ' A' ' 23' ' ' SER . 18.6 t -108.68 70.93 0.76 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 126.766 2.026 . . . . 0.0 105.596 175.354 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.7 126.12 42.97 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.642 1.577 . . . . 0.0 107.002 -178.077 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.51 83.59 0.59 Allowed Glycine 0 C--N 1.362 1.981 0 N-CA-C 107.053 -2.419 . . . . 0.0 107.053 171.096 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.85 115.04 27.72 Favored 'General case' 0 C--N 1.359 1.0 0 C-N-CA 125.623 1.569 . . . . 0.0 109.748 -171.117 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -124.62 147.12 48.69 Favored 'General case' 0 CA--C 1.485 -1.534 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 -170.487 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.3 131.49 18.41 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -177.619 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -109.43 84.89 2.0 Allowed 'General case' 0 C--N 1.359 1.021 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 171.992 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.271 5.4 p30 1.32 64.93 0.0 OUTLIER 'General case' 0 C--N 1.382 2.005 1 C-N-CA 134.438 5.095 . . . . 0.0 119.273 179.345 . . . . . . . . 3 2 . 1 . 037 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.0 -47.11 0.27 Allowed Glycine 0 C--N 1.354 1.54 0 N-CA-C 108.927 -1.669 . . . . 0.0 108.927 -162.63 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -154.0 154.98 34.72 Favored 'General case' 0 C--N 1.37 1.475 0 CA-C-N 119.398 1.599 . . . . 0.0 109.353 -177.036 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.4 t -107.75 152.43 24.36 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 129.45 3.1 . . . . 0.0 110.196 -166.913 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -133.61 139.84 46.75 Favored 'General case' 0 C--N 1.363 1.165 0 C-N-CA 126.808 2.043 . . . . 0.0 106.425 177.554 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.4 m -123.18 112.92 18.26 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 124.704 1.202 . . . . 0.0 108.816 178.877 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -112.11 -149.39 0.45 Allowed 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 106.539 177.084 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -135.03 156.57 48.81 Favored 'General case' 0 C--N 1.359 0.984 0 N-CA-C 105.59 -2.004 . . . . 0.0 105.59 177.37 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -87.31 122.88 31.66 Favored 'General case' 0 C--N 1.361 1.072 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 171.852 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.326 0 O-C-N 123.474 0.484 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 91.7 m . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 . . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 mt -104.92 118.5 52.41 Favored 'Isoleucine or valine' 0 C--N 1.361 1.101 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -179.376 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt -99.28 -174.84 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.212 0 C-N-CA 126.076 1.75 . . . . 0.0 110.113 -176.76 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -128.25 82.91 2.11 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -174.167 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.3 t -134.63 126.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 104.273 -2.491 . . . . 0.0 104.273 172.856 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -80.28 138.75 36.81 Favored 'General case' 0 C--N 1.366 1.315 0 C-N-CA 127.036 2.134 . . . . 0.0 110.253 -178.928 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.7 p -145.1 171.18 14.87 Favored 'General case' 0 C--N 1.356 0.883 0 CA-C-O 121.782 0.801 . . . . 0.0 109.356 -166.888 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -119.85 -22.84 6.64 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 127.04 2.136 . . . . 0.0 108.156 161.184 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.5 p -135.9 162.44 56.8 Favored Pre-proline 0 C--N 1.366 1.288 0 C-N-CA 125.951 1.7 . . . . 0.0 110.046 -169.132 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -69.62 -17.07 38.42 Favored 'Trans proline' 0 C--N 1.361 1.213 1 C-N-CA 125.364 4.043 . . . . 0.0 115.113 163.397 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.32 -11.12 59.94 Favored 'General case' 0 C--N 1.369 1.441 0 C-N-CA 127.101 2.16 . . . . 0.0 114.187 171.0 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -98.23 7.31 46.43 Favored 'General case' 0 C--N 1.372 1.564 0 C-N-CA 127.36 2.264 . . . . 0.0 109.43 172.245 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -123.79 -13.18 7.48 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 127.662 2.385 . . . . 0.0 108.602 177.767 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -85.36 -1.11 56.65 Favored 'General case' 0 C--N 1.371 1.525 0 C-N-CA 126.26 1.824 . . . . 0.0 110.905 173.679 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -81.88 -57.23 0.52 Allowed Pre-proline 0 N--CA 1.44 -0.974 0 C-N-CA 129.31 3.044 . . . . 0.0 111.112 172.827 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.76 -42.41 3.43 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 124.958 3.772 . . . . 0.0 113.962 172.568 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -70.0 -29.45 66.53 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.345 2.258 . . . . 0.0 114.845 -176.661 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -88.04 -8.62 55.31 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.784 1.234 . . . . 0.0 113.303 171.356 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -84.79 -25.88 27.9 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 125.732 1.613 . . . . 0.0 111.182 165.777 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.8 mt -89.78 -63.42 1.29 Allowed 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.516 2.326 . . . . 0.0 111.761 179.934 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -98.53 -8.98 25.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.629 2.371 . . . . 0.0 111.964 -167.645 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -80.95 0.47 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.039 1.304 . . . . 0.0 113.651 164.956 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.3 m -147.51 -9.69 0.42 Allowed 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.858 1.663 . . . . 0.0 106.965 -175.058 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -106.19 69.92 0.82 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 126.946 2.098 . . . . 0.0 105.726 176.326 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 127.15 42.55 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -175.363 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 87.19 0.51 Allowed Glycine 0 C--N 1.36 1.868 0 N-CA-C 107.211 -2.356 . . . . 0.0 107.211 172.219 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.56 117.31 28.36 Favored 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.328 1.451 . . . . 0.0 109.935 -174.089 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -122.99 140.15 53.33 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 102.986 -2.968 . . . . 0.0 102.986 -175.575 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.25 107.53 6.83 Favored 'General case' 0 CA--C 1.501 -0.935 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 -178.115 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 62.4 mtt -110.61 123.89 50.84 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 127.295 2.238 . . . . 0.0 106.042 -174.377 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 80.39 -86.29 0.02 OUTLIER 'General case' 0 C--N 1.38 1.919 0 C-N-CA 127.403 2.281 . . . . 0.0 109.908 177.854 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.77 49.51 0.24 Allowed Glycine 0 N--CA 1.435 -1.429 0 N-CA-C 106.444 -2.662 . . . . 0.0 106.444 170.03 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -151.37 150.58 30.64 Favored 'General case' 0 C--N 1.367 1.335 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 177.822 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.9 t -105.03 150.29 25.08 Favored 'General case' 0 C--N 1.362 1.127 0 C-N-CA 127.137 2.175 . . . . 0.0 110.819 -160.712 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -131.98 144.47 50.83 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 127.437 2.295 . . . . 0.0 105.948 178.092 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.6 m -127.8 127.53 43.68 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 108.168 177.859 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -125.18 -163.31 1.18 Allowed 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 178.926 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -129.19 97.76 4.7 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.419 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -139.15 97.65 3.35 Favored 'General case' 0 C--N 1.355 0.837 0 N-CA-C 105.068 -2.197 . . . . 0.0 105.068 176.11 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.422 0 CA-C-N 116.09 -0.505 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 80.5 p . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 121.913 0.863 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.9 mt -124.59 115.81 45.63 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.465 -2.791 . . . . 0.0 103.465 176.061 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.0 pt -104.32 -176.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.261 0 C-N-CA 125.78 1.632 . . . . 0.0 108.906 178.738 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -134.97 104.01 5.8 Favored 'General case' 0 C--N 1.361 1.105 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -178.101 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.3 t -114.44 -50.06 5.14 Favored 'Isoleucine or valine' 0 C--N 1.364 1.228 0 C-N-CA 125.012 1.325 . . . . 0.0 110.851 -172.491 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 82.14 121.39 0.05 OUTLIER 'General case' 0 C--N 1.364 1.211 0 C-N-CA 131.638 3.975 . . . . 0.0 110.45 -167.192 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.8 p -148.0 -177.73 5.9 Favored 'General case' 0 C--N 1.356 0.877 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -166.227 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.1 t -152.71 24.23 0.59 Allowed 'General case' 0 C--N 1.358 0.96 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 167.008 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.2 p -173.04 150.41 1.95 Allowed Pre-proline 0 C--N 1.364 1.218 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 -171.086 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -69.77 -14.28 35.84 Favored 'Trans proline' 0 C--N 1.36 1.149 1 C-N-CA 125.428 4.086 . . . . 0.0 114.949 162.106 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.8 -15.26 59.79 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 127.674 2.389 . . . . 0.0 114.19 170.489 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -97.78 8.8 44.07 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.686 2.395 . . . . 0.0 109.222 173.149 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -124.51 -14.47 6.85 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.827 2.051 . . . . 0.0 109.446 -179.827 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.9 m -86.51 -6.87 58.79 Favored 'General case' 0 C--N 1.367 1.351 0 C-N-CA 125.712 1.605 . . . . 0.0 111.237 175.72 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -82.52 -54.45 0.6 Allowed Pre-proline 0 C--N 1.356 0.866 0 C-N-CA 129.3 3.04 . . . . 0.0 111.956 171.37 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.38 -46.0 4.61 Favored 'Trans proline' 0 C--N 1.367 1.504 1 C-N-CA 125.974 4.45 . . . . 0.0 113.802 172.92 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.05 -30.87 69.3 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.589 2.356 . . . . 0.0 115.353 -178.152 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -88.01 -6.06 58.18 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 124.662 1.185 . . . . 0.0 113.444 172.979 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -88.59 -21.43 24.04 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 126.003 1.721 . . . . 0.0 111.081 165.889 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.7 mt -92.64 -66.65 0.91 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.396 2.278 . . . . 0.0 111.196 178.51 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.1 -7.29 33.04 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 128.283 2.633 . . . . 0.0 112.34 -167.565 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.56 -79.9 0.57 Allowed Glycine 0 C--N 1.364 2.123 0 C-N-CA 125.05 1.31 . . . . 0.0 113.72 164.83 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.51 -9.61 0.42 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.854 1.661 . . . . 0.0 107.198 -175.684 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 t -105.79 69.0 0.8 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 126.875 2.07 . . . . 0.0 106.031 177.37 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.49 124.83 39.28 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.736 1.614 . . . . 0.0 106.985 -174.155 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.44 ' HA3' HD21 ' A' ' 39' ' ' ASN . . . -102.24 89.91 0.78 Allowed Glycine 0 C--N 1.363 2.043 0 N-CA-C 107.091 -2.403 . . . . 0.0 107.091 170.065 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.42 111.88 23.82 Favored 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.303 1.441 . . . . 0.0 109.894 -169.719 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -125.54 140.26 52.91 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 104.102 -2.555 . . . . 0.0 104.102 -173.382 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.16 110.28 9.47 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 -174.78 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.7 mmm -122.34 129.57 52.28 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.592 1.957 . . . . 0.0 105.747 -172.539 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m120 76.15 -7.25 1.85 Allowed 'General case' 0 C--N 1.382 1.98 0 C-N-CA 126.793 2.037 . . . . 0.0 115.342 168.972 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.27 42.0 3.58 Favored Glycine 0 C--N 1.362 2.017 0 C-N-CA 126.63 2.062 . . . . 0.0 111.082 -174.114 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.03 156.97 38.33 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 102.968 -2.975 . . . . 0.0 102.968 169.862 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 39.0 t -105.05 155.58 18.85 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 126.305 1.842 . . . . 0.0 109.896 -166.077 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -132.56 134.51 45.04 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 176.95 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.3 m -123.02 117.34 25.25 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -115.19 -165.59 1.04 Allowed 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 126.851 2.06 . . . . 0.0 106.21 -179.524 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -127.25 91.02 3.24 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 -178.707 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.44 HD21 ' HA3' ' A' ' 26' ' ' GLY . 69.6 m-80 -137.9 94.7 2.92 Favored 'General case' 0 C--N 1.356 0.879 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 177.089 . . . . . . . . 2 2 . 1 . 039 nuclear orig full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.404 0 CA-C-N 116.015 -0.539 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 104.164 -2.532 . . . . 0.0 104.164 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -108.18 -174.42 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.175 1.39 . . . . 0.0 109.287 177.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -130.98 80.39 1.94 Allowed 'General case' 0 C--N 1.362 1.139 0 C-N-CA 124.984 1.314 . . . . 0.0 107.634 -176.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.411 HG11 ' HG3' ' A' ' 16' ' ' PRO . 6.9 t -131.16 129.75 63.09 Favored 'Isoleucine or valine' 0 C--N 1.361 1.093 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -79.88 135.72 36.5 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.017 1.727 . . . . 0.0 110.56 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.66 171.95 13.48 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -169.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.39 22.88 0.54 Allowed 'General case' 0 C--N 1.355 0.821 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.3 p -171.96 149.72 2.34 Favored Pre-proline 0 C--N 1.36 1.059 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -71.66 -16.88 30.04 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.197 3.264 . . . . 0.0 114.549 168.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -79.09 -10.75 59.91 Favored 'General case' 0 C--N 1.369 1.45 0 C-N-CA 127.516 2.326 . . . . 0.0 114.799 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -89.94 -11.53 41.46 Favored 'General case' 0 C--N 1.37 1.5 0 C-N-CA 127.735 2.414 . . . . 0.0 110.275 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.5 t -109.72 -13.63 14.46 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.289 2.236 . . . . 0.0 108.76 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.5 m -83.69 -1.39 53.94 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.182 1.793 . . . . 0.0 111.445 174.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -80.35 -59.06 0.54 Allowed Pre-proline 0 N--CA 1.44 -0.938 0 C-N-CA 129.545 3.138 . . . . 0.0 111.471 172.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.411 ' HG3' HG11 ' A' ' 5' ' ' VAL . 68.4 Cg_endo -70.61 -40.35 4.08 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 125.097 3.865 . . . . 0.0 113.703 174.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.5 m -69.52 -31.45 69.69 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 127.6 2.36 . . . . 0.0 114.696 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -88.14 -7.17 57.31 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 124.837 1.255 . . . . 0.0 113.296 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.1 -19.21 28.87 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.746 1.618 . . . . 0.0 111.468 165.229 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 mt -93.9 -67.39 0.86 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 127.608 2.363 . . . . 0.0 111.14 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -94.72 -9.54 34.42 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.09 2.556 . . . . 0.0 112.4 -167.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -78.06 0.29 Allowed Glycine 0 C--N 1.365 2.153 0 C-N-CA 124.97 1.271 . . . . 0.0 113.161 166.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -152.99 -8.52 0.17 Allowed 'General case' 0 C--N 1.355 0.836 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -105.42 71.12 0.91 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 126.992 2.117 . . . . 0.0 105.748 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.38 123.24 31.21 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 125.684 1.594 . . . . 0.0 106.776 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.19 85.19 0.73 Allowed Glycine 0 C--N 1.364 2.098 0 N-CA-C 107.488 -2.245 . . . . 0.0 107.488 171.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.46 114.39 26.4 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.602 1.561 . . . . 0.0 109.949 -169.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.3 mttp -122.95 142.02 51.28 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -171.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.8 t -122.49 112.52 18.14 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.7 mmm -121.7 123.53 42.1 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.747 -2.316 . . . . 0.0 104.747 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.72 -84.61 0.02 OUTLIER 'General case' 0 C--N 1.381 1.964 0 C-N-CA 127.623 2.369 . . . . 0.0 111.099 176.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.83 54.47 0.19 Allowed Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 105.58 -3.008 . . . . 0.0 105.58 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mttm -154.04 152.19 30.21 Favored 'General case' 0 C--N 1.362 1.149 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.4 t -105.78 144.07 33.04 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 127.518 2.327 . . . . 0.0 109.465 -164.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -124.33 139.53 53.82 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.35 1.86 . . . . 0.0 106.671 174.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 67.7 m -125.2 111.45 15.28 Favored 'General case' 0 CA--C 1.5 -0.967 0 C-N-CA 124.09 0.956 . . . . 0.0 108.498 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 . . . . . 0 N--CA 1.439 -0.99 0 C-N-CA 127.001 2.12 . . . . 0.0 106.647 178.713 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 39.7 mt . . . . . 0 N--CA 1.445 -0.705 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.0 pt -112.88 -171.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 125.578 1.551 . . . . 0.0 108.208 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -131.9 80.29 1.91 Allowed 'General case' 0 C--N 1.363 1.156 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.413 HG11 ' HG3' ' A' ' 16' ' ' PRO . 11.3 t -130.62 129.52 64.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.082 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 171.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.64 134.26 35.16 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 125.734 1.614 . . . . 0.0 110.448 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.5 p -142.51 170.44 15.7 Favored 'General case' 0 C--N 1.36 1.029 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -167.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.03 22.37 0.76 Allowed 'General case' 0 C--N 1.355 0.843 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -170.42 150.16 3.31 Favored Pre-proline 0 C--N 1.362 1.121 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -71.46 -15.79 30.92 Favored 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 124.196 3.264 . . . . 0.0 114.891 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -82.66 -2.35 53.74 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.947 2.099 . . . . 0.0 114.315 171.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -101.87 7.53 41.56 Favored 'General case' 0 C--N 1.372 1.568 0 C-N-CA 127.195 2.198 . . . . 0.0 109.233 170.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.2 t -128.25 -14.3 4.86 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 127.229 2.212 . . . . 0.0 108.253 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.9 m -84.24 -1.15 54.72 Favored 'General case' 0 C--N 1.372 1.571 0 C-N-CA 126.064 1.746 . . . . 0.0 111.756 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -79.47 -58.67 0.64 Allowed Pre-proline 0 C--N 1.358 0.965 0 C-N-CA 128.926 2.89 . . . . 0.0 111.74 170.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.413 ' HG3' HG11 ' A' ' 5' ' ' VAL . 66.7 Cg_endo -70.89 -39.66 4.16 Favored 'Trans proline' 0 C--N 1.364 1.366 0 C-N-CA 124.966 3.778 . . . . 0.0 113.522 175.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.6 m -69.42 -31.79 70.35 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.824 2.45 . . . . 0.0 114.679 -178.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -88.06 -6.38 57.97 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.853 1.261 . . . . 0.0 113.184 172.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -88.23 -19.65 26.57 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.814 1.646 . . . . 0.0 111.232 165.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.0 mt -93.38 -67.11 0.88 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 127.636 2.374 . . . . 0.0 111.059 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -94.89 -11.36 28.87 Favored 'General case' 0 C--N 1.362 1.14 0 C-N-CA 128.115 2.566 . . . . 0.0 112.277 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.86 -79.72 0.31 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 124.753 1.168 . . . . 0.0 113.284 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -146.42 -15.1 0.44 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 125.495 1.518 . . . . 0.0 107.097 -175.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.7 t -103.43 72.8 1.16 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 126.94 2.096 . . . . 0.0 106.14 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.0 122.58 30.37 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 125.792 1.637 . . . . 0.0 106.777 -174.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.9 85.25 0.75 Allowed Glycine 0 C--N 1.365 2.156 0 N-CA-C 107.647 -2.181 . . . . 0.0 107.647 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.09 115.07 27.34 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 125.567 1.547 . . . . 0.0 109.896 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -123.37 142.92 50.47 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -171.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.8 t -123.31 114.52 20.31 Favored 'General case' 0 C--N 1.351 0.645 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.45 123.0 39.67 Favored 'General case' 0 C--N 1.358 0.95 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 177.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 77.33 -84.6 0.02 OUTLIER 'General case' 0 C--N 1.381 1.949 0 C-N-CA 127.481 2.312 . . . . 0.0 111.27 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.59 54.52 0.19 Allowed Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 168.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -152.85 152.23 31.31 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.8 t -104.99 145.04 30.98 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 127.514 2.326 . . . . 0.0 109.038 -164.525 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -125.97 138.07 53.73 Favored 'General case' 0 CA--C 1.5 -0.968 0 C-N-CA 126.074 1.749 . . . . 0.0 106.624 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.0 m -124.36 112.69 17.26 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 124.482 1.113 . . . . 0.0 108.573 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 . . . . . 0 N--CA 1.438 -1.045 0 C-N-CA 126.985 2.114 . . . . 0.0 106.396 179.517 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 104.066 -2.568 . . . . 0.0 104.066 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 pt -100.8 177.94 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.288 0 C-N-CA 125.188 1.395 . . . . 0.0 110.953 -176.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.5 t30 -113.38 71.4 0.74 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 126.273 1.829 . . . . 0.0 108.34 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t -133.56 143.92 37.48 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.179 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -103.25 139.97 38.01 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 126.827 2.051 . . . . 0.0 107.068 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.4 p -143.28 177.82 8.16 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 -170.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -155.02 22.99 0.44 Allowed 'General case' 0 C--N 1.355 0.815 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 174.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.2 p -174.79 148.01 1.14 Allowed Pre-proline 0 C--N 1.361 1.078 0 N-CA-C 105.235 -2.135 . . . . 0.0 105.235 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -71.81 -13.19 29.32 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.444 3.429 . . . . 0.0 114.157 167.214 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -73.97 -21.41 60.02 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 128.495 2.718 . . . . 0.0 114.833 170.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -87.4 -15.08 38.82 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.095 2.558 . . . . 0.0 110.743 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.45 -14.22 15.79 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 126.732 2.013 . . . . 0.0 109.955 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 p -87.97 3.33 49.09 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 120.498 -1.376 . . . . 0.0 111.371 174.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -79.16 -59.62 0.6 Allowed Pre-proline 0 C--N 1.361 1.099 0 C-N-CA 129.364 3.066 . . . . 0.0 111.221 169.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.75 -39.42 4.62 Favored 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 125.08 3.853 . . . . 0.0 113.653 174.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.99 -30.65 66.97 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.87 2.468 . . . . 0.0 114.653 -177.18 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -88.1 -7.37 57.05 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.766 1.226 . . . . 0.0 113.281 171.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.66 -18.98 29.95 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.702 1.601 . . . . 0.0 111.468 165.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.2 mt -94.04 -66.8 0.89 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 127.615 2.366 . . . . 0.0 111.153 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -95.25 -9.44 33.17 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 128.001 2.521 . . . . 0.0 112.329 -167.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.39 -79.79 0.32 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 124.868 1.223 . . . . 0.0 113.234 166.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.42 -14.2 0.39 Allowed 'General case' 0 C--N 1.354 0.78 0 C-N-CA 125.543 1.537 . . . . 0.0 106.949 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 t -103.51 72.46 1.14 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.022 2.129 . . . . 0.0 106.369 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.67 124.8 34.51 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 -175.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.71 84.47 0.67 Allowed Glycine 0 C--N 1.364 2.108 0 N-CA-C 107.493 -2.243 . . . . 0.0 107.493 172.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.35 116.15 28.7 Favored 'General case' 0 C--N 1.36 1.032 0 C-N-CA 125.563 1.545 . . . . 0.0 109.923 -170.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -122.99 139.73 53.76 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -171.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -121.01 111.94 18.11 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.89 -1.892 . . . . 0.0 105.89 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -119.91 123.17 42.91 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 77.58 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.382 2.004 0 C-N-CA 127.646 2.378 . . . . 0.0 111.027 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.54 55.95 0.19 Allowed Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 105.219 -3.152 . . . . 0.0 105.219 168.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -153.08 148.31 26.85 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.2 t -106.45 143.36 34.68 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 127.373 2.269 . . . . 0.0 109.529 -165.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -125.99 142.28 51.59 Favored 'General case' 0 C--N 1.357 0.926 0 C-N-CA 126.575 1.95 . . . . 0.0 107.083 175.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.09 120.56 32.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.687 1.195 . . . . 0.0 108.399 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 . . . . . 0 N--CA 1.436 -1.126 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 178.558 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.6 mt . . . . . 0 N--CA 1.444 -0.769 0 N-CA-C 103.525 -2.769 . . . . 0.0 103.525 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.9 pt -103.63 -176.38 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.279 0 C-N-CA 125.357 1.463 . . . . 0.0 109.128 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.1 m-80 -129.38 79.23 1.9 Allowed 'General case' 0 C--N 1.361 1.102 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -176.177 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.6 t -129.55 127.83 65.18 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.621 -2.733 . . . . 0.0 103.621 171.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -82.37 133.82 35.23 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 126.183 1.793 . . . . 0.0 109.967 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.2 p -142.65 172.51 12.6 Favored 'General case' 0 C--N 1.357 0.904 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -167.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.0 26.91 0.48 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 170.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -170.4 148.29 2.83 Favored Pre-proline 0 C--N 1.36 1.039 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 -176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -71.34 -16.08 31.25 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 124.199 3.266 . . . . 0.0 114.672 169.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -80.75 -7.28 59.33 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 127.217 2.207 . . . . 0.0 114.636 171.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -94.55 -3.25 50.13 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.195 2.198 . . . . 0.0 109.945 170.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.3 t -116.69 -13.92 10.8 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.28 2.232 . . . . 0.0 108.238 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -83.97 -1.18 54.15 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 126.196 1.799 . . . . 0.0 111.394 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.11 -59.35 0.54 Allowed Pre-proline 0 C--N 1.357 0.931 0 C-N-CA 129.556 3.142 . . . . 0.0 111.322 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -70.68 -40.87 3.5 Favored 'Trans proline' 0 C--N 1.365 1.397 0 C-N-CA 125.079 3.853 . . . . 0.0 113.48 174.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.4 m -69.93 -31.33 69.03 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 127.736 2.415 . . . . 0.0 114.824 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -88.07 -7.37 57.09 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 124.624 1.169 . . . . 0.0 113.338 172.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -87.14 -20.66 26.72 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.649 1.58 . . . . 0.0 111.447 165.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.1 mt -92.74 -66.7 0.91 Allowed 'General case' 0 C--N 1.366 1.303 0 C-N-CA 127.553 2.341 . . . . 0.0 111.086 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -96.59 -7.86 33.28 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 128.107 2.563 . . . . 0.0 112.253 -167.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.81 -80.03 0.5 Allowed Glycine 0 C--N 1.365 2.167 0 C-N-CA 124.936 1.255 . . . . 0.0 113.621 165.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.1 m -147.63 -11.38 0.4 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.74 1.616 . . . . 0.0 107.093 -175.472 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 t -105.13 69.17 0.84 Allowed 'General case' 0 C--N 1.366 1.298 0 C-N-CA 126.907 2.083 . . . . 0.0 106.142 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.78 126.14 42.91 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 125.741 1.616 . . . . 0.0 106.855 -175.235 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.56 85.8 0.57 Allowed Glycine 0 C--N 1.363 2.054 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 170.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.08 112.88 24.53 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 125.327 1.451 . . . . 0.0 109.812 -169.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -121.91 141.78 50.94 Favored 'General case' 0 C--N 1.361 1.088 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -127.96 110.62 12.71 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -118.93 128.11 54.11 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 78.75 -85.54 0.02 OUTLIER 'General case' 0 C--N 1.383 2.023 0 C-N-CA 127.537 2.335 . . . . 0.0 111.023 173.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 55.6 0.18 Allowed Glycine 0 N--CA 1.432 -1.582 0 N-CA-C 106.083 -2.807 . . . . 0.0 106.083 169.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -153.45 151.99 30.5 Favored 'General case' 0 C--N 1.362 1.148 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -106.35 144.98 32.26 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.558 2.343 . . . . 0.0 109.239 -165.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.3 mtmm -127.11 139.02 53.28 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 126.059 1.744 . . . . 0.0 106.835 173.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.7 m -120.66 119.42 32.79 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 124.523 1.129 . . . . 0.0 108.16 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 . . . . . 0 N--CA 1.438 -1.061 0 C-N-CA 126.37 1.868 . . . . 0.0 106.008 179.467 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.6 mt . . . . . 0 N--CA 1.443 -0.805 0 N-CA-C 104.311 -2.477 . . . . 0.0 104.311 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -113.56 -169.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.303 0 C-N-CA 125.631 1.572 . . . . 0.0 107.961 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.97 80.73 1.86 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 124.406 1.083 . . . . 0.0 108.431 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.35 126.97 66.7 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 103.665 -2.717 . . . . 0.0 103.665 172.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -78.56 134.19 37.26 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 126.395 1.878 . . . . 0.0 110.919 -175.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.2 p -145.95 168.82 19.93 Favored 'General case' 0 C--N 1.357 0.929 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -166.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.92 26.37 0.64 Allowed 'General case' 0 C--N 1.357 0.9 0 N-CA-C 105.445 -2.058 . . . . 0.0 105.445 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.7 p -168.85 149.77 4.31 Favored Pre-proline 0 C--N 1.361 1.074 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 -177.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -71.86 -13.46 29.27 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.257 3.304 . . . . 0.0 114.727 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -86.63 6.91 28.71 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 126.855 2.062 . . . . 0.0 113.582 170.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -113.09 22.23 14.56 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 127.38 2.272 . . . . 0.0 107.24 170.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.8 t -144.93 -19.01 0.5 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.4 m -82.58 -1.26 50.21 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 126.347 1.859 . . . . 0.0 111.798 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -82.6 -56.81 0.49 Allowed Pre-proline 0 C--N 1.357 0.919 0 C-N-CA 129.357 3.063 . . . . 0.0 111.424 172.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.34 -40.47 5.94 Favored 'Trans proline' 0 C--N 1.365 1.441 0 C-N-CA 124.939 3.759 . . . . 0.0 113.881 172.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.41 -31.8 70.39 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.698 2.399 . . . . 0.0 114.74 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -88.06 -6.73 57.78 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 124.992 1.317 . . . . 0.0 113.252 172.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -87.44 -19.51 27.92 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.749 1.619 . . . . 0.0 111.392 165.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -93.77 -67.38 0.86 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 127.598 2.359 . . . . 0.0 111.089 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -94.75 -10.61 31.07 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 128.089 2.555 . . . . 0.0 112.269 -167.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.22 -79.97 0.31 Allowed Glycine 0 C--N 1.365 2.142 0 C-N-CA 124.882 1.23 . . . . 0.0 113.106 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.37 -15.39 0.44 Allowed 'General case' 0 C--N 1.355 0.824 0 C-N-CA 125.569 1.548 . . . . 0.0 107.092 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.1 t -102.85 74.74 1.35 Allowed 'General case' 0 C--N 1.364 1.228 0 C-N-CA 127.005 2.122 . . . . 0.0 106.134 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.87 122.95 26.52 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 -174.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.59 86.51 0.76 Allowed Glycine 0 C--N 1.363 2.071 0 N-CA-C 107.565 -2.214 . . . . 0.0 107.565 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.72 116.0 28.21 Favored 'General case' 0 C--N 1.359 1.013 0 C-N-CA 125.504 1.521 . . . . 0.0 109.957 -169.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -123.93 143.41 50.4 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -171.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.3 t -122.83 114.87 21.09 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -125.62 124.15 40.55 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 104.429 -2.434 . . . . 0.0 104.429 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.43 -84.13 0.02 OUTLIER 'General case' 0 C--N 1.383 2.03 0 C-N-CA 127.579 2.352 . . . . 0.0 110.88 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.08 53.14 0.19 Allowed Glycine 0 N--CA 1.433 -1.538 0 N-CA-C 106.059 -2.816 . . . . 0.0 106.059 168.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -152.75 153.92 34.17 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 105.982 -1.858 . . . . 0.0 105.982 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.1 t -105.08 145.33 30.65 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 127.384 2.274 . . . . 0.0 108.73 -164.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -126.37 138.67 53.58 Favored 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 126.225 1.81 . . . . 0.0 106.447 175.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.5 m -125.33 112.51 16.43 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 124.473 1.109 . . . . 0.0 108.51 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 N--CA 1.438 -1.035 0 C-N-CA 126.931 2.092 . . . . 0.0 106.546 179.732 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.0 mt . . . . . 0 N--CA 1.444 -0.768 0 N-CA-C 102.955 -2.98 . . . . 0.0 102.955 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.0 pt -102.0 -177.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.32 0 C-N-CA 125.435 1.494 . . . . 0.0 109.831 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -126.87 76.8 1.67 Allowed 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.815 1.246 . . . . 0.0 108.196 -173.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.2 t -132.11 130.59 60.99 Favored 'Isoleucine or valine' 0 C--N 1.36 1.058 0 N-CA-C 103.957 -2.608 . . . . 0.0 103.957 173.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -80.56 137.11 36.37 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.202 1.801 . . . . 0.0 110.605 -178.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.82 172.51 12.92 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.83 27.85 0.43 Allowed 'General case' 0 C--N 1.355 0.82 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.4 p -171.23 149.14 2.55 Favored Pre-proline 0 C--N 1.36 1.037 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -71.35 -16.78 31.11 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 124.278 3.319 . . . . 0.0 114.775 169.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.62 -6.84 59.38 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.139 2.176 . . . . 0.0 114.647 172.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -94.49 -4.11 48.72 Favored 'General case' 0 C--N 1.37 1.48 0 C-N-CA 127.173 2.189 . . . . 0.0 110.1 170.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.6 t -116.19 -13.45 11.13 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 127.402 2.281 . . . . 0.0 108.048 -178.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.4 m -84.04 0.09 49.6 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 126.367 1.867 . . . . 0.0 111.304 173.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.27 -59.37 0.53 Allowed Pre-proline 0 C--N 1.358 0.94 0 C-N-CA 129.365 3.066 . . . . 0.0 111.14 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.22 -40.49 3.16 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 124.902 3.735 . . . . 0.0 113.509 174.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.79 -31.13 68.88 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 127.535 2.334 . . . . 0.0 114.747 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.09 -7.87 56.32 Favored 'General case' 0 C--N 1.371 1.516 0 C-N-CA 124.59 1.156 . . . . 0.0 113.289 172.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -86.92 -21.16 26.45 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 125.798 1.639 . . . . 0.0 111.528 165.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.7 mt -92.16 -66.46 0.92 Allowed 'General case' 0 C--N 1.366 1.301 0 C-N-CA 127.601 2.36 . . . . 0.0 111.04 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -95.72 -12.14 25.93 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 128.022 2.529 . . . . 0.0 112.106 -167.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.74 -74.59 0.4 Allowed Glycine 0 C--N 1.364 2.133 0 C-N-CA 124.915 1.245 . . . . 0.0 113.836 164.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -141.72 -36.59 0.43 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.584 1.553 . . . . 0.0 107.218 -170.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.6 t -90.5 75.07 6.78 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.86 2.464 . . . . 0.0 108.346 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.32 124.8 35.24 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -176.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.52 87.06 0.63 Allowed Glycine 0 C--N 1.362 1.992 0 N-CA-C 107.545 -2.222 . . . . 0.0 107.545 172.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.26 115.21 27.12 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.286 1.434 . . . . 0.0 109.721 -171.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -123.33 142.27 51.13 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.9 t -123.56 113.87 19.29 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 105.885 -1.894 . . . . 0.0 105.885 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 79.0 mtp -120.38 123.4 42.98 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 175.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 78.58 -84.78 0.02 OUTLIER 'General case' 0 C--N 1.383 2.039 0 C-N-CA 127.512 2.325 . . . . 0.0 110.936 174.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.8 55.28 0.2 Allowed Glycine 0 N--CA 1.434 -1.499 0 N-CA-C 105.806 -2.917 . . . . 0.0 105.806 168.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -154.04 152.5 30.57 Favored 'General case' 0 C--N 1.363 1.18 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.91 146.44 29.98 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 127.438 2.295 . . . . 0.0 109.568 -163.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -126.13 141.82 51.78 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.294 1.838 . . . . 0.0 106.793 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -124.79 122.89 38.73 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.255 1.022 . . . . 0.0 108.261 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 . . . . . 0 N--CA 1.435 -1.178 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 179.691 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.9 mt . . . . . 0 N--CA 1.444 -0.767 0 N-CA-C 103.51 -2.774 . . . . 0.0 103.51 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.4 pt -104.16 -176.72 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.279 1.431 . . . . 0.0 109.299 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -127.73 77.19 1.73 Allowed 'General case' 0 C--N 1.362 1.115 0 C-N-CA 124.699 1.2 . . . . 0.0 107.8 -175.599 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.433 HG11 ' HG3' ' A' ' 16' ' ' PRO . 12.3 t -129.98 129.69 65.87 Favored 'Isoleucine or valine' 0 C--N 1.361 1.087 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 172.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -79.72 137.02 36.92 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 126.451 1.901 . . . . 0.0 110.447 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -145.86 173.43 12.14 Favored 'General case' 0 C--N 1.358 0.965 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.96 27.27 0.42 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 p -172.06 147.32 1.87 Allowed Pre-proline 0 C--N 1.359 1.017 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -71.07 -13.71 31.52 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.609 3.539 . . . . 0.0 114.28 167.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -72.18 -23.27 61.24 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 128.879 2.872 . . . . 0.0 114.438 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -89.42 -8.74 52.4 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 127.555 2.342 . . . . 0.0 110.931 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -110.45 -15.24 13.96 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 126.984 2.114 . . . . 0.0 109.417 -178.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.3 p -87.89 3.01 50.07 Favored 'General case' 0 C--N 1.369 1.422 0 O-C-N 120.179 -1.576 . . . . 0.0 111.156 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -79.87 -58.25 0.63 Allowed Pre-proline 0 C--N 1.359 1.002 0 C-N-CA 129.846 3.258 . . . . 0.0 111.347 170.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.433 ' HG3' HG11 ' A' ' 5' ' ' VAL . 67.0 Cg_endo -70.15 -40.22 4.95 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 125.119 3.879 . . . . 0.0 113.756 173.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -69.78 -31.68 69.75 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.647 2.379 . . . . 0.0 114.796 -176.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -88.1 -8.0 56.11 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 124.952 1.301 . . . . 0.0 113.16 172.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -86.85 -20.16 27.89 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 125.81 1.644 . . . . 0.0 111.434 165.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.5 mt -92.02 -66.66 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.692 2.397 . . . . 0.0 111.097 177.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -96.9 -11.21 25.02 Favored 'General case' 0 C--N 1.362 1.129 0 C-N-CA 127.914 2.486 . . . . 0.0 112.288 -166.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -78.55 0.43 Allowed Glycine 0 C--N 1.363 2.08 0 C-N-CA 124.933 1.254 . . . . 0.0 113.097 166.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.7 m -148.47 -6.96 0.4 Allowed 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.764 1.625 . . . . 0.0 107.201 -175.664 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.7 t -107.39 64.46 0.63 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 126.77 2.028 . . . . 0.0 106.156 178.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -124.6 127.0 46.71 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 125.944 1.697 . . . . 0.0 107.227 -174.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.92 87.74 0.58 Allowed Glycine 0 C--N 1.362 1.983 0 N-CA-C 107.023 -2.431 . . . . 0.0 107.023 169.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.04 114.75 26.59 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 125.227 1.411 . . . . 0.0 109.868 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -124.42 140.53 52.86 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 -171.264 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.3 t -124.33 119.2 28.59 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.5 mtt -127.42 126.98 43.37 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.05 -84.24 0.02 OUTLIER 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.553 2.341 . . . . 0.0 110.82 173.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.3 55.94 0.17 Allowed Glycine 0 N--CA 1.432 -1.586 0 N-CA-C 106.088 -2.805 . . . . 0.0 106.088 167.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -154.0 151.54 29.49 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.5 t -106.81 146.69 30.6 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.543 2.337 . . . . 0.0 109.367 -163.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -127.29 139.12 53.11 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 106.701 174.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.8 m -123.81 116.15 22.51 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 124.458 1.103 . . . . 0.0 108.043 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 . . . . . 0 N--CA 1.439 -1.016 0 C-N-CA 126.51 1.924 . . . . 0.0 106.883 -179.776 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 45.5 mt . . . . . 0 N--CA 1.443 -0.787 0 N-CA-C 103.728 -2.693 . . . . 0.0 103.728 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 33.6 pt -103.21 -173.11 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.39 1.476 . . . . 0.0 109.015 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -134.95 78.16 1.72 Allowed 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.244 1.018 . . . . 0.0 108.379 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.3 t -128.31 128.1 68.05 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.725 -2.694 . . . . 0.0 103.725 172.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -79.2 134.62 36.68 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.354 1.861 . . . . 0.0 110.472 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -144.39 169.47 17.86 Favored 'General case' 0 C--N 1.358 0.961 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -167.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -148.8 18.86 1.01 Allowed 'General case' 0 C--N 1.353 0.733 0 C-N-CA 125.874 1.67 . . . . 0.0 106.515 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.7 p -169.6 151.19 4.25 Favored Pre-proline 0 C--N 1.36 1.033 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 -175.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -71.26 -15.15 31.68 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 124.597 3.531 . . . . 0.0 114.326 166.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -73.63 -19.61 60.81 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.306 2.642 . . . . 0.0 114.744 170.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.0 tp60 -88.96 -13.76 38.2 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.415 2.686 . . . . 0.0 110.883 175.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.7 t -106.29 -13.79 15.29 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.11 2.164 . . . . 0.0 109.407 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.2 p -87.82 4.41 44.61 Favored 'General case' 0 C--N 1.368 1.398 0 O-C-N 120.303 -1.498 . . . . 0.0 111.251 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.04 -59.33 0.63 Allowed Pre-proline 0 C--N 1.361 1.107 0 C-N-CA 129.279 3.032 . . . . 0.0 111.139 169.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.72 -39.41 4.68 Favored 'Trans proline' 0 C--N 1.366 1.484 0 C-N-CA 125.089 3.859 . . . . 0.0 113.651 174.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.7 m -70.78 -30.32 66.77 Favored 'General case' 0 C--N 1.368 1.398 0 C-N-CA 127.57 2.348 . . . . 0.0 114.818 -176.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -88.08 -8.85 54.89 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 124.787 1.235 . . . . 0.0 112.682 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -86.43 -19.93 28.91 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 125.731 1.612 . . . . 0.0 111.696 166.098 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.1 mt -94.01 -67.9 0.83 Allowed 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.521 2.328 . . . . 0.0 110.873 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -93.99 -10.47 33.51 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 128.169 2.587 . . . . 0.0 112.2 -168.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.1 -79.71 0.42 Allowed Glycine 0 C--N 1.364 2.136 0 C-N-CA 124.897 1.237 . . . . 0.0 113.69 164.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.3 m -145.2 -15.39 0.51 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.681 1.592 . . . . 0.0 107.284 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.0 t -105.6 72.66 0.98 Allowed 'General case' 0 C--N 1.364 1.239 0 C-N-CA 126.835 2.054 . . . . 0.0 105.89 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.43 121.9 30.08 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 125.687 1.595 . . . . 0.0 106.864 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.97 84.27 0.64 Allowed Glycine 0 C--N 1.365 2.178 0 N-CA-C 107.672 -2.171 . . . . 0.0 107.672 171.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.04 117.08 29.66 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.532 1.533 . . . . 0.0 110.141 -170.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -124.64 140.33 53.04 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 -171.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.2 t -124.62 119.4 28.92 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 -178.495 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -129.39 126.3 38.51 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 103.857 -2.646 . . . . 0.0 103.857 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.2 m120 78.6 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.008 0 C-N-CA 127.564 2.346 . . . . 0.0 110.968 174.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.34 55.64 0.18 Allowed Glycine 0 N--CA 1.432 -1.567 0 N-CA-C 106.069 -2.812 . . . . 0.0 106.069 168.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -154.01 153.16 31.46 Favored 'General case' 0 C--N 1.362 1.141 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -107.54 146.07 32.33 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 127.596 2.358 . . . . 0.0 109.092 -164.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -127.65 139.47 52.7 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.391 1.876 . . . . 0.0 106.451 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -121.58 118.72 29.94 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 124.563 1.145 . . . . 0.0 108.149 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 . . . . . 0 N--CA 1.436 -1.146 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 179.214 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.414 HG23 ' HG2' ' A' ' 35' ' ' LYS . 85.4 mt . . . . . 0 CA--C 1.511 -0.558 0 N-CA-C 105.82 -1.918 . . . . 0.0 105.82 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.6 pt -102.47 179.22 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.082 0 C-N-CA 125.272 1.429 . . . . 0.0 111.113 -171.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -120.41 67.96 0.85 Allowed 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.741 1.616 . . . . 0.0 108.42 -172.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.2 t -125.91 129.64 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -87.68 133.73 33.78 Favored 'General case' 0 C--N 1.363 1.185 0 C-N-CA 125.98 1.712 . . . . 0.0 108.991 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -138.5 175.26 9.72 Favored 'General case' 0 C--N 1.358 0.947 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -168.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -154.54 23.12 0.47 Allowed 'General case' 0 C--N 1.356 0.855 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.3 p -173.68 149.39 1.58 Allowed Pre-proline 0 C--N 1.361 1.1 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -173.853 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -71.4 -16.34 31.01 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.189 3.259 . . . . 0.0 114.617 168.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -78.31 -13.75 59.71 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 127.624 2.37 . . . . 0.0 114.897 173.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -88.2 -11.26 47.23 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 127.962 2.505 . . . . 0.0 110.324 171.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -110.13 -12.34 14.5 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 127.322 2.249 . . . . 0.0 108.758 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.6 m -85.68 -1.65 57.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.535 1.934 . . . . 0.0 111.12 173.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -79.08 -59.27 0.63 Allowed Pre-proline 0 C--N 1.359 0.979 0 C-N-CA 129.203 3.001 . . . . 0.0 111.319 171.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.22 -41.9 2.3 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 125.004 3.803 . . . . 0.0 113.551 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.32 -29.05 65.66 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.656 2.383 . . . . 0.0 114.813 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -88.0 -8.39 55.7 Favored 'General case' 0 C--N 1.37 1.476 0 CA-C-N 120.069 1.304 . . . . 0.0 113.545 170.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -86.55 -20.74 27.53 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.694 1.598 . . . . 0.0 111.536 166.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.9 mt -93.96 -66.21 0.93 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.549 2.339 . . . . 0.0 111.141 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -95.4 -7.76 37.5 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.812 2.445 . . . . 0.0 112.212 -167.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.8 -78.77 0.37 Allowed Glycine 0 C--N 1.366 2.196 0 C-N-CA 125.124 1.345 . . . . 0.0 113.334 165.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.413 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -153.12 -7.92 0.17 Allowed 'General case' 0 C--N 1.354 0.787 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.779 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.413 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.3 t -104.93 69.7 0.88 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.103 2.161 . . . . 0.0 105.687 175.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.99 127.49 41.76 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 125.709 1.604 . . . . 0.0 106.691 -175.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.56 89.57 0.66 Allowed Glycine 0 C--N 1.36 1.91 0 N-CA-C 107.084 -2.406 . . . . 0.0 107.084 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.11 116.52 29.11 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 125.144 1.378 . . . . 0.0 109.736 -171.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -123.44 141.73 51.7 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 -173.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -123.03 110.29 15.16 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 -178.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 49.9 mtt -117.38 122.8 44.83 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 79.12 -85.34 0.02 OUTLIER 'General case' 0 C--N 1.383 2.022 0 C-N-CA 127.561 2.345 . . . . 0.0 110.204 175.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.28 56.49 0.18 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 105.218 -3.153 . . . . 0.0 105.218 169.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -152.37 149.88 29.09 Favored 'General case' 0 C--N 1.362 1.135 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.0 t -105.83 142.33 35.74 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.238 2.215 . . . . 0.0 109.086 -165.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.414 ' HG2' HG23 ' A' ' 2' ' ' ILE . 51.6 mtmt -120.82 146.14 46.86 Favored 'General case' 0 CA--C 1.5 -0.96 0 C-N-CA 126.219 1.807 . . . . 0.0 107.168 172.023 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.88 142.84 48.31 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 . . . . . 0 N--CA 1.431 -1.381 0 N-CA-C 103.631 -2.729 . . . . 0.0 103.631 177.151 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 38.1 mt . . . . . 0 N--CA 1.446 -0.666 0 N-CA-C 104.377 -2.453 . . . . 0.0 104.377 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -107.65 -174.88 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.295 0 C-N-CA 125.143 1.377 . . . . 0.0 109.189 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 -131.63 80.05 1.91 Allowed 'General case' 0 C--N 1.361 1.101 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.8 t -129.16 126.46 64.2 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -85.75 138.19 32.27 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.902 1.681 . . . . 0.0 108.872 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 p -146.74 171.07 15.71 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -162.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.63 21.73 0.71 Allowed 'General case' 0 C--N 1.355 0.817 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 174.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.8 p -170.15 149.96 3.44 Favored Pre-proline 0 C--N 1.36 1.036 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -70.98 -17.37 32.09 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.443 3.429 . . . . 0.0 114.55 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -79.8 -10.86 59.83 Favored 'General case' 0 C--N 1.369 1.455 0 C-N-CA 127.353 2.261 . . . . 0.0 114.923 173.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -89.03 -10.64 46.77 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 127.685 2.394 . . . . 0.0 110.248 170.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.5 t -108.83 -14.6 14.55 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.193 2.197 . . . . 0.0 108.646 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.6 m -83.97 -0.68 52.52 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 126.208 1.803 . . . . 0.0 111.358 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -79.15 -59.65 0.6 Allowed Pre-proline 0 C--N 1.358 0.969 0 C-N-CA 128.85 2.86 . . . . 0.0 111.277 170.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.04 -42.51 3.05 Favored 'Trans proline' 0 C--N 1.366 1.451 0 C-N-CA 125.017 3.812 . . . . 0.0 113.423 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.5 -32.59 72.67 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 127.442 2.297 . . . . 0.0 115.135 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -88.06 -7.41 57.04 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 124.429 1.092 . . . . 0.0 112.605 173.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -87.82 -22.57 24.41 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 125.795 1.638 . . . . 0.0 111.73 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.06 -66.68 0.91 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 127.527 2.331 . . . . 0.0 110.964 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -91.95 -18.65 23.4 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 128.21 2.604 . . . . 0.0 111.685 -169.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.96 -75.21 0.46 Allowed Glycine 0 C--N 1.365 2.192 0 C-N-CA 125.081 1.324 . . . . 0.0 113.211 165.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.3 m -144.95 -9.48 0.6 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.227 1.811 . . . . 0.0 107.694 -171.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.6 t -111.31 61.99 0.61 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 126.353 1.861 . . . . 0.0 106.216 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.8 124.09 45.27 Favored 'General case' 0 C--N 1.358 0.959 0 C-N-CA 126.063 1.745 . . . . 0.0 107.458 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.11 85.77 0.47 Allowed Glycine 0 C--N 1.362 2.012 0 N-CA-C 106.652 -2.579 . . . . 0.0 106.652 168.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.84 111.96 23.72 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 125.224 1.409 . . . . 0.0 110.094 -168.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -119.68 146.23 45.77 Favored 'General case' 0 CA--C 1.497 -1.089 0 C-N-CA 125.194 1.397 . . . . 0.0 107.268 -171.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.5 t -129.97 114.87 16.37 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.1 mmt -126.78 127.02 44.39 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 176.496 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 80.11 -83.65 0.02 OUTLIER 'General case' 0 C--N 1.383 2.048 0 C-N-CA 127.469 2.308 . . . . 0.0 109.946 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.26 56.83 0.12 Allowed Glycine 0 N--CA 1.431 -1.675 0 N-CA-C 105.42 -3.072 . . . . 0.0 105.42 168.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -153.68 152.08 30.4 Favored 'General case' 0 C--N 1.364 1.198 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -106.19 142.72 35.41 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 127.713 2.405 . . . . 0.0 109.314 -164.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -124.87 138.01 54.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 126.045 1.738 . . . . 0.0 106.887 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.1 m -121.27 110.71 16.47 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 124.428 1.091 . . . . 0.0 108.103 178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 N--CA 1.44 -0.945 0 C-N-CA 126.744 2.018 . . . . 0.0 107.858 -179.84 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.3 mt . . . . . 0 CA--C 1.513 -0.448 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.9 pt -101.67 -178.41 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.221 0 C-N-CA 125.819 1.648 . . . . 0.0 109.852 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.71 76.63 1.69 Allowed 'General case' 0 C--N 1.362 1.132 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.404 HG11 ' HG3' ' A' ' 16' ' ' PRO . 18.4 t -127.23 126.08 67.23 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 172.234 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -83.49 132.54 34.94 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.962 1.705 . . . . 0.0 110.151 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -141.66 171.56 13.89 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -165.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.43 26.93 0.51 Allowed 'General case' 0 C--N 1.356 0.87 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 170.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -170.13 148.76 3.11 Favored Pre-proline 0 C--N 1.359 1.006 0 N-CA-C 105.196 -2.15 . . . . 0.0 105.196 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -71.58 -15.93 30.51 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.216 3.278 . . . . 0.0 114.764 169.452 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -79.43 -11.04 59.92 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.493 2.317 . . . . 0.0 114.356 171.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -92.23 -2.23 56.62 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 127.216 2.207 . . . . 0.0 110.238 171.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.81 -13.55 9.53 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.254 2.221 . . . . 0.0 108.243 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -85.1 -0.84 55.83 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 126.077 1.751 . . . . 0.0 111.251 174.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.9 mmmm -81.45 -57.31 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.927 0 C-N-CA 128.915 2.886 . . . . 0.0 111.282 171.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.404 ' HG3' HG11 ' A' ' 5' ' ' VAL . 61.9 Cg_endo -70.04 -41.36 3.98 Favored 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 124.796 3.664 . . . . 0.0 113.832 173.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.75 -30.59 68.22 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.522 2.329 . . . . 0.0 114.824 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.05 -7.62 56.74 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 124.747 1.219 . . . . 0.0 113.071 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.69 -20.26 26.51 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 125.656 1.582 . . . . 0.0 111.706 165.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.0 mt -94.9 -67.86 0.83 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.499 2.32 . . . . 0.0 110.967 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -91.65 -13.22 32.18 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 128.373 2.669 . . . . 0.0 111.789 -169.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.95 -75.63 0.29 Allowed Glycine 0 C--N 1.365 2.148 0 C-N-CA 124.916 1.246 . . . . 0.0 113.942 162.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.41 -34.76 0.48 Allowed 'General case' 0 C--N 1.354 0.795 0 C-N-CA 125.543 1.537 . . . . 0.0 107.071 -170.054 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 t -92.61 78.93 4.86 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.877 2.471 . . . . 0.0 107.778 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -132.82 120.13 21.17 Favored 'General case' 0 C--N 1.361 1.077 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.32 85.53 0.73 Allowed Glycine 0 C--N 1.363 2.076 0 N-CA-C 107.638 -2.185 . . . . 0.0 107.638 172.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.18 117.6 30.26 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.65 1.58 . . . . 0.0 110.095 -169.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -123.99 141.39 52.09 Favored 'General case' 0 C--N 1.362 1.146 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -171.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.5 t -122.68 111.0 16.22 Favored 'General case' 0 C--N 1.351 0.671 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.3 mtp -117.81 123.67 46.52 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 105.109 -2.182 . . . . 0.0 105.109 175.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.58 -84.3 0.02 OUTLIER 'General case' 0 C--N 1.383 2.026 0 C-N-CA 127.641 2.376 . . . . 0.0 110.826 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.04 56.07 0.18 Allowed Glycine 0 N--CA 1.432 -1.571 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -154.0 152.36 30.44 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 175.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.9 t -105.58 145.5 30.88 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 127.262 2.225 . . . . 0.0 109.574 -164.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -126.04 143.62 51.04 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 126.225 1.81 . . . . 0.0 106.964 173.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -127.59 116.6 20.58 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 124.949 1.3 . . . . 0.0 108.298 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 . . . . . 0 N--CA 1.438 -1.053 0 C-N-CA 126.429 1.892 . . . . 0.0 105.935 178.728 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.4 mt . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 pt -103.42 -171.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.273 0 C-N-CA 125.442 1.497 . . . . 0.0 109.335 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -133.48 77.71 1.74 Allowed 'General case' 0 C--N 1.361 1.077 0 C-N-CA 124.464 1.106 . . . . 0.0 108.685 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -129.49 127.7 65.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 171.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -82.43 132.78 35.2 Favored 'General case' 0 C--N 1.366 1.289 0 C-N-CA 125.964 1.706 . . . . 0.0 109.9 -176.657 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.0 p -141.38 166.62 24.25 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 123.821 1.772 . . . . 0.0 110.079 -165.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 83.3 m -128.91 -49.11 1.23 Allowed 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 129.634 3.174 . . . . 0.0 104.699 -174.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.9 p -114.23 163.24 19.64 Favored Pre-proline 0 C--N 1.36 1.058 0 C-N-CA 127.443 2.297 . . . . 0.0 109.011 -177.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -72.6 -17.31 26.51 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.546 3.497 . . . . 0.0 114.409 164.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.68 -14.98 60.36 Favored 'General case' 0 C--N 1.372 1.57 0 C-N-CA 127.681 2.392 . . . . 0.0 114.469 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -84.81 -14.63 47.46 Favored 'General case' 0 C--N 1.37 1.491 0 C-N-CA 128.399 2.679 . . . . 0.0 110.62 172.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -107.46 -14.08 14.94 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 127.343 2.257 . . . . 0.0 109.077 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.7 m -84.52 -2.06 56.75 Favored 'General case' 0 C--N 1.369 1.413 0 C-N-CA 126.067 1.747 . . . . 0.0 111.386 174.671 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -80.43 -57.29 0.63 Allowed Pre-proline 0 N--CA 1.442 -0.866 0 C-N-CA 129.042 2.937 . . . . 0.0 111.5 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.63 -41.52 4.37 Favored 'Trans proline' 0 C--N 1.365 1.434 0 C-N-CA 124.984 3.789 . . . . 0.0 114.049 173.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.75 -30.9 68.59 Favored 'General case' 0 C--N 1.368 1.379 0 C-N-CA 127.579 2.352 . . . . 0.0 114.815 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -88.08 -7.7 56.58 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 124.921 1.288 . . . . 0.0 113.33 172.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -86.99 -20.12 27.71 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 125.654 1.582 . . . . 0.0 111.436 165.533 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.4 mt -92.39 -66.51 0.92 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 127.51 2.324 . . . . 0.0 111.168 177.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.2 -8.83 29.04 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 128.032 2.533 . . . . 0.0 112.245 -166.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.64 0.46 Allowed Glycine 0 C--N 1.364 2.109 0 C-N-CA 125.042 1.306 . . . . 0.0 113.377 165.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.42 -8.65 0.38 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 125.843 1.657 . . . . 0.0 107.143 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.1 t -106.56 67.78 0.73 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 126.822 2.049 . . . . 0.0 105.933 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.74 126.26 43.16 Favored 'General case' 0 CA--C 1.5 -0.969 0 C-N-CA 125.748 1.619 . . . . 0.0 106.946 -174.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.79 88.07 0.63 Allowed Glycine 0 C--N 1.361 1.97 0 N-CA-C 107.372 -2.291 . . . . 0.0 107.372 170.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.97 114.17 25.86 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 125.048 1.339 . . . . 0.0 109.84 -171.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.65 141.95 48.88 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -173.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.0 t -122.2 110.37 15.64 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -120.9 123.42 42.47 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.02 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.591 2.356 . . . . 0.0 110.901 177.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.91 54.62 0.17 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.631 -2.988 . . . . 0.0 105.631 168.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -152.55 152.3 31.71 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.6 t -105.15 144.29 32.16 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.16 2.184 . . . . 0.0 109.417 -165.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -125.28 139.69 53.49 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 126.463 1.905 . . . . 0.0 107.181 173.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.9 m -123.76 118.97 28.39 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.361 1.064 . . . . 0.0 108.319 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 N--CA 1.438 -1.074 0 C-N-CA 126.569 1.948 . . . . 0.0 106.381 179.961 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt -103.54 -170.77 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.337 0 C-N-CA 125.601 1.56 . . . . 0.0 109.142 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -135.01 78.43 1.73 Allowed 'General case' 0 C--N 1.361 1.07 0 C-N-CA 124.33 1.052 . . . . 0.0 108.555 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.0 t -128.87 127.21 66.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.7 133.13 34.82 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 125.613 1.565 . . . . 0.0 110.201 -174.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -142.12 171.71 13.68 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -165.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -153.28 27.33 0.51 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 169.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.3 p -170.53 149.22 2.97 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -71.31 -14.25 31.14 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 124.228 3.286 . . . . 0.0 114.822 168.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -87.75 9.43 21.7 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 126.71 2.004 . . . . 0.0 113.464 171.259 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -113.1 19.55 17.08 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.189 2.196 . . . . 0.0 107.614 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.3 t -142.58 -16.06 0.72 Allowed 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.36 1.864 . . . . 0.0 109.001 -175.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.8 m -83.83 -0.7 52.2 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 126.333 1.853 . . . . 0.0 111.717 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.1 mptp? -83.13 -57.3 0.44 Allowed Pre-proline 0 C--N 1.358 0.959 0 C-N-CA 129.069 2.947 . . . . 0.0 110.885 173.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.83 -40.01 5.71 Favored 'Trans proline' 0 C--N 1.367 1.521 0 C-N-CA 124.877 3.718 . . . . 0.0 113.714 174.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -70.07 -31.44 69.05 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 127.805 2.442 . . . . 0.0 114.782 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -88.07 -5.02 58.69 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 124.78 1.232 . . . . 0.0 113.463 171.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -87.05 -24.92 24.45 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 125.98 1.712 . . . . 0.0 110.655 164.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.9 mt -89.78 -63.38 1.29 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.473 2.309 . . . . 0.0 111.913 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -98.21 -9.05 26.24 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 127.797 2.439 . . . . 0.0 111.893 -167.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.56 -80.12 0.36 Allowed Glycine 0 C--N 1.365 2.176 0 C-N-CA 124.898 1.237 . . . . 0.0 113.407 165.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 24' ' ' SER . 74.8 m -146.31 -15.79 0.44 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.458 1.503 . . . . 0.0 107.006 -176.002 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.5 t -102.71 74.3 1.34 Allowed 'General case' 0 C--N 1.365 1.265 0 C-N-CA 126.948 2.099 . . . . 0.0 106.435 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -130.27 125.45 34.83 Favored 'General case' 0 C--N 1.36 1.025 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 -176.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.99 85.91 0.65 Allowed Glycine 0 C--N 1.362 2.016 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 171.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.05 117.74 30.53 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.49 1.516 . . . . 0.0 109.964 -170.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -124.51 144.32 50.18 Favored 'General case' 0 C--N 1.362 1.138 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -170.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -122.96 113.46 19.11 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -126.01 125.85 43.32 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 104.438 -2.43 . . . . 0.0 104.438 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 81.04 -86.25 0.02 OUTLIER 'General case' 0 C--N 1.384 2.068 0 C-N-CA 127.592 2.357 . . . . 0.0 109.158 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -173.23 54.51 0.16 Allowed Glycine 0 N--CA 1.432 -1.593 0 N-CA-C 104.923 -3.271 . . . . 0.0 104.923 166.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -150.23 152.95 35.39 Favored 'General case' 0 C--N 1.365 1.27 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.9 t -105.05 144.12 32.3 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 126.771 2.029 . . . . 0.0 109.297 -164.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -124.32 142.31 51.37 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 126.179 1.792 . . . . 0.0 106.774 174.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.8 m -125.97 119.01 26.58 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 124.342 1.057 . . . . 0.0 108.198 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 . . . . . 0 N--CA 1.436 -1.146 0 N-CA-C 105.769 -1.938 . . . . 0.0 105.769 178.997 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.6 mt . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 102.897 -3.001 . . . . 0.0 102.897 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.0 pt -99.5 -177.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.314 0 C-N-CA 125.556 1.543 . . . . 0.0 110.235 -178.035 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.39 74.47 1.52 Allowed 'General case' 0 C--N 1.362 1.146 0 C-N-CA 124.813 1.245 . . . . 0.0 107.957 -174.607 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.4 t -126.81 122.6 60.95 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 N-CA-C 103.36 -2.83 . . . . 0.0 103.36 171.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -85.62 136.45 33.37 Favored 'General case' 0 C--N 1.364 1.226 0 C-N-CA 125.771 1.628 . . . . 0.0 109.029 -173.107 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 p -145.61 170.47 16.39 Favored 'General case' 0 C--N 1.356 0.891 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 -160.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.43 22.63 0.72 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.789 -1.93 . . . . 0.0 105.789 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 p -170.62 148.36 2.71 Favored Pre-proline 0 C--N 1.36 1.054 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -174.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -71.52 -13.36 30.13 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 124.632 3.554 . . . . 0.0 114.291 165.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -75.57 -15.22 60.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 128.156 2.582 . . . . 0.0 114.786 170.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -91.85 -9.8 42.05 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 128.052 2.541 . . . . 0.0 110.332 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.7 t -112.64 -12.86 13.35 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.857 2.063 . . . . 0.0 109.456 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.2 p -87.96 0.43 55.9 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 125.71 1.604 . . . . 0.0 111.345 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -78.96 -58.05 0.73 Allowed Pre-proline 0 C--N 1.36 1.053 0 C-N-CA 128.42 2.688 . . . . 0.0 111.775 169.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.98 -41.41 2.74 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.945 3.763 . . . . 0.0 113.204 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -69.89 -31.66 69.58 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.831 2.452 . . . . 0.0 114.971 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -88.01 -6.64 57.88 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 124.659 1.184 . . . . 0.0 113.304 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.09 -22.32 22.96 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 126.255 1.822 . . . . 0.0 111.638 165.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.2 mt -91.3 -68.17 0.81 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.287 2.235 . . . . 0.0 110.966 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.24 -30.07 15.37 Favored 'General case' 0 C--N 1.36 1.055 0 C-N-CA 128.001 2.52 . . . . 0.0 111.672 -167.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.48 -169.64 14.88 Favored Glycine 0 C--N 1.36 1.883 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 34.2 m -69.23 -4.92 19.73 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 128.496 2.719 . . . . 0.0 116.302 -174.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 t -109.57 67.1 0.64 Allowed 'General case' 0 C--N 1.363 1.159 0 C-N-CA 126.717 2.007 . . . . 0.0 106.196 167.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.47 140.73 49.04 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.055 1.742 . . . . 0.0 106.6 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.82 87.11 0.62 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.476 -2.25 . . . . 0.0 107.476 173.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.94 112.59 24.29 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.357 1.463 . . . . 0.0 109.425 -171.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -123.23 139.0 54.5 Favored 'General case' 0 C--N 1.362 1.111 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -171.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.9 t -119.88 112.45 19.23 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -121.97 123.52 41.86 Favored 'General case' 0 C--N 1.358 0.957 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 37.7 t30 79.23 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.381 1.963 0 C-N-CA 127.285 2.234 . . . . 0.0 110.217 175.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.48 55.35 0.17 Allowed Glycine 0 N--CA 1.432 -1.599 0 N-CA-C 105.495 -3.042 . . . . 0.0 105.495 168.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -154.05 153.95 32.81 Favored 'General case' 0 C--N 1.363 1.175 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -105.03 148.47 26.72 Favored 'General case' 0 C--N 1.359 0.983 0 C-N-CA 127.23 2.212 . . . . 0.0 109.454 -165.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -128.15 142.66 51.12 Favored 'General case' 0 CA--C 1.501 -0.921 0 C-N-CA 126.238 1.815 . . . . 0.0 106.89 174.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.8 m -123.67 123.72 41.17 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 . . . . . 0 N--CA 1.437 -1.12 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.665 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt . . . . . 0 N--CA 1.444 -0.766 0 N-CA-C 102.995 -2.965 . . . . 0.0 102.995 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.1 pt -99.8 -178.93 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.287 0 C-N-CA 125.576 1.55 . . . . 0.0 109.858 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -127.21 75.66 1.6 Allowed 'General case' 0 C--N 1.363 1.183 0 C-N-CA 124.541 1.137 . . . . 0.0 107.935 -174.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.413 HG11 ' HG3' ' A' ' 16' ' ' PRO . 15.6 t -129.38 129.22 67.08 Favored 'Isoleucine or valine' 0 C--N 1.36 1.055 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 172.805 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -82.59 140.88 32.98 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 125.914 1.686 . . . . 0.0 109.613 -175.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.9 p -147.67 167.35 24.83 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -167.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -148.83 22.12 1.0 Allowed 'General case' 0 C--N 1.355 0.81 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 171.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.0 p -169.01 150.73 4.53 Favored Pre-proline 0 C--N 1.361 1.067 0 N-CA-C 105.304 -2.109 . . . . 0.0 105.304 -175.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -71.62 -16.32 30.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.114 3.21 . . . . 0.0 114.815 169.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.51 -4.82 57.02 Favored 'General case' 0 C--N 1.369 1.437 0 C-N-CA 127.009 2.123 . . . . 0.0 114.569 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -99.14 3.01 46.42 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 127.161 2.184 . . . . 0.0 109.648 171.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -122.99 -14.04 7.68 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 127.465 2.306 . . . . 0.0 108.007 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 m -85.66 0.66 52.06 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 126.195 1.798 . . . . 0.0 110.81 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.45 -57.21 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.965 0 C-N-CA 129.297 3.039 . . . . 0.0 110.92 172.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.413 ' HG3' HG11 ' A' ' 5' ' ' VAL . 62.2 Cg_endo -70.05 -42.04 3.43 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 124.867 3.711 . . . . 0.0 113.919 171.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.3 -28.98 65.61 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.293 2.237 . . . . 0.0 114.941 -175.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -88.09 -11.08 48.12 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.589 1.156 . . . . 0.0 113.026 171.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -84.78 -20.37 31.13 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 125.527 1.531 . . . . 0.0 111.872 166.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.5 mt -93.42 -67.01 0.88 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.626 2.37 . . . . 0.0 111.03 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -96.78 -6.61 35.75 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 127.866 2.466 . . . . 0.0 112.518 -166.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.22 -78.73 0.52 Allowed Glycine 0 C--N 1.366 2.203 0 C-N-CA 125.074 1.321 . . . . 0.0 113.672 164.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.405 ' H ' ' H ' ' A' ' 24' ' ' SER . 10.1 t -153.2 -7.96 0.17 Allowed 'General case' 0 C--N 1.354 0.776 0 N-CA-C 106.528 -1.656 . . . . 0.0 106.528 -174.691 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.405 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.5 t -106.21 68.71 0.77 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.001 2.12 . . . . 0.0 105.66 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.86 128.88 48.32 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.013 1.725 . . . . 0.0 106.892 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.46 87.53 0.54 Allowed Glycine 0 C--N 1.362 2.005 0 N-CA-C 106.965 -2.454 . . . . 0.0 106.965 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.42 113.45 25.11 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.235 1.414 . . . . 0.0 109.704 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -124.03 140.36 53.04 Favored 'General case' 0 C--N 1.36 1.054 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -171.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 45.3 t -121.24 113.62 20.21 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.6 mmm -124.23 123.62 40.66 Favored 'General case' 0 C--N 1.359 1.003 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 79.23 -85.73 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.463 2.305 . . . . 0.0 110.266 175.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.76 54.12 0.19 Allowed Glycine 0 N--CA 1.433 -1.522 0 N-CA-C 105.453 -3.059 . . . . 0.0 105.453 169.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -154.02 154.35 33.57 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.2 t -106.1 147.15 29.28 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.368 2.267 . . . . 0.0 109.407 -164.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -126.81 141.06 51.93 Favored 'General case' 0 CA--C 1.501 -0.916 0 C-N-CA 126.165 1.786 . . . . 0.0 106.794 173.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.4 m -123.56 124.42 42.77 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 . . . . . 0 N--CA 1.436 -1.164 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.29 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.434 HG23 ' HG2' ' A' ' 35' ' ' LYS . 88.1 mt . . . . . 0 CA--C 1.511 -0.544 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -105.38 -177.56 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.117 0 C-N-CA 125.938 1.695 . . . . 0.0 109.933 -172.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -127.26 75.93 1.62 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 124.918 1.287 . . . . 0.0 107.686 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 t -126.76 125.66 67.28 Favored 'Isoleucine or valine' 0 C--N 1.362 1.126 0 N-CA-C 103.909 -2.626 . . . . 0.0 103.909 173.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -80.58 133.13 35.73 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.13 1.772 . . . . 0.0 110.067 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.0 169.94 16.66 Favored 'General case' 0 C--N 1.357 0.934 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -166.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.49 22.07 0.72 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.918 -1.882 . . . . 0.0 105.918 174.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 p -170.06 149.51 3.37 Favored Pre-proline 0 C--N 1.36 1.044 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 -175.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -71.64 -16.64 30.16 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.317 3.345 . . . . 0.0 114.601 168.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -82.27 -3.43 55.19 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.931 2.093 . . . . 0.0 114.628 171.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -94.23 -5.81 46.05 Favored 'General case' 0 C--N 1.37 1.499 0 C-N-CA 127.319 2.248 . . . . 0.0 109.827 169.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.0 t -116.35 -13.05 11.03 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 126.921 2.089 . . . . 0.0 108.795 -177.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -86.25 -2.38 58.33 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 126.655 1.982 . . . . 0.0 110.604 172.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -79.15 -57.97 0.72 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.099 2.959 . . . . 0.0 111.389 171.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.18 -45.01 0.96 Allowed 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 124.984 3.789 . . . . 0.0 113.577 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.2 m -69.43 -28.93 66.55 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 127.296 2.238 . . . . 0.0 115.048 -177.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -88.05 -9.3 53.79 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.73 170.528 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -86.04 -23.28 26.84 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 125.651 1.58 . . . . 0.0 111.319 167.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.8 mt -87.99 -61.16 1.78 Allowed 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.785 2.434 . . . . 0.0 111.389 176.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -107.34 1.71 23.94 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.664 1.986 . . . . 0.0 112.323 -162.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.84 -82.79 0.75 Allowed Glycine 0 C--N 1.365 2.163 0 C-N-CA 125.163 1.363 . . . . 0.0 113.711 165.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.5 m -148.2 -6.75 0.42 Allowed 'General case' 0 C--N 1.355 0.81 0 C-N-CA 125.909 1.684 . . . . 0.0 106.797 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 23' ' ' SER . 22.0 t -102.65 77.89 1.65 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.392 2.277 . . . . 0.0 106.316 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -145.36 125.9 14.12 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.21 87.35 0.66 Allowed Glycine 0 C--N 1.366 2.208 0 N-CA-C 107.535 -2.226 . . . . 0.0 107.535 171.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.1 113.18 25.36 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 125.171 1.388 . . . . 0.0 110.71 -168.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -117.91 145.62 44.52 Favored 'General case' 0 C--N 1.363 1.177 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -125.09 112.95 17.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 105.469 -2.048 . . . . 0.0 105.469 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.85 123.91 41.49 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 104.4 -2.445 . . . . 0.0 104.4 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.0 m120 77.65 -84.03 0.03 OUTLIER 'General case' 0 C--N 1.383 2.027 0 C-N-CA 127.617 2.367 . . . . 0.0 111.09 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.64 55.44 0.16 Allowed Glycine 0 N--CA 1.433 -1.505 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 169.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -152.51 153.02 32.62 Favored 'General case' 0 C--N 1.364 1.197 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.0 t -104.99 142.98 33.82 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.347 2.259 . . . . 0.0 109.238 -165.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HG2' HG23 ' A' ' 2' ' ' ILE . 57.3 mtmt -125.63 145.53 50.11 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 126.031 1.732 . . . . 0.0 108.107 174.466 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 16.6 m -117.43 135.44 53.89 Favored 'General case' 0 C--N 1.36 1.049 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 . . . . . 0 C--N 1.359 1.009 0 C-N-CA 124.801 1.24 . . . . 0.0 109.097 -174.846 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.8 mt . . . . . 0 N--CA 1.447 -0.616 0 N-CA-C 104.318 -2.475 . . . . 0.0 104.318 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.3 pt -106.68 -172.58 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.249 0 C-N-CA 125.385 1.474 . . . . 0.0 108.949 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -133.33 85.74 2.24 Favored 'General case' 0 C--N 1.361 1.085 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.0 t -131.42 129.45 62.15 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 N-CA-C 103.473 -2.788 . . . . 0.0 103.473 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -79.29 135.38 36.73 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 126.283 1.833 . . . . 0.0 110.187 -178.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.72 173.06 12.17 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -168.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.01 27.34 0.42 Allowed 'General case' 0 C--N 1.355 0.844 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 169.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.3 p -171.32 148.54 2.38 Favored Pre-proline 0 C--N 1.361 1.075 0 N-CA-C 105.1 -2.185 . . . . 0.0 105.1 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -70.7 -17.46 33.28 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 124.286 3.324 . . . . 0.0 114.857 169.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.63 -8.77 59.41 Favored 'General case' 0 C--N 1.368 1.392 0 C-N-CA 127.556 2.342 . . . . 0.0 114.204 172.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -93.96 -1.84 54.03 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 126.954 2.102 . . . . 0.0 110.193 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.8 t -118.51 -12.97 9.74 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 127.157 2.183 . . . . 0.0 108.209 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.3 m -83.47 -1.94 54.75 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 125.987 1.715 . . . . 0.0 112.099 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -80.99 -56.96 0.6 Allowed Pre-proline 0 C--N 1.361 1.067 0 C-N-CA 128.304 2.642 . . . . 0.0 111.358 171.446 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.26 -40.81 4.16 Favored 'Trans proline' 0 C--N 1.366 1.456 0 C-N-CA 124.78 3.653 . . . . 0.0 113.59 175.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.7 m -69.19 -31.87 70.78 Favored 'General case' 0 C--N 1.368 1.391 0 C-N-CA 127.787 2.435 . . . . 0.0 114.888 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -88.07 -6.01 58.16 Favored 'General case' 0 C--N 1.369 1.436 0 C-N-CA 124.852 1.261 . . . . 0.0 113.267 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -88.59 -20.31 25.16 Favored 'General case' 0 C--N 1.36 1.053 0 C-N-CA 125.906 1.682 . . . . 0.0 111.243 165.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.7 mt -93.1 -67.09 0.88 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.571 2.348 . . . . 0.0 111.119 178.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -95.56 -10.07 30.58 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 128.163 2.585 . . . . 0.0 112.121 -167.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.62 -79.55 0.39 Allowed Glycine 0 C--N 1.365 2.139 0 C-N-CA 125.01 1.29 . . . . 0.0 113.404 165.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.69 -13.38 0.44 Allowed 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.65 1.58 . . . . 0.0 107.071 -175.048 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 t -104.43 70.18 0.94 Allowed 'General case' 0 C--N 1.366 1.321 0 C-N-CA 126.862 2.065 . . . . 0.0 106.1 177.194 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.45 126.25 43.47 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.738 1.615 . . . . 0.0 106.826 -175.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.25 86.54 0.57 Allowed Glycine 0 C--N 1.361 1.95 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 171.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.36 114.73 26.83 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 125.185 1.394 . . . . 0.0 109.822 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -121.34 145.54 47.78 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -173.036 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.1 t -127.93 112.08 14.29 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 65.9 mtt -131.92 130.85 42.11 Favored 'General case' 0 C--N 1.359 1.009 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 79.36 -14.36 0.87 Allowed 'General case' 0 C--N 1.384 2.072 0 C-N-CA 126.869 2.068 . . . . 0.0 114.516 172.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.22 41.18 4.06 Favored Glycine 0 C--N 1.361 1.952 0 C-N-CA 127.36 2.41 . . . . 0.0 110.451 -171.101 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -148.54 151.33 34.92 Favored 'General case' 0 C--N 1.365 1.246 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.5 t -104.94 140.09 38.69 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.583 1.953 . . . . 0.0 109.462 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -121.76 140.53 52.23 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 126.128 1.771 . . . . 0.0 107.066 173.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.2 m -125.72 113.2 17.01 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 . . . . . 0 N--CA 1.439 -1.013 0 C-N-CA 127.243 2.217 . . . . 0.0 106.767 -179.891 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 103.9 -2.63 . . . . 0.0 103.9 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -102.52 -179.73 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.318 0 C-N-CA 125.715 1.606 . . . . 0.0 110.013 -178.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -123.77 71.9 1.12 Allowed 'General case' 0 C--N 1.363 1.157 0 C-N-CA 125.075 1.35 . . . . 0.0 108.323 -173.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.469 HG11 ' HG3' ' A' ' 16' ' ' PRO . 14.1 t -128.94 131.18 68.44 Favored 'Isoleucine or valine' 0 C--N 1.362 1.111 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 173.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.73 140.18 30.71 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 125.868 1.667 . . . . 0.0 109.308 -173.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 p -146.3 168.56 20.78 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -168.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -153.38 26.02 0.52 Allowed 'General case' 0 C--N 1.355 0.848 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 167.388 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.4 p -167.46 148.22 4.88 Favored Pre-proline 0 C--N 1.361 1.068 0 N-CA-C 105.19 -2.152 . . . . 0.0 105.19 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -72.59 -14.74 27.52 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 123.966 3.111 . . . . 0.0 114.844 171.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -76.88 -15.97 59.54 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 127.234 2.214 . . . . 0.0 114.28 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -88.65 -3.76 58.71 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 127.262 2.225 . . . . 0.0 110.636 173.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.2 t -117.41 -13.84 10.36 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 127.556 2.342 . . . . 0.0 108.433 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -85.99 -1.85 57.73 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 126.184 1.793 . . . . 0.0 111.075 174.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -77.4 -59.01 0.9 Allowed Pre-proline 0 C--N 1.357 0.895 0 C-N-CA 129.006 2.923 . . . . 0.0 111.813 170.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.469 ' HG3' HG11 ' A' ' 5' ' ' VAL . 71.1 Cg_endo -71.32 -41.04 2.7 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 124.961 3.774 . . . . 0.0 113.676 174.892 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.47 -29.31 65.83 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 127.509 2.324 . . . . 0.0 114.566 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -88.06 -9.91 51.89 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 124.732 1.213 . . . . 0.0 113.103 171.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -85.5 -20.08 30.22 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 125.613 1.565 . . . . 0.0 111.706 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.1 mt -93.81 -66.53 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.681 2.393 . . . . 0.0 111.092 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -96.12 -7.63 35.44 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.875 2.47 . . . . 0.0 112.346 -167.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.14 -78.91 0.4 Allowed Glycine 0 C--N 1.364 2.125 0 C-N-CA 124.982 1.277 . . . . 0.0 113.445 165.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.7 t -153.06 -8.43 0.17 Allowed 'General case' 0 C--N 1.354 0.775 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 t -106.3 68.78 0.77 Allowed 'General case' 0 C--N 1.365 1.272 0 C-N-CA 126.947 2.099 . . . . 0.0 105.649 175.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.57 126.57 45.01 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 125.956 1.702 . . . . 0.0 106.725 -174.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.29 86.32 0.56 Allowed Glycine 0 C--N 1.361 1.962 0 N-CA-C 107.326 -2.31 . . . . 0.0 107.326 171.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.07 113.09 24.99 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.356 1.462 . . . . 0.0 109.534 -172.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -121.61 137.7 54.63 Favored 'General case' 0 C--N 1.36 1.032 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 -171.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.5 t -115.0 126.62 54.97 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 -177.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 95.9 mmm -110.42 69.14 0.68 Allowed 'General case' 0 C--N 1.359 1.02 0 N-CA-C 104.349 -2.463 . . . . 0.0 104.349 172.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -2.9 71.32 0.0 OUTLIER 'General case' 0 C--N 1.38 1.927 1 C-N-CA 134.678 5.191 . . . . 0.0 118.433 -172.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.48 -39.38 0.58 Allowed Glycine 0 C--N 1.354 1.545 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -164.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -154.06 158.27 40.26 Favored 'General case' 0 C--N 1.37 1.474 0 CA-C-N 119.443 1.622 . . . . 0.0 108.666 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -107.46 153.81 22.27 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 128.661 2.784 . . . . 0.0 109.688 -166.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -131.46 142.77 50.06 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.04 2.136 . . . . 0.0 106.896 175.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.1 m -125.6 122.58 36.87 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.301 1.04 . . . . 0.0 108.748 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 N--CA 1.437 -1.082 0 C-N-CA 126.443 1.897 . . . . 0.0 105.911 179.169 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.408 HG23 ' HG2' ' A' ' 35' ' ' LYS . 72.1 mt . . . . . 0 CA--C 1.511 -0.544 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.8 pt -103.72 -176.55 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.597 1.559 . . . . 0.0 110.354 -173.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -127.41 79.86 1.92 Allowed 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -128.37 123.07 59.2 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.038 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 170.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -81.82 130.28 35.01 Favored 'General case' 0 C--N 1.366 1.285 0 C-N-CA 125.954 1.702 . . . . 0.0 109.651 -175.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.1 p -139.01 171.48 14.26 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -164.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.87 22.85 0.68 Allowed 'General case' 0 C--N 1.355 0.847 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 174.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.4 p -171.52 148.01 2.2 Favored Pre-proline 0 C--N 1.36 1.043 0 N-CA-C 105.526 -2.028 . . . . 0.0 105.526 -174.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -71.56 -13.63 30.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.632 3.554 . . . . 0.0 114.173 165.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -75.28 -16.15 60.46 Favored 'General case' 0 C--N 1.369 1.447 0 C-N-CA 128.35 2.66 . . . . 0.0 114.76 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -89.8 -12.05 40.35 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 128.225 2.61 . . . . 0.0 110.441 174.396 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.8 t -111.82 -12.92 13.75 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 126.797 2.039 . . . . 0.0 109.636 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.2 p -88.04 -1.22 57.86 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 125.613 1.565 . . . . 0.0 111.61 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -78.03 -58.49 0.85 Allowed Pre-proline 0 C--N 1.36 1.03 0 C-N-CA 128.586 2.754 . . . . 0.0 111.668 169.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.9 -43.92 2.27 Favored 'Trans proline' 0 C--N 1.365 1.438 0 C-N-CA 124.98 3.787 . . . . 0.0 113.198 177.065 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 66.0 m -67.58 -33.58 75.3 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 128.26 2.624 . . . . 0.0 115.411 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -88.06 -5.04 58.69 Favored 'General case' 0 C--N 1.37 1.465 0 CA-C-N 119.628 1.103 . . . . 0.0 113.337 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -88.97 -23.44 22.65 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.97 1.708 . . . . 0.0 111.628 164.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.6 mt -90.77 -64.14 1.17 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 127.41 2.284 . . . . 0.0 111.611 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -90.05 -32.82 16.56 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.154 2.581 . . . . 0.0 110.797 -168.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.66 92.6 1.37 Allowed Glycine 0 C--N 1.364 2.116 0 C-N-CA 124.966 1.27 . . . . 0.0 114.299 163.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . 0.259 20.1 m 83.57 -53.01 0.15 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 128.439 2.696 . . . . 0.0 114.554 169.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.1 t -109.31 71.74 0.78 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 126.652 1.981 . . . . 0.0 107.103 -177.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.96 146.84 34.55 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 125.559 1.544 . . . . 0.0 107.572 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.5 89.44 0.78 Allowed Glycine 0 C--N 1.359 1.854 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.46 115.94 28.12 Favored 'General case' 0 C--N 1.355 0.827 0 C-N-CA 125.283 1.433 . . . . 0.0 109.438 -172.787 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.6 mtpt -122.81 140.29 53.09 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.1 t -119.44 110.45 16.94 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -120.05 122.91 42.14 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 178.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.44 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.635 2.374 . . . . 0.0 111.195 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.15 55.27 0.18 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 105.38 -3.088 . . . . 0.0 105.38 169.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -153.67 152.2 30.55 Favored 'General case' 0 C--N 1.364 1.203 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 176.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.2 t -105.22 143.15 33.8 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 127.119 2.167 . . . . 0.0 109.214 -166.021 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG2' HG23 ' A' ' 2' ' ' ILE . 54.0 mtmt -122.06 148.15 45.22 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 126.045 1.738 . . . . 0.0 107.232 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 m -126.02 133.69 51.67 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.434 -1.261 0 N-CA-C 104.561 -2.385 . . . . 0.0 104.561 179.25 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.9 mt . . . . . 0 N--CA 1.445 -0.719 0 N-CA-C 104.398 -2.445 . . . . 0.0 104.398 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -111.53 -171.65 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.631 1.572 . . . . 0.0 108.305 174.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -131.45 82.01 2.01 Favored 'General case' 0 C--N 1.364 1.22 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.448 HG11 ' HG3' ' A' ' 16' ' ' PRO . 9.0 t -132.89 130.0 58.37 Favored 'Isoleucine or valine' 0 C--N 1.361 1.092 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 171.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.68 135.05 35.53 Favored 'General case' 0 C--N 1.366 1.297 0 C-N-CA 125.866 1.666 . . . . 0.0 110.357 -177.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.2 p -143.72 171.8 13.7 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -168.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -153.72 27.28 0.49 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 105.307 -2.109 . . . . 0.0 105.307 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 76.1 p -170.71 149.16 2.84 Favored Pre-proline 0 C--N 1.36 1.04 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -71.69 -13.1 29.58 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 124.46 3.44 . . . . 0.0 114.081 167.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.05 -13.72 59.92 Favored 'General case' 0 C--N 1.371 1.501 0 C-N-CA 128.793 2.837 . . . . 0.0 113.915 172.001 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -98.17 0.71 46.42 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 127.719 2.408 . . . . 0.0 109.913 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.5 t -122.51 -17.5 6.97 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 126.504 1.922 . . . . 0.0 108.669 -175.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 p -87.04 1.58 52.41 Favored 'General case' 0 C--N 1.369 1.416 0 O-C-N 120.155 -1.591 . . . . 0.0 111.095 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.86 -56.81 0.54 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 129.67 3.188 . . . . 0.0 110.942 170.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.448 ' HG3' HG11 ' A' ' 5' ' ' VAL . 55.6 Cg_endo -67.35 -46.8 2.59 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 124.863 3.709 . . . . 0.0 113.646 171.26 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -62.87 -37.79 88.28 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.984 2.514 . . . . 0.0 115.517 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.1 -3.25 58.91 Favored 'General case' 0 C--N 1.368 1.4 0 C-N-CA 125.012 1.325 . . . . 0.0 113.447 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -89.02 -25.85 21.76 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 125.401 1.48 . . . . 0.0 111.911 162.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.5 mt -94.58 -61.85 1.43 Allowed 'General case' 0 C--N 1.367 1.332 0 C-N-CA 127.044 2.137 . . . . 0.0 112.844 -173.432 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -91.41 -33.59 15.19 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 127.092 2.157 . . . . 0.0 112.416 -161.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 173.88 -113.39 0.46 Allowed Glycine 0 C--N 1.356 1.661 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 176.542 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -148.52 -10.5 0.36 Allowed 'General case' 0 C--N 1.356 0.877 0 C-N-CA 126.258 1.823 . . . . 0.0 106.51 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -128.54 73.87 1.52 Allowed 'General case' 0 C--N 1.362 1.116 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.88 153.37 19.91 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.908 1.683 . . . . 0.0 108.687 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.55 87.35 0.94 Allowed Glycine 0 C--N 1.364 2.124 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.75 115.82 28.09 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 125.239 1.416 . . . . 0.0 109.459 -171.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -124.91 140.6 52.77 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 -172.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -121.33 114.7 21.71 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 -178.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -124.94 124.14 41.4 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 78.41 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.007 0 C-N-CA 127.592 2.357 . . . . 0.0 110.916 176.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.6 54.34 0.18 Allowed Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 105.48 -3.048 . . . . 0.0 105.48 168.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -153.99 151.74 29.73 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 105.631 -1.989 . . . . 0.0 105.631 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.5 t -104.96 145.92 29.76 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 127.44 2.296 . . . . 0.0 109.067 -164.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -125.77 138.86 53.87 Favored 'General case' 0 CA--C 1.499 -1.003 0 C-N-CA 126.34 1.856 . . . . 0.0 106.441 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 66.5 m -125.5 116.11 21.28 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.286 1.034 . . . . 0.0 108.717 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 . . . . . 0 N--CA 1.436 -1.127 0 C-N-CA 127.197 2.199 . . . . 0.0 106.536 179.647 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.9 mt . . . . . 0 N--CA 1.445 -0.712 0 N-CA-C 103.106 -2.924 . . . . 0.0 103.106 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.0 pt -105.8 -175.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.269 0 C-N-CA 125.307 1.443 . . . . 0.0 109.445 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -129.63 78.42 1.85 Allowed 'General case' 0 C--N 1.362 1.114 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.66 127.62 66.9 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 N-CA-C 103.772 -2.677 . . . . 0.0 103.772 172.557 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -80.35 132.84 35.85 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.218 1.807 . . . . 0.0 110.409 -176.116 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.8 p -142.85 173.13 11.82 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 123.219 1.485 . . . . 0.0 109.009 -165.938 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 96.3 m -142.05 -52.73 0.42 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 102.625 -3.102 . . . . 0.0 102.625 -168.634 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.7 p -107.98 162.74 18.82 Favored Pre-proline 0 C--N 1.362 1.127 0 C-N-CA 127.635 2.374 . . . . 0.0 109.351 179.018 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -72.12 -18.35 27.32 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.685 3.59 . . . . 0.0 114.417 164.27 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.43 -2.29 48.96 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.735 2.014 . . . . 0.0 114.505 171.759 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -93.13 -10.27 36.52 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.162 2.585 . . . . 0.0 109.773 169.762 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.6 t -112.74 -14.67 13.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 127.511 2.324 . . . . 0.0 108.159 -177.031 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -82.91 -0.69 49.6 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 126.749 2.019 . . . . 0.0 111.25 173.426 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -82.09 -57.65 0.49 Allowed Pre-proline 0 N--CA 1.439 -1.01 0 C-N-CA 129.272 3.029 . . . . 0.0 110.881 172.78 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.07 -43.69 3.07 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 124.911 3.741 . . . . 0.0 113.796 171.411 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -68.1 -30.39 69.54 Favored 'General case' 0 C--N 1.367 1.36 0 C-N-CA 127.138 2.175 . . . . 0.0 115.215 -176.01 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -88.05 -9.31 53.78 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.946 1.298 . . . . 0.0 113.076 173.108 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -87.5 -22.13 25.07 Favored 'General case' 0 C--N 1.362 1.114 0 C-N-CA 125.917 1.687 . . . . 0.0 112.219 165.735 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.8 mt -96.54 -71.13 0.69 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.214 2.206 . . . . 0.0 110.756 -177.336 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -89.45 -25.89 21.25 Favored 'General case' 0 C--N 1.361 1.102 0 C-N-CA 128.568 2.747 . . . . 0.0 111.531 -169.851 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.73 -155.86 20.14 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 125.669 1.604 . . . . 0.0 109.826 177.333 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.4 m -72.46 -4.51 30.72 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 128.337 2.655 . . . . 0.0 114.911 179.661 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.7 t -104.52 71.78 1.01 Allowed 'General case' 0 C--N 1.365 1.245 0 C-N-CA 127.261 2.224 . . . . 0.0 105.73 165.014 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.46 127.07 36.63 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.6 87.45 0.65 Allowed Glycine 0 C--N 1.361 1.96 0 N-CA-C 107.085 -2.406 . . . . 0.0 107.085 170.956 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.81 111.37 23.16 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.473 1.509 . . . . 0.0 109.754 -170.342 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -120.81 141.63 50.36 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -170.913 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.2 t -122.59 111.77 17.18 Favored 'General case' 0 C--N 1.352 0.675 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 -178.194 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.8 mmm -120.59 124.79 46.15 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 104.415 -2.439 . . . . 0.0 104.415 178.55 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.47 12.5 p30 70.41 -79.07 0.04 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 128.647 2.779 . . . . 0.0 113.596 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.23 54.0 0.14 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.854 -2.898 . . . . 0.0 105.854 169.466 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -153.23 151.49 30.13 Favored 'General case' 0 C--N 1.361 1.095 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 176.428 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.11 144.37 32.0 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.212 2.205 . . . . 0.0 109.295 -163.656 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -124.99 140.63 52.75 Favored 'General case' 0 CA--C 1.501 -0.912 0 C-N-CA 126.01 1.724 . . . . 0.0 107.027 174.219 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -125.31 110.79 14.42 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.307 1.043 . . . . 0.0 108.492 179.014 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 . . . . . 0 C--N 1.357 0.928 0 C-N-CA 127.23 2.212 . . . . 0.0 106.829 177.462 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt . . . . . 0 N--CA 1.443 -0.8 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.7 pt -101.01 -172.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.286 0 C-N-CA 125.422 1.489 . . . . 0.0 109.644 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -133.38 73.15 1.5 Allowed 'General case' 0 C--N 1.36 1.049 0 C-N-CA 124.424 1.09 . . . . 0.0 108.669 -173.1 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.8 t -125.32 125.48 69.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -88.77 125.0 34.68 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 125.264 1.426 . . . . 0.0 108.813 -171.107 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 p -131.37 176.09 8.58 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.177 0.991 . . . . 0.0 109.314 -162.931 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.84 23.27 0.45 Allowed 'General case' 0 C--N 1.356 0.88 0 N-CA-C 105.734 -1.951 . . . . 0.0 105.734 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -173.47 149.56 1.67 Allowed Pre-proline 0 C--N 1.359 1.002 0 N-CA-C 105.118 -2.179 . . . . 0.0 105.118 -173.59 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -70.58 -17.33 33.9 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.538 3.492 . . . . 0.0 114.36 167.847 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -78.02 -14.28 59.57 Favored 'General case' 0 C--N 1.37 1.473 0 C-N-CA 128.584 2.754 . . . . 0.0 114.001 174.765 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -88.66 -11.44 45.29 Favored 'General case' 0 C--N 1.372 1.574 0 C-N-CA 127.852 2.461 . . . . 0.0 110.263 172.266 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.5 t -109.08 -13.41 14.7 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.04 2.136 . . . . 0.0 109.135 -179.144 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -84.8 -0.41 53.77 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.021 1.728 . . . . 0.0 111.202 173.714 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -80.09 -59.06 0.56 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.108 2.963 . . . . 0.0 111.266 171.21 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -70.88 -41.77 2.65 Favored 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 125.023 3.815 . . . . 0.0 113.509 174.663 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.59 -30.06 66.65 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 127.482 2.313 . . . . 0.0 114.941 -176.621 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -88.07 -8.94 54.79 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.823 1.192 . . . . 0.0 112.792 171.975 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -86.27 -21.37 27.39 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.836 1.654 . . . . 0.0 111.586 166.471 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.9 mt -91.92 -66.27 0.94 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 127.563 2.345 . . . . 0.0 111.023 178.006 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.16 -8.57 29.75 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.863 2.465 . . . . 0.0 112.263 -167.179 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.38 -79.64 0.58 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 125.099 1.333 . . . . 0.0 113.655 164.92 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.8 m -147.97 -7.13 0.43 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.005 1.722 . . . . 0.0 107.225 -174.683 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.3 t -108.73 66.6 0.64 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 126.733 2.013 . . . . 0.0 105.886 177.372 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.58 125.31 42.98 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.715 1.606 . . . . 0.0 106.838 -175.871 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.16 83.59 0.43 Allowed Glycine 0 C--N 1.362 2.018 0 N-CA-C 106.897 -2.481 . . . . 0.0 106.897 170.177 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.89 113.59 25.34 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.291 1.437 . . . . 0.0 110.172 -168.427 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -119.78 149.28 42.3 Favored 'General case' 0 CA--C 1.495 -1.148 0 C-N-CA 125.197 1.399 . . . . 0.0 108.026 -171.165 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -131.33 115.34 16.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 -179.859 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 94.7 mtp -124.34 127.37 47.49 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 173.527 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.44 -83.31 0.02 OUTLIER 'General case' 0 C--N 1.384 2.104 0 C-N-CA 127.562 2.345 . . . . 0.0 110.533 174.518 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.54 57.14 0.11 Allowed Glycine 0 N--CA 1.43 -1.756 0 N-CA-C 105.558 -3.017 . . . . 0.0 105.558 167.527 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -152.09 150.21 29.66 Favored 'General case' 0 C--N 1.365 1.25 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 175.758 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -105.04 142.88 34.04 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.28 2.232 . . . . 0.0 109.555 -164.747 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -123.58 140.6 52.83 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.83 1.652 . . . . 0.0 107.315 173.008 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -120.62 119.26 32.35 Favored 'General case' 0 C--N 1.361 1.082 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.385 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 . . . . . 0 N--CA 1.438 -1.061 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 178.039 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.0 mt . . . . . 0 N--CA 1.445 -0.687 0 N-CA-C 103.064 -2.939 . . . . 0.0 103.064 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.1 pt -103.78 -175.85 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.248 0 C-N-CA 125.12 1.368 . . . . 0.0 109.679 -179.88 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -128.73 78.69 1.86 Allowed 'General case' 0 C--N 1.362 1.12 0 C-N-CA 124.913 1.285 . . . . 0.0 107.589 -175.061 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.26 124.37 62.11 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.96 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -80.87 134.94 35.84 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 126.904 2.082 . . . . 0.0 110.125 -177.87 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.3 p -142.33 -179.18 6.12 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.726 0.774 . . . . 0.0 110.079 -164.253 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.5 t -148.94 18.64 0.99 Allowed 'General case' 0 C--N 1.355 0.839 0 C-N-CA 126.064 1.746 . . . . 0.0 106.772 168.972 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.2 p -172.96 155.96 3.03 Favored Pre-proline 0 C--N 1.363 1.189 0 C-N-CA 124.651 1.181 . . . . 0.0 108.196 -172.705 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -69.75 -18.22 37.17 Favored 'Trans proline' 0 C--N 1.361 1.198 1 C-N-CA 125.395 4.064 . . . . 0.0 114.804 163.224 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -76.09 -17.11 59.76 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 128.161 2.584 . . . . 0.0 113.744 174.65 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.5 tp60 -91.6 -7.86 48.94 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 128.499 2.72 . . . . 0.0 110.179 174.293 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 t -109.06 -13.54 14.69 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.522 2.329 . . . . 0.0 109.144 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.1 m -84.39 -1.88 56.24 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 126.332 1.853 . . . . 0.0 111.295 174.511 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -79.95 -59.37 0.55 Allowed Pre-proline 0 C--N 1.357 0.907 0 C-N-CA 129.331 3.053 . . . . 0.0 111.314 171.744 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -70.61 -41.02 3.47 Favored 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 125.114 3.876 . . . . 0.0 113.584 175.332 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.12 -31.44 70.13 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 127.684 2.394 . . . . 0.0 114.735 -177.85 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.08 -6.4 57.95 Favored 'General case' 0 C--N 1.37 1.486 0 C-N-CA 124.651 1.18 . . . . 0.0 113.2 172.396 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -88.65 -20.44 24.91 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.68 1.592 . . . . 0.0 111.471 165.632 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -93.36 -66.88 0.89 Allowed 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.506 2.322 . . . . 0.0 111.111 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -92.68 -14.92 27.4 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 128.181 2.592 . . . . 0.0 111.705 -169.416 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.0 -74.29 0.29 Allowed Glycine 0 C--N 1.365 2.154 0 C-N-CA 124.9 1.238 . . . . 0.0 113.746 163.734 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.39 -35.22 0.47 Allowed 'General case' 0 C--N 1.354 0.766 0 C-N-CA 125.588 1.555 . . . . 0.0 107.13 -169.882 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.8 t -93.14 75.64 4.66 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.823 2.449 . . . . 0.0 108.034 176.466 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.53 121.15 28.16 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 -177.24 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.36 85.08 0.78 Allowed Glycine 0 C--N 1.364 2.104 0 N-CA-C 107.783 -2.127 . . . . 0.0 107.783 172.194 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.65 114.55 27.14 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 125.556 1.542 . . . . 0.0 109.843 -170.841 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -123.99 143.21 50.55 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 -172.654 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.8 113.38 8.54 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -176.696 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.5 mmt -115.0 122.32 45.85 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 -175.003 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 77.92 -83.91 0.03 OUTLIER 'General case' 0 C--N 1.38 1.895 0 C-N-CA 127.491 2.316 . . . . 0.0 111.152 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.76 49.44 0.25 Allowed Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 107.194 -2.362 . . . . 0.0 107.194 170.972 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.9 mttm -151.28 149.25 29.15 Favored 'General case' 0 C--N 1.367 1.343 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.173 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -104.97 150.11 25.19 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.91 2.484 . . . . 0.0 110.076 -161.95 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -132.31 138.39 47.8 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.559 1.943 . . . . 0.0 106.035 177.743 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.4 m -124.41 113.43 18.16 Favored 'General case' 0 C--N 1.359 1.001 0 C-N-CA 124.336 1.054 . . . . 0.0 108.685 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 . . . . . 0 N--CA 1.44 -0.964 0 C-N-CA 127.112 2.165 . . . . 0.0 106.311 178.312 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.9 mt . . . . . 0 N--CA 1.445 -0.717 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.6 pt -99.88 -177.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.382 0 C-N-CA 125.367 1.467 . . . . 0.0 109.777 -179.094 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -127.36 77.58 1.75 Allowed 'General case' 0 C--N 1.362 1.123 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -173.853 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.7 t -128.63 125.44 63.51 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.535 -2.395 . . . . 0.0 104.535 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -78.27 138.78 38.78 Favored 'General case' 0 C--N 1.367 1.338 0 C-N-CA 127.091 2.156 . . . . 0.0 110.914 -177.705 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 p -147.96 -176.35 5.24 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-O 121.421 0.629 . . . . 0.0 109.606 -166.865 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.11 27.3 0.42 Allowed 'General case' 0 C--N 1.359 0.984 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 163.89 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.9 p -174.44 151.25 1.57 Allowed Pre-proline 0 C--N 1.364 1.213 0 C-N-CA 124.669 1.188 . . . . 0.0 108.137 -170.272 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -69.12 -17.15 40.62 Favored 'Trans proline' 0 C--N 1.361 1.185 1 C-N-CA 125.333 4.022 . . . . 0.0 115.305 165.059 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.02 6.89 33.83 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 126.093 1.757 . . . . 0.0 113.746 172.385 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -113.0 25.42 11.41 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 126.917 2.087 . . . . 0.0 107.366 167.129 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.9 t -145.2 -18.26 0.49 Allowed 'General case' 0 C--N 1.356 0.857 0 C-N-CA 126.329 1.852 . . . . 0.0 109.549 -175.547 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -88.02 1.26 54.62 Favored 'General case' 0 C--N 1.37 1.496 0 CA-C-N 121.147 1.794 . . . . 0.0 110.464 177.26 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -82.79 -55.34 0.53 Allowed Pre-proline 0 C--N 1.359 1.011 0 C-N-CA 129.346 3.058 . . . . 0.0 110.955 171.155 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.83 -39.09 6.77 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 124.99 3.793 . . . . 0.0 113.79 172.724 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.8 m -70.18 -29.42 66.29 Favored 'General case' 0 C--N 1.367 1.347 0 C-N-CA 127.601 2.36 . . . . 0.0 114.828 -179.394 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -88.08 -8.27 55.75 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.922 1.289 . . . . 0.0 113.204 170.955 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -87.71 -20.42 26.25 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 125.797 1.639 . . . . 0.0 111.157 167.394 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.3 mt -92.91 -66.47 0.92 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.663 2.385 . . . . 0.0 111.016 177.578 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.42 -7.48 31.6 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.682 2.393 . . . . 0.0 112.447 -167.055 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.56 -80.75 0.52 Allowed Glycine 0 C--N 1.364 2.1 0 C-N-CA 124.953 1.263 . . . . 0.0 113.738 165.318 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.29 -11.2 0.42 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.762 1.625 . . . . 0.0 107.167 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t -105.78 70.59 0.87 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 126.811 2.045 . . . . 0.0 105.842 176.694 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.81 129.39 48.21 Favored 'General case' 0 C--N 1.36 1.033 0 C-N-CA 125.718 1.607 . . . . 0.0 107.042 -174.255 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 89.37 0.61 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.208 -2.357 . . . . 0.0 107.208 171.39 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.48 115.66 27.87 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 125.253 1.421 . . . . 0.0 109.653 -173.286 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -128.89 142.97 50.78 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 -171.501 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.7 115.37 9.07 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -174.236 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 92.1 mtp -113.29 121.92 45.86 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 126.28 1.832 . . . . 0.0 106.183 -177.581 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 78.58 -84.34 0.02 OUTLIER 'General case' 0 C--N 1.38 1.899 0 C-N-CA 127.385 2.274 . . . . 0.0 111.332 173.769 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -165.11 48.95 0.28 Allowed Glycine 0 N--CA 1.434 -1.471 0 N-CA-C 107.54 -2.224 . . . . 0.0 107.54 171.71 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -151.75 150.86 30.66 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 171.078 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.01 154.05 20.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.016 2.526 . . . . 0.0 110.472 -162.193 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -134.74 140.81 46.22 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 126.623 1.969 . . . . 0.0 105.945 177.502 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -125.86 128.02 46.96 Favored 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.417 1.087 . . . . 0.0 108.067 178.247 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 . . . . . 0 N--CA 1.436 -1.141 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -177.841 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.3 mt . . . . . 0 N--CA 1.443 -0.783 0 N-CA-C 102.832 -3.025 . . . . 0.0 102.832 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.6 pt -100.64 -179.05 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.17 -177.849 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -124.52 73.94 1.29 Allowed 'General case' 0 C--N 1.363 1.156 0 C-N-CA 124.952 1.301 . . . . 0.0 108.397 -173.071 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.41 HG11 ' HG3' ' A' ' 16' ' ' PRO . 12.6 t -128.96 126.51 64.76 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 174.009 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -84.26 140.96 31.31 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 126.424 1.89 . . . . 0.0 109.146 -175.944 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.96 -178.79 6.38 Favored 'General case' 0 C--N 1.357 0.909 0 CA-C-O 121.552 0.692 . . . . 0.0 110.41 -164.822 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -154.94 25.19 0.43 Allowed 'General case' 0 C--N 1.358 0.959 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 167.233 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.5 p -173.81 152.07 1.93 Allowed Pre-proline 0 C--N 1.365 1.274 0 C-N-CA 124.653 1.181 . . . . 0.0 107.975 -172.776 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -69.79 -17.89 37.18 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 125.269 3.98 . . . . 0.0 115.288 164.512 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.2 tptt -78.89 -13.74 59.63 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.676 1.99 . . . . 0.0 114.374 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -90.37 -3.71 57.54 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 127.239 2.215 . . . . 0.0 110.077 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.19 -14.15 12.33 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.285 2.234 . . . . 0.0 109.138 179.725 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -85.14 -3.77 58.92 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 126.071 1.748 . . . . 0.0 111.013 174.874 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -77.83 -59.33 0.8 Allowed Pre-proline 0 N--CA 1.441 -0.906 0 C-N-CA 129.408 3.083 . . . . 0.0 111.907 170.832 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.41 ' HG3' HG11 ' A' ' 5' ' ' VAL . 66.6 Cg_endo -71.14 -39.96 3.62 Favored 'Trans proline' 0 C--N 1.364 1.344 0 C-N-CA 125.138 3.892 . . . . 0.0 113.841 175.111 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.72 -29.7 66.04 Favored 'General case' 0 C--N 1.367 1.369 0 C-N-CA 127.487 2.315 . . . . 0.0 114.294 -177.115 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -88.04 -8.19 55.92 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 124.889 1.276 . . . . 0.0 113.143 171.615 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -87.07 -19.94 27.87 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 125.608 1.563 . . . . 0.0 111.443 165.924 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.4 mt -92.83 -66.51 0.92 Allowed 'General case' 0 C--N 1.364 1.227 0 C-N-CA 127.666 2.386 . . . . 0.0 111.122 178.211 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -95.53 -10.4 29.77 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.991 2.516 . . . . 0.0 112.247 -167.769 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.35 -79.97 0.37 Allowed Glycine 0 C--N 1.366 2.198 0 C-N-CA 124.863 1.221 . . . . 0.0 113.351 165.517 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.76 -14.01 0.43 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.661 1.584 . . . . 0.0 107.072 -174.968 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.7 t -104.56 70.1 0.93 Allowed 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.866 2.066 . . . . 0.0 106.146 176.816 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.1 122.89 38.47 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.134 1.774 . . . . 0.0 106.813 -176.276 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.23 84.01 0.68 Allowed Glycine 0 C--N 1.364 2.097 0 N-CA-C 107.597 -2.201 . . . . 0.0 107.597 171.718 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.86 115.8 28.45 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.298 1.439 . . . . 0.0 109.689 -171.932 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -122.57 145.55 48.24 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 102.984 -2.969 . . . . 0.0 102.984 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.89 132.05 28.09 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.747 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 96.8 mtp -105.46 73.39 1.02 Allowed 'General case' 0 C--N 1.359 1.009 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 175.259 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -0.76 68.28 0.0 OUTLIER 'General case' 0 C--N 1.378 1.813 1 C-N-CA 135.193 5.397 . . . . 0.0 118.537 -175.354 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 160.61 -42.24 0.43 Allowed Glycine 0 C--N 1.355 1.624 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -161.799 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -153.96 155.4 35.53 Favored 'General case' 0 C--N 1.37 1.482 0 CA-C-N 119.264 1.532 . . . . 0.0 109.369 179.74 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.8 t -107.02 153.63 22.31 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 129.275 3.03 . . . . 0.0 110.519 -165.266 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -133.37 137.18 45.75 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 126.79 2.036 . . . . 0.0 106.557 176.148 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 63.4 m -121.11 122.7 40.6 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 124.369 1.067 . . . . 0.0 108.721 177.935 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 . . . . . 0 N--CA 1.436 -1.165 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 178.758 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.8 mt . . . . . 0 N--CA 1.445 -0.7 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.5 pt -103.15 -171.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.289 0 C-N-CA 125.538 1.535 . . . . 0.0 108.936 177.554 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -134.99 91.62 2.77 Favored 'General case' 0 C--N 1.36 1.046 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.941 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.46 124.37 48.37 Favored 'Isoleucine or valine' 0 C--N 1.359 1.007 0 N-CA-C 103.251 -2.87 . . . . 0.0 103.251 169.746 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -79.32 134.63 36.61 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 126.689 1.996 . . . . 0.0 109.814 -178.485 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.5 p -143.32 -177.87 5.59 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-O 121.505 0.669 . . . . 0.0 110.052 -163.453 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.3 t -152.42 22.29 0.63 Allowed 'General case' 0 C--N 1.358 0.948 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 168.556 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.2 p -173.49 151.84 2.03 Favored Pre-proline 0 C--N 1.364 1.237 0 C-N-CA 124.455 1.102 . . . . 0.0 108.28 -171.102 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -69.45 -17.79 38.79 Favored 'Trans proline' 0 C--N 1.36 1.177 1 C-N-CA 125.377 4.051 . . . . 0.0 115.153 164.139 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -77.91 -15.28 59.13 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.02 2.128 . . . . 0.0 114.455 172.483 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -89.67 -4.49 57.73 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 127.256 2.222 . . . . 0.0 110.005 171.749 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.5 t -113.18 -13.49 12.99 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 127.236 2.214 . . . . 0.0 109.245 178.923 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.4 m -85.29 -4.03 59.02 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 126.128 1.771 . . . . 0.0 111.057 174.6 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -78.61 -58.85 0.73 Allowed Pre-proline 0 C--N 1.356 0.882 0 C-N-CA 129.499 3.119 . . . . 0.0 111.7 171.05 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.21 -42.23 3.11 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 125.253 3.969 . . . . 0.0 113.725 174.833 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -69.43 -30.77 68.78 Favored 'General case' 0 C--N 1.367 1.367 0 C-N-CA 127.451 2.3 . . . . 0.0 114.888 -177.458 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -87.97 -7.02 57.7 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 124.817 1.247 . . . . 0.0 113.495 171.915 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -85.79 -25.74 26.16 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 125.913 1.685 . . . . 0.0 110.956 165.317 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.7 mt -89.36 -63.3 1.31 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.553 2.341 . . . . 0.0 111.781 179.706 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.77 -8.84 25.31 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.786 2.434 . . . . 0.0 111.898 -167.495 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.14 -79.94 0.48 Allowed Glycine 0 C--N 1.365 2.189 0 C-N-CA 125.048 1.309 . . . . 0.0 113.551 165.237 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -147.31 -11.45 0.42 Allowed 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.711 1.604 . . . . 0.0 106.98 -175.43 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -105.26 69.51 0.85 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 126.887 2.075 . . . . 0.0 106.132 177.388 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.22 128.13 46.73 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 125.842 1.657 . . . . 0.0 106.723 -175.956 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.18 86.03 0.5 Allowed Glycine 0 C--N 1.362 1.975 0 N-CA-C 107.017 -2.433 . . . . 0.0 107.017 170.999 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.84 113.8 25.91 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 125.14 1.376 . . . . 0.0 109.832 -171.483 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -121.52 144.13 48.89 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 -173.595 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.82 110.76 6.23 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 -178.491 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.7 mtt -115.26 126.06 54.06 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.751 2.02 . . . . 0.0 105.695 -175.797 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 t30 81.67 -85.64 0.02 OUTLIER 'General case' 0 C--N 1.382 1.991 0 C-N-CA 127.32 2.248 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -168.86 50.84 0.22 Allowed Glycine 0 N--CA 1.433 -1.525 0 N-CA-C 106.527 -2.629 . . . . 0.0 106.527 169.363 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -151.41 149.98 29.91 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 174.595 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.4 t -104.94 150.06 25.21 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 127.686 2.395 . . . . 0.0 110.368 -162.785 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -132.36 138.88 47.9 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 126.812 2.045 . . . . 0.0 106.395 177.111 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -123.16 121.99 37.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 124.334 1.053 . . . . 0.0 108.546 178.087 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 . . . . . 0 N--CA 1.437 -1.103 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.156 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 57.1 mt . . . . . 0 N--CA 1.45 -0.431 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.7 pt -100.87 -171.62 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 126.098 1.759 . . . . 0.0 110.111 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -130.99 82.46 2.05 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -176.309 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 t -132.84 128.05 56.44 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.56 -2.755 . . . . 0.0 103.56 172.301 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -83.03 132.0 35.15 Favored 'General case' 0 C--N 1.364 1.234 0 C-N-CA 126.084 1.754 . . . . 0.0 109.551 -177.328 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -140.83 170.03 16.51 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -166.018 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -152.14 25.91 0.62 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 170.577 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -168.73 149.31 4.23 Favored Pre-proline 0 C--N 1.36 1.032 0 N-CA-C 105.175 -2.158 . . . . 0.0 105.175 -177.686 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -71.43 -15.48 31.06 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.469 3.446 . . . . 0.0 114.394 168.422 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.43 -11.65 59.96 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.047 2.539 . . . . 0.0 113.736 172.24 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -94.24 -3.93 49.8 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.509 2.324 . . . . 0.0 110.138 173.478 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.5 t -118.12 -13.41 9.95 Favored 'General case' 0 C--N 1.36 1.061 0 C-N-CA 126.886 2.074 . . . . 0.0 108.895 -177.383 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -88.03 1.0 55.26 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 125.897 1.679 . . . . 0.0 110.949 172.651 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -79.69 -58.8 0.61 Allowed Pre-proline 0 C--N 1.359 1.003 0 C-N-CA 129.165 2.986 . . . . 0.0 111.592 170.871 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.23 -40.02 3.49 Favored 'Trans proline' 0 C--N 1.365 1.404 0 C-N-CA 125.024 3.816 . . . . 0.0 113.668 175.829 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -74.3 -25.67 59.72 Favored 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.591 2.356 . . . . 0.0 114.669 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.13 -8.16 55.84 Favored 'General case' 0 C--N 1.371 1.531 0 CA-C-N 120.15 1.341 . . . . 0.0 113.248 168.122 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -86.91 -19.71 28.45 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 125.565 1.546 . . . . 0.0 111.398 166.56 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.9 mt -93.54 -65.92 0.96 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.575 2.35 . . . . 0.0 111.133 177.606 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -95.41 -6.73 40.23 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 127.797 2.439 . . . . 0.0 112.35 -167.407 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.64 -80.11 0.45 Allowed Glycine 0 C--N 1.365 2.188 0 C-N-CA 125.103 1.335 . . . . 0.0 113.392 165.459 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.7 m -146.68 -5.87 0.54 Allowed 'General case' 0 C--N 1.353 0.745 0 C-N-CA 125.722 1.609 . . . . 0.0 106.903 -177.164 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -102.22 73.24 1.34 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.092 2.157 . . . . 0.0 106.907 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -152.02 116.55 5.06 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.253 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -108.97 72.61 0.2 Allowed Glycine 0 C--N 1.36 1.862 0 N-CA-C 106.481 -2.648 . . . . 0.0 106.481 169.035 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.11 140.54 34.98 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 128.366 2.666 . . . . 0.0 111.484 -167.662 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -122.13 142.97 49.83 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.787 1.235 . . . . 0.0 107.79 -163.41 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.5 t -117.91 103.73 10.23 Favored 'General case' 0 C--N 1.353 0.732 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 178.845 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.7 mtp -111.83 121.94 46.43 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 176.975 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 78.32 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.383 2.051 0 C-N-CA 127.781 2.432 . . . . 0.0 110.706 178.618 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 53.56 0.18 Allowed Glycine 0 N--CA 1.433 -1.5 0 N-CA-C 105.299 -3.121 . . . . 0.0 105.299 168.574 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -151.88 151.82 31.78 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 179.031 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.98 141.2 36.99 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 126.497 1.919 . . . . 0.0 109.907 -163.296 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -120.08 146.64 45.73 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.669 1.988 . . . . 0.0 106.746 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.1 m -117.13 137.7 52.13 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.114 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 . . . . . 0 N--CA 1.434 -1.229 0 N-CA-C 105.112 -2.181 . . . . 0.0 105.112 -178.554 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' ILE . . . . . 0.438 HG23 ' HG2' ' A' ' 35' ' ' LYS . 98.3 mt . . . . . 0 CA--C 1.512 -0.498 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.3 pt -106.13 -174.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.037 0 C-N-CA 125.751 1.62 . . . . 0.0 110.093 -172.622 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -130.1 82.34 2.06 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -177.206 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 t -130.79 126.17 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.123 0 N-CA-C 103.101 -2.926 . . . . 0.0 103.101 171.457 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -83.23 131.59 35.09 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 125.673 1.589 . . . . 0.0 109.519 -175.953 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.8 p -138.72 171.84 13.75 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -165.941 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -152.88 26.73 0.55 Allowed 'General case' 0 C--N 1.356 0.886 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 170.202 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.8 p -170.18 148.39 2.98 Favored Pre-proline 0 C--N 1.36 1.056 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -177.443 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -71.14 -16.29 31.91 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 124.293 3.329 . . . . 0.0 114.801 168.965 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -84.08 -0.36 51.51 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.564 1.946 . . . . 0.0 114.449 171.525 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -97.17 -0.64 46.54 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 127.115 2.166 . . . . 0.0 109.619 168.118 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.6 t -122.69 -12.52 8.08 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 127.013 2.125 . . . . 0.0 108.866 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -87.68 1.11 54.64 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 126.797 2.039 . . . . 0.0 110.16 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -81.4 -58.73 0.48 Allowed Pre-proline 0 N--CA 1.44 -0.957 0 C-N-CA 129.347 3.059 . . . . 0.0 111.096 171.342 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -71.52 -40.33 3.04 Favored 'Trans proline' 0 C--N 1.364 1.393 0 C-N-CA 124.972 3.782 . . . . 0.0 113.534 173.762 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.0 m -71.88 -23.96 61.58 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 127.353 2.261 . . . . 0.0 114.764 -179.325 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -88.09 -9.06 54.46 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.471 1.487 . . . . 0.0 114.117 166.936 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -88.08 -20.07 26.22 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 125.525 1.53 . . . . 0.0 111.445 167.948 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.7 mt -98.8 -71.79 0.68 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.437 2.295 . . . . 0.0 110.292 179.368 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.82 40.48 1.56 Allowed 'General case' 0 C--N 1.359 1.004 0 C-N-CA 128.643 2.777 . . . . 0.0 109.963 -169.936 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.84 83.97 1.5 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 126.212 1.863 . . . . 0.0 116.051 -167.59 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.3 m -154.95 -61.48 0.12 Allowed 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 103.508 -2.775 . . . . 0.0 103.508 171.237 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.7 t -137.35 71.78 1.41 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 104.184 -2.525 . . . . 0.0 104.184 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.45 135.85 34.52 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 125.311 1.444 . . . . 0.0 111.899 177.079 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.51 148.62 18.38 Favored Glycine 0 C--N 1.362 2.002 0 N-CA-C 106.686 -2.566 . . . . 0.0 106.686 164.558 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.98 118.5 4.51 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 -170.788 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -122.28 147.15 46.58 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.5 t -123.05 107.93 12.33 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 177.763 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.2 mmm -119.54 123.69 44.57 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.755 -2.313 . . . . 0.0 104.755 177.991 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.08 -84.35 0.02 OUTLIER 'General case' 0 C--N 1.382 1.983 0 C-N-CA 127.645 2.378 . . . . 0.0 110.904 177.256 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.67 55.92 0.16 Allowed Glycine 0 N--CA 1.433 -1.51 0 N-CA-C 104.808 -3.317 . . . . 0.0 104.808 168.842 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -152.91 152.18 31.2 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -104.93 138.36 41.29 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.122 2.169 . . . . 0.0 108.882 -166.73 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HG2' HG23 ' A' ' 2' ' ' ILE . 52.3 mtmt -115.56 145.85 42.28 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 125.814 1.646 . . . . 0.0 107.227 169.769 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.7 m -114.42 148.51 37.61 Favored 'General case' 0 C--N 1.357 0.905 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 169.747 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 . . . . . 0 N--CA 1.433 -1.312 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -174.71 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.8 mt . . . . . 0 N--CA 1.443 -0.797 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.8 pt -101.9 -174.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.345 0 C-N-CA 125.435 1.494 . . . . 0.0 108.773 177.924 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -135.01 86.6 2.27 Favored 'General case' 0 C--N 1.361 1.1 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -179.198 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.2 t -127.69 124.72 63.88 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 N-CA-C 103.573 -2.751 . . . . 0.0 103.573 170.687 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -85.69 129.76 34.74 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 126.191 1.796 . . . . 0.0 109.521 -171.824 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.4 p -138.36 -175.72 4.21 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.36 0.664 . . . . 0.0 109.607 -160.561 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -153.79 26.02 0.5 Allowed 'General case' 0 C--N 1.359 0.982 0 N-CA-C 105.585 -2.005 . . . . 0.0 105.585 164.938 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.5 p -173.87 150.55 1.69 Allowed Pre-proline 0 C--N 1.363 1.162 0 C-N-CA 124.604 1.162 . . . . 0.0 108.241 -171.525 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -68.54 -17.84 43.27 Favored 'Trans proline' 0 C--N 1.36 1.16 1 C-N-CA 125.331 4.021 . . . . 0.0 115.444 164.217 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -75.26 -20.74 59.02 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.015 2.126 . . . . 0.0 114.148 171.713 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.95 1.55 55.28 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.239 2.216 . . . . 0.0 110.541 173.878 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.5 t -117.44 -12.27 10.44 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 127.616 2.366 . . . . 0.0 108.785 177.264 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.4 m -86.02 -4.75 59.24 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 125.934 1.694 . . . . 0.0 111.831 174.784 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -56.79 1.19 Allowed Pre-proline 0 C--N 1.359 1.016 0 C-N-CA 127.382 2.273 . . . . 0.0 112.634 167.797 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.86 -41.62 2.77 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 124.88 3.72 . . . . 0.0 113.587 176.981 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.6 m -70.71 -29.66 66.0 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.757 2.423 . . . . 0.0 114.593 -178.059 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -88.12 -6.64 57.79 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.623 1.169 . . . . 0.0 113.332 171.591 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -88.68 -21.11 24.08 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 125.723 1.609 . . . . 0.0 111.068 166.347 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.3 mt -92.39 -65.65 0.99 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 127.525 2.33 . . . . 0.0 111.26 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -97.69 -5.62 34.83 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.964 2.506 . . . . 0.0 112.26 -167.611 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.26 -79.33 0.52 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.027 1.298 . . . . 0.0 113.891 164.331 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 t -152.93 -7.53 0.18 Allowed 'General case' 0 C--N 1.353 0.75 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 -175.345 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.2 68.02 0.71 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.014 2.126 . . . . 0.0 105.528 174.769 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.1 126.62 47.41 Favored 'General case' 0 C--N 1.359 1.016 0 C-N-CA 125.806 1.642 . . . . 0.0 106.87 -176.599 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.24 85.37 0.56 Allowed Glycine 0 C--N 1.361 1.969 0 N-CA-C 107.265 -2.334 . . . . 0.0 107.265 170.411 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.9 113.02 24.95 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 125.253 1.421 . . . . 0.0 109.539 -171.963 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.08 143.15 49.69 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 -171.996 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -143.7 115.63 8.31 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -177.028 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -121.0 127.41 51.74 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 -176.164 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 79.72 -85.17 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.544 2.337 . . . . 0.0 110.571 175.386 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.44 51.91 0.21 Allowed Glycine 0 N--CA 1.434 -1.464 0 N-CA-C 106.635 -2.586 . . . . 0.0 106.635 169.717 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -151.61 148.83 28.44 Favored 'General case' 0 C--N 1.369 1.426 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.009 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -105.1 154.05 20.68 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 128.022 2.529 . . . . 0.0 109.963 -163.44 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -138.21 137.06 37.2 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 57.7 m -120.65 124.42 45.18 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 124.355 1.062 . . . . 0.0 108.179 178.353 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 . . . . . 0 N--CA 1.436 -1.15 0 N-CA-C 105.702 -1.962 . . . . 0.0 105.702 -179.329 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.9 mt . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 104.199 -2.519 . . . . 0.0 104.199 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.3 pt -101.12 179.52 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.335 0 C-N-CA 125.419 1.488 . . . . 0.0 110.236 -178.757 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -119.81 73.89 0.99 Allowed 'General case' 0 C--N 1.361 1.088 0 C-N-CA 125.412 1.485 . . . . 0.0 108.546 -172.379 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -130.57 126.39 60.59 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 N-CA-C 105.521 -2.029 . . . . 0.0 105.521 175.289 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -83.58 138.18 33.5 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 127.131 2.172 . . . . 0.0 109.611 179.847 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -143.26 -177.75 5.52 Favored 'General case' 0 C--N 1.359 1.006 0 CA-C-O 121.735 0.779 . . . . 0.0 109.844 -165.957 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.9 t -149.08 18.73 0.97 Allowed 'General case' 0 C--N 1.356 0.876 0 C-N-CA 126.06 1.744 . . . . 0.0 106.495 168.566 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 51.9 p -173.67 155.52 2.57 Favored Pre-proline 0 C--N 1.364 1.236 0 C-N-CA 124.673 1.189 . . . . 0.0 108.292 -171.933 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -69.68 -18.59 37.29 Favored 'Trans proline' 0 C--N 1.362 1.24 1 C-N-CA 125.41 4.073 . . . . 0.0 115.025 163.767 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -79.26 -11.22 59.95 Favored 'General case' 0 C--N 1.369 1.431 0 C-N-CA 126.999 2.12 . . . . 0.0 114.768 173.416 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -94.02 -4.79 48.9 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 127.902 2.481 . . . . 0.0 109.974 171.791 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.3 t -111.69 -14.45 13.61 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.468 2.307 . . . . 0.0 108.65 179.605 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -84.79 -1.19 56.04 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 126.655 1.982 . . . . 0.0 110.753 173.038 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -81.77 -57.47 0.52 Allowed Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 129.056 2.942 . . . . 0.0 110.928 172.17 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.33 -45.37 1.85 Allowed 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 124.876 3.717 . . . . 0.0 113.68 172.011 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.88 -29.42 67.71 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 127.416 2.286 . . . . 0.0 115.081 -175.158 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -88.04 -10.83 49.05 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 124.436 1.094 . . . . 0.0 113.429 172.641 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -85.98 -21.22 27.96 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 125.858 1.663 . . . . 0.0 112.086 166.375 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 mt -94.97 -69.05 0.77 Allowed 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.307 2.243 . . . . 0.0 110.942 -178.882 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -91.4 -27.83 18.07 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 128.035 2.534 . . . . 0.0 111.856 -167.97 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.75 -171.02 15.83 Favored Glycine 0 C--N 1.362 1.997 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.417 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.1 m -71.8 -4.88 30.32 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 128.003 2.521 . . . . 0.0 115.571 -174.897 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.3 t -108.65 64.08 0.61 Allowed 'General case' 0 C--N 1.363 1.193 0 C-N-CA 127.059 2.144 . . . . 0.0 106.411 168.359 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.62 143.35 43.95 Favored 'General case' 0 C--N 1.364 1.205 0 C-N-CA 126.399 1.879 . . . . 0.0 106.924 176.557 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.71 85.49 0.52 Allowed Glycine 0 C--N 1.361 1.927 0 N-CA-C 107.559 -2.216 . . . . 0.0 107.559 171.839 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.55 111.07 23.06 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 125.246 1.418 . . . . 0.0 109.037 -173.368 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -123.14 141.92 51.45 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 104.181 -2.525 . . . . 0.0 104.181 -171.111 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.82 109.25 6.19 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 -175.662 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -110.15 123.54 49.93 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 127.071 2.148 . . . . 0.0 106.122 -176.862 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.7 m120 78.54 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.554 2.342 . . . . 0.0 111.05 177.076 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.03 49.77 0.25 Allowed Glycine 0 N--CA 1.435 -1.407 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 170.352 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -150.52 147.99 28.16 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.308 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.94 151.74 23.53 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 127.842 2.457 . . . . 0.0 110.506 -161.97 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -134.34 139.43 45.64 Favored 'General case' 0 C--N 1.361 1.083 0 C-N-CA 126.726 2.01 . . . . 0.0 106.241 177.788 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.8 m -121.78 125.77 47.3 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 124.375 1.07 . . . . 0.0 108.576 176.977 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.435 -1.224 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.282 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.444 -0.743 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -99.87 -179.99 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 125.945 1.698 . . . . 0.0 110.38 -176.071 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -123.36 70.9 1.05 Allowed 'General case' 0 C--N 1.363 1.165 0 C-N-CA 125.021 1.328 . . . . 0.0 108.422 -173.17 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.437 HG11 ' HG3' ' A' ' 16' ' ' PRO . 11.7 t -128.63 132.71 67.57 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.154 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 173.682 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -84.66 140.99 30.93 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 125.869 1.668 . . . . 0.0 109.425 -174.999 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.5 p -147.07 160.76 42.02 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 121.656 0.741 . . . . 0.0 109.289 -169.379 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.3 t -133.13 -0.29 3.36 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 126.589 1.956 . . . . 0.0 108.171 169.994 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -152.55 157.36 33.59 Favored Pre-proline 0 C--N 1.364 1.205 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -176.087 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -71.99 -16.16 29.1 Favored 'Trans proline' 0 C--N 1.359 1.095 0 C-N-CA 124.418 3.412 . . . . 0.0 114.702 169.446 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -83.0 -1.71 53.35 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 126.595 1.958 . . . . 0.0 114.579 170.788 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -99.71 -0.77 39.42 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.773 2.429 . . . . 0.0 109.627 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.9 t -124.34 -14.71 6.89 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.89 2.076 . . . . 0.0 108.439 -173.079 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 78.4 p -87.92 3.13 49.71 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 125.44 1.496 . . . . 0.0 110.927 173.278 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -77.49 -59.2 0.86 Allowed Pre-proline 0 C--N 1.359 1.001 0 C-N-CA 129.757 3.223 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.437 ' HG3' HG11 ' A' ' 5' ' ' VAL . 74.2 Cg_endo -71.23 -38.42 4.85 Favored 'Trans proline' 0 C--N 1.364 1.357 0 C-N-CA 125.121 3.881 . . . . 0.0 113.878 174.156 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -71.68 -29.07 64.19 Favored 'General case' 0 C--N 1.366 1.326 0 C-N-CA 127.647 2.379 . . . . 0.0 114.46 -176.938 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -88.04 -9.0 54.77 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 125.148 1.379 . . . . 0.0 113.135 170.339 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -86.51 -20.53 27.9 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.632 1.573 . . . . 0.0 111.489 166.498 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.4 mt -92.78 -66.63 0.91 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.704 2.402 . . . . 0.0 110.962 177.962 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -95.84 -8.91 32.87 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.972 2.509 . . . . 0.0 112.175 -167.383 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.99 -79.83 0.54 Allowed Glycine 0 C--N 1.364 2.087 0 C-N-CA 125.289 1.423 . . . . 0.0 113.46 165.125 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.1 -6.29 0.44 Allowed 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.064 1.746 . . . . 0.0 106.929 -175.568 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 t -107.02 63.81 0.63 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 126.948 2.099 . . . . 0.0 106.212 177.552 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.73 140.23 52.55 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 125.973 1.709 . . . . 0.0 106.732 -176.875 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.79 -76.07 1.17 Allowed Glycine 0 C--N 1.361 1.962 0 C-N-CA 126.316 1.913 . . . . 0.0 110.943 172.373 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 84.97 98.9 0.04 OUTLIER 'General case' 0 C--N 1.367 1.336 0 C-N-CA 126.823 2.049 . . . . 0.0 110.984 169.024 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -125.44 141.37 52.09 Favored 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -171.552 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.4 t -116.24 124.8 51.12 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -176.171 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.2 mtp -109.34 72.17 0.8 Allowed 'General case' 0 C--N 1.36 1.058 0 N-CA-C 104.43 -2.433 . . . . 0.0 104.43 170.302 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -5.39 72.33 0.0 OUTLIER 'General case' 0 C--N 1.377 1.782 1 C-N-CA 134.63 5.172 . . . . 0.0 118.749 -171.8 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.76 -38.05 0.61 Allowed Glycine 0 C--N 1.354 1.536 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -166.185 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -154.05 157.68 39.38 Favored 'General case' 0 C--N 1.37 1.472 0 CA-C-N 119.45 1.625 . . . . 0.0 108.419 -175.833 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.26 154.62 20.98 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 128.66 2.784 . . . . 0.0 109.56 -166.156 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -129.82 147.49 51.6 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.733 2.013 . . . . 0.0 106.444 173.902 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.5 m -123.14 122.34 38.21 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 175.207 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 . . . . . 0 N--CA 1.44 -0.934 0 C-N-CA 126.541 1.936 . . . . 0.0 106.141 177.383 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 53.2 mt . . . . . 0 N--CA 1.445 -0.722 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.4 pt -106.06 -172.63 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.276 0 C-N-CA 125.129 1.372 . . . . 0.0 109.25 178.873 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -135.04 77.49 1.68 Allowed 'General case' 0 C--N 1.361 1.093 0 C-N-CA 124.325 1.05 . . . . 0.0 108.207 -177.23 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.4 t -121.06 122.52 67.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 172.205 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -80.9 133.98 35.65 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 126.757 2.023 . . . . 0.0 110.185 -172.733 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.16 -176.64 5.18 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 121.399 0.618 . . . . 0.0 110.252 -162.634 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -155.0 26.25 0.43 Allowed 'General case' 0 C--N 1.358 0.971 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 165.428 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.7 p -173.63 149.87 1.67 Allowed Pre-proline 0 C--N 1.364 1.23 0 C-N-CA 124.498 1.119 . . . . 0.0 108.369 -170.751 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -68.69 -16.62 42.3 Favored 'Trans proline' 0 C--N 1.362 1.245 1 C-N-CA 125.505 4.137 . . . . 0.0 115.29 165.479 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.01 7.98 28.7 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 126.128 1.771 . . . . 0.0 113.824 171.006 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -113.06 27.75 9.36 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.09 2.156 . . . . 0.0 107.127 166.417 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.6 t -148.12 -19.63 0.34 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.688 1.595 . . . . 0.0 110.189 -175.111 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -85.99 0.85 52.25 Favored 'General case' 0 C--N 1.369 1.424 0 CA-C-N 121.527 1.967 . . . . 0.0 111.476 175.968 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -81.31 -56.49 0.6 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.124 2.97 . . . . 0.0 110.807 170.438 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.1 -42.13 4.4 Favored 'Trans proline' 0 C--N 1.368 1.596 0 C-N-CA 124.964 3.776 . . . . 0.0 113.725 173.08 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.0 m -68.08 -31.61 71.35 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.81 2.444 . . . . 0.0 115.188 -177.873 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -88.06 -8.03 56.13 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 124.986 1.314 . . . . 0.0 112.92 172.928 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -87.84 -20.48 25.99 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 125.679 1.592 . . . . 0.0 111.374 166.508 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -92.85 -66.48 0.92 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.54 2.336 . . . . 0.0 111.116 178.706 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.15 -10.26 28.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 127.908 2.483 . . . . 0.0 111.999 -168.197 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.94 0.46 Allowed Glycine 0 C--N 1.364 2.086 0 C-N-CA 125.011 1.291 . . . . 0.0 113.672 164.685 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.52 -10.63 0.47 Allowed 'General case' 0 C--N 1.355 0.806 0 C-N-CA 125.851 1.661 . . . . 0.0 107.266 -174.14 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.07 69.49 0.76 Allowed 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.88 2.072 . . . . 0.0 105.681 176.509 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.89 125.44 41.6 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 125.695 1.598 . . . . 0.0 106.826 -174.768 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.64 87.42 0.57 Allowed Glycine 0 C--N 1.362 2.0 0 N-CA-C 107.276 -2.33 . . . . 0.0 107.276 170.698 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.79 113.54 25.84 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.238 1.415 . . . . 0.0 109.667 -172.236 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -124.43 146.39 48.94 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 103.963 -2.606 . . . . 0.0 103.963 -172.577 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.45 116.1 7.19 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 -175.912 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 68.9 mtt -121.11 126.39 49.65 Favored 'General case' 0 C--N 1.361 1.074 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 -176.04 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.33 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.505 2.322 . . . . 0.0 110.906 173.946 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.88 50.65 0.25 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 107.388 -2.285 . . . . 0.0 107.388 171.105 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -151.99 150.61 30.19 Favored 'General case' 0 C--N 1.368 1.39 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.846 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.0 151.96 23.3 Favored 'General case' 0 C--N 1.36 1.029 0 C-N-CA 128.499 2.72 . . . . 0.0 109.644 -165.305 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -135.4 137.63 42.48 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 179.013 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.68 110.65 14.64 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 124.465 1.106 . . . . 0.0 108.437 -179.321 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.44 -0.929 0 C-N-CA 127.431 2.292 . . . . 0.0 107.189 179.713 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 56.0 mt . . . . . 0 CA--C 1.513 -0.474 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 pt -106.28 -173.21 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 126.229 1.811 . . . . 0.0 109.74 -175.478 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -130.96 79.95 1.92 Allowed 'General case' 0 C--N 1.362 1.112 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -175.971 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.8 127.07 63.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 173.615 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -80.83 131.8 35.42 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 126.133 1.773 . . . . 0.0 110.155 -176.515 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -141.28 171.08 14.56 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -166.316 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.77 22.37 0.69 Allowed 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 174.194 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 p -171.09 149.23 2.63 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -174.781 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -71.84 -15.37 29.8 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 124.22 3.28 . . . . 0.0 114.747 168.685 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -79.3 -11.75 59.94 Favored 'General case' 0 C--N 1.371 1.508 0 C-N-CA 127.231 2.212 . . . . 0.0 114.323 171.525 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -89.77 -5.17 57.22 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 127.335 2.254 . . . . 0.0 110.178 171.357 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.0 t -118.19 -11.78 10.07 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.162 2.185 . . . . 0.0 108.592 -176.685 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -88.0 1.26 54.58 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 126.497 1.919 . . . . 0.0 110.38 171.569 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -80.93 -58.03 0.54 Allowed Pre-proline 0 C--N 1.356 0.89 0 C-N-CA 129.121 2.969 . . . . 0.0 111.301 170.998 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -72.04 -39.44 3.15 Favored 'Trans proline' 0 C--N 1.364 1.377 0 C-N-CA 125.072 3.848 . . . . 0.0 113.582 173.883 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -73.16 -22.69 60.45 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 127.185 2.194 . . . . 0.0 114.571 -179.427 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -88.14 -9.73 52.26 Favored 'General case' 0 C--N 1.374 1.633 0 CA-C-N 120.455 1.48 . . . . 0.0 114.068 166.141 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.39 -19.36 28.21 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.663 1.585 . . . . 0.0 111.334 168.337 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.6 mt -98.69 -71.33 0.69 Allowed 'General case' 0 C--N 1.365 1.25 0 C-N-CA 127.539 2.336 . . . . 0.0 110.221 178.27 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -106.42 42.43 1.28 Allowed 'General case' 0 C--N 1.361 1.072 0 C-N-CA 128.655 2.782 . . . . 0.0 109.955 -169.781 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -79.47 89.04 1.22 Allowed Glycine 0 C--N 1.365 2.171 0 C-N-CA 126.488 1.994 . . . . 0.0 115.939 -169.078 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.0 t -168.06 -61.37 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 103.275 -2.861 . . . . 0.0 103.275 174.308 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -137.28 70.33 1.4 Allowed 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 179.352 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.61 138.93 31.83 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.532 1.533 . . . . 0.0 111.606 177.261 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -106.31 152.66 17.04 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 105.893 -2.883 . . . . 0.0 105.893 165.568 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.31 121.96 4.86 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -171.407 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -124.73 141.27 52.22 Favored 'General case' 0 C--N 1.361 1.071 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 -179.128 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.2 t -117.56 103.37 10.0 Favored 'General case' 0 C--N 1.352 0.71 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.913 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.6 mmt -108.84 121.61 45.46 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 178.857 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.466 3.6 p-10 68.66 -78.06 0.05 OUTLIER 'General case' 0 C--N 1.38 1.905 0 C-N-CA 128.718 2.807 . . . . 0.0 113.95 -177.842 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.28 54.46 0.14 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 105.407 -3.077 . . . . 0.0 105.407 170.664 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -153.92 152.12 30.24 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.2 t -104.99 141.32 36.78 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.637 1.975 . . . . 0.0 109.435 -164.016 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -119.86 147.04 45.17 Favored 'General case' 0 CA--C 1.499 -0.989 0 C-N-CA 126.571 1.948 . . . . 0.0 106.27 172.486 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -116.33 143.47 45.5 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 172.01 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 N--CA 1.434 -1.233 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 -174.617 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 26.3 mt . . . . . 0 N--CA 1.444 -0.745 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.2 pt -102.41 -170.53 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 125.966 1.707 . . . . 0.0 109.429 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.98 76.6 1.63 Allowed 'General case' 0 C--N 1.36 1.056 0 C-N-CA 124.333 1.053 . . . . 0.0 108.378 -175.48 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.435 HG11 ' HG3' ' A' ' 16' ' ' PRO . 7.0 t -129.59 133.26 65.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.132 0 N-CA-C 103.938 -2.615 . . . . 0.0 103.938 173.301 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.75 134.75 35.48 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 125.847 1.659 . . . . 0.0 110.447 -177.041 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.7 p -140.25 -178.98 5.73 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 -169.227 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 55.4 m -154.93 -53.36 0.09 Allowed 'General case' 0 N--CA 1.432 -1.366 0 N-CA-C 100.969 -3.715 . . . . 0.0 100.969 -163.057 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.6 p -111.25 161.91 23.17 Favored Pre-proline 0 C--N 1.362 1.112 0 C-N-CA 127.647 2.379 . . . . 0.0 108.661 177.893 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -71.88 -16.2 29.45 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.468 3.446 . . . . 0.0 114.535 165.803 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -74.73 -17.05 60.71 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 127.759 2.424 . . . . 0.0 114.146 168.941 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -88.85 -2.93 58.83 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 127.649 2.38 . . . . 0.0 110.485 174.864 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.5 t -118.93 -12.45 9.56 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 128.068 2.547 . . . . 0.0 108.207 179.697 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.3 m -86.2 -0.78 56.52 Favored 'General case' 0 C--N 1.371 1.536 0 C-N-CA 126.317 1.847 . . . . 0.0 111.06 172.867 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -77.87 -58.06 0.92 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.193 2.997 . . . . 0.0 111.795 170.817 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.435 ' HG3' HG11 ' A' ' 5' ' ' VAL . 74.5 Cg_endo -72.08 -37.7 4.53 Favored 'Trans proline' 0 C--N 1.363 1.309 0 C-N-CA 125.111 3.874 . . . . 0.0 113.886 174.496 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.54 -27.6 64.28 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.309 2.244 . . . . 0.0 114.298 -179.531 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -88.04 -8.94 54.85 Favored 'General case' 0 C--N 1.371 1.534 0 C-N-CA 125.341 1.456 . . . . 0.0 113.141 170.236 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -87.44 -19.58 27.84 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.791 1.636 . . . . 0.0 111.357 167.182 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 mt -95.11 -67.35 0.86 Allowed 'General case' 0 C--N 1.365 1.252 0 C-N-CA 127.696 2.398 . . . . 0.0 110.94 178.694 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -93.37 -11.21 32.84 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 128.198 2.599 . . . . 0.0 112.032 -168.542 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.19 -81.09 0.44 Allowed Glycine 0 C--N 1.364 2.131 0 C-N-CA 125.067 1.318 . . . . 0.0 113.573 164.224 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.6 m -148.46 -8.59 0.38 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 125.952 1.701 . . . . 0.0 106.927 -173.81 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 t -108.25 63.59 0.61 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.969 2.107 . . . . 0.0 105.386 175.391 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.16 130.73 53.15 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 125.959 1.703 . . . . 0.0 107.878 -172.916 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.74 153.16 18.76 Favored Glycine 0 C--N 1.359 1.829 0 N-CA-C 105.837 -2.905 . . . . 0.0 105.837 161.175 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.21 120.39 5.36 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 105.024 -2.213 . . . . 0.0 105.024 -171.457 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -124.7 137.65 54.34 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 -177.181 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -117.94 106.81 13.34 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.443 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.7 mtp -111.34 121.97 46.62 Favored 'General case' 0 C--N 1.361 1.089 0 N-CA-C 105.312 -2.107 . . . . 0.0 105.312 176.69 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.467 12.0 p30 69.99 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.382 1.981 0 C-N-CA 128.627 2.771 . . . . 0.0 113.704 -179.617 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 53.5 0.17 Allowed Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 105.591 -3.003 . . . . 0.0 105.591 170.686 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -152.47 150.77 29.98 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 105.369 -2.085 . . . . 0.0 105.369 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.99 144.58 31.61 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 126.746 2.018 . . . . 0.0 109.788 -162.73 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -122.63 145.45 48.35 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 127.145 2.178 . . . . 0.0 106.119 173.544 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 85.8 m -123.84 127.64 48.34 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 122.25 1.024 . . . . 0.0 109.411 177.202 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 N--CA 1.435 -1.217 0 C-N-CA 127.762 2.425 . . . . 0.0 105.383 -178.962 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 mt . . . . . 0 N--CA 1.443 -0.779 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.0 pt -104.47 -171.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 126.009 1.723 . . . . 0.0 108.936 177.686 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -132.5 84.0 2.12 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.922 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.5 t -132.15 125.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 N-CA-C 104.111 -2.552 . . . . 0.0 104.111 173.519 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -76.65 137.53 39.5 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.061 2.144 . . . . 0.0 111.007 -179.238 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.7 p -145.39 178.6 7.98 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.83 0.824 . . . . 0.0 110.492 -165.506 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -149.64 19.5 0.92 Allowed 'General case' 0 C--N 1.355 0.846 0 C-N-CA 126.2 1.8 . . . . 0.0 106.65 169.526 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.1 p -172.92 155.7 3.01 Favored Pre-proline 0 C--N 1.363 1.182 0 C-N-CA 124.853 1.261 . . . . 0.0 107.975 -172.935 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -70.56 -18.44 33.22 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 125.143 3.895 . . . . 0.0 115.181 164.273 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.6 -16.13 59.66 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 127.013 2.125 . . . . 0.0 114.374 172.474 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.5 tp60 -89.53 -4.01 58.09 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.614 2.366 . . . . 0.0 110.186 172.996 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -114.09 -13.1 12.47 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 127.737 2.415 . . . . 0.0 108.982 178.762 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.2 m -85.73 -4.12 59.08 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.173 1.789 . . . . 0.0 111.026 174.997 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -78.02 -57.29 0.96 Allowed Pre-proline 0 N--CA 1.441 -0.892 0 C-N-CA 129.393 3.077 . . . . 0.0 112.092 170.795 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.59 -41.31 3.31 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 125.248 3.965 . . . . 0.0 113.943 173.711 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.16 -27.83 64.84 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 127.313 2.245 . . . . 0.0 114.838 -177.86 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -87.99 -10.5 50.2 Favored 'General case' 0 C--N 1.371 1.519 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 170.781 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.96 -19.75 29.97 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 125.639 1.576 . . . . 0.0 111.539 167.365 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.2 mt -93.7 -66.65 0.91 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 127.645 2.378 . . . . 0.0 111.013 177.758 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -96.91 -8.21 31.37 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.643 2.377 . . . . 0.0 112.326 -167.126 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.84 -80.99 0.51 Allowed Glycine 0 C--N 1.364 2.11 0 C-N-CA 125.015 1.293 . . . . 0.0 113.529 165.308 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.66 -8.67 0.42 Allowed 'General case' 0 C--N 1.354 0.782 0 C-N-CA 125.927 1.691 . . . . 0.0 107.153 -174.81 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -107.13 68.0 0.71 Allowed 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.934 2.093 . . . . 0.0 105.683 176.479 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.27 125.82 42.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 C-N-CA 125.815 1.646 . . . . 0.0 107.078 -173.849 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.28 88.51 0.58 Allowed Glycine 0 C--N 1.359 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.0 107.463 172.025 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.39 116.38 28.92 Favored 'General case' 0 C--N 1.358 0.935 0 C-N-CA 125.043 1.337 . . . . 0.0 109.7 -174.144 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -123.17 141.43 51.98 Favored 'General case' 0 C--N 1.36 1.053 0 N-CA-C 102.317 -3.216 . . . . 0.0 102.317 -174.464 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.92 112.63 10.8 Favored 'General case' 0 CA--C 1.505 -0.787 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.456 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.9 mmt -110.52 119.62 39.76 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 126.806 2.042 . . . . 0.0 106.449 -174.515 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.5 m120 77.26 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.378 1.825 0 C-N-CA 127.452 2.301 . . . . 0.0 111.558 177.492 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -164.55 48.68 0.29 Allowed Glycine 0 C--N 1.352 1.462 0 N-CA-C 106.984 -2.446 . . . . 0.0 106.984 171.47 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -151.22 153.06 34.18 Favored 'General case' 0 C--N 1.366 1.308 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 173.387 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -105.03 152.55 22.6 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 127.458 2.303 . . . . 0.0 110.417 -161.592 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -133.92 141.43 47.33 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 127.411 2.285 . . . . 0.0 105.801 178.971 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.2 m -126.95 124.93 40.61 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.595 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 . . . . . 0 N--CA 1.435 -1.185 0 C-N-CA 126.879 2.072 . . . . 0.0 105.922 179.901 . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.5 mt . . . . . 0 N--CA 1.444 -0.734 0 N-CA-C 103.521 -2.77 . . . . 0.0 103.521 . . . . . . . . . 0 0 . 1 . 036 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.7 pt -104.53 -171.8 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.242 0 C-N-CA 125.497 1.519 . . . . 0.0 108.681 177.045 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -135.04 78.63 1.74 Allowed 'General case' 0 C--N 1.36 1.032 0 C-N-CA 123.995 0.918 . . . . 0.0 108.542 -175.774 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 t -126.6 126.38 68.78 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 N-CA-C 104.392 -2.448 . . . . 0.0 104.392 172.677 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -88.61 129.7 35.44 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 125.971 1.708 . . . . 0.0 109.132 -171.529 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.9 p -133.85 -174.59 3.57 Favored 'General case' 0 C--N 1.358 0.975 0 C-N-CA 123.797 0.839 . . . . 0.0 109.265 -162.373 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -151.8 22.6 0.69 Allowed 'General case' 0 C--N 1.358 0.949 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 166.609 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 p -175.5 153.39 1.46 Allowed Pre-proline 0 C--N 1.365 1.269 0 C-N-CA 124.59 1.156 . . . . 0.0 108.242 -169.115 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -69.4 -17.89 38.99 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 125.286 3.99 . . . . 0.0 115.113 163.425 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -82.14 -7.33 59.62 Favored 'General case' 0 C--N 1.368 1.41 0 C-N-CA 126.682 1.993 . . . . 0.0 114.658 173.59 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -100.51 6.03 44.21 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.941 2.096 . . . . 0.0 109.156 170.699 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.6 t -120.3 -14.76 8.72 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 127.603 2.361 . . . . 0.0 108.447 177.846 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -84.61 1.09 47.67 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 126.406 1.882 . . . . 0.0 110.876 173.365 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.77 -59.79 0.43 Allowed Pre-proline 0 N--CA 1.44 -0.972 0 C-N-CA 129.454 3.101 . . . . 0.0 110.91 171.682 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.55 -38.91 4.01 Favored 'Trans proline' 0 C--N 1.365 1.415 0 C-N-CA 125.066 3.844 . . . . 0.0 113.561 173.987 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -71.6 -27.68 63.29 Favored 'General case' 0 C--N 1.368 1.397 0 C-N-CA 127.3 2.24 . . . . 0.0 114.378 -178.531 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.17 -6.54 57.8 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.92 1.236 . . . . 0.0 113.936 169.202 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -88.94 -18.8 26.74 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 125.833 1.653 . . . . 0.0 111.403 166.187 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.1 mt -99.46 -73.64 0.62 Allowed 'General case' 0 C--N 1.364 1.211 0 C-N-CA 127.418 2.287 . . . . 0.0 109.859 179.559 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -103.58 45.61 0.95 Allowed 'General case' 0 C--N 1.36 1.048 0 C-N-CA 129.079 2.952 . . . . 0.0 109.565 -173.638 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.59 81.57 1.23 Allowed Glycine 0 C--N 1.364 2.105 0 C-N-CA 126.492 1.996 . . . . 0.0 116.763 -170.778 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p 175.62 -47.26 0.01 OUTLIER 'General case' 0 C--N 1.358 0.945 0 C-N-CA 127.701 2.4 . . . . 0.0 104.856 175.701 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 t -133.11 76.39 1.68 Allowed 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -177.577 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.57 119.36 39.19 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 125.273 1.429 . . . . 0.0 108.624 178.336 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.37 85.71 0.62 Allowed Glycine 0 C--N 1.368 2.313 0 N-CA-C 108.34 -1.904 . . . . 0.0 108.34 170.515 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.86 115.79 28.2 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.332 1.453 . . . . 0.0 109.956 -172.817 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.3 mttm -125.43 143.84 50.8 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 104.564 -2.384 . . . . 0.0 104.564 -172.401 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -140.04 112.23 7.68 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -177.038 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.0 mmm -112.86 124.91 53.69 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.983 2.113 . . . . 0.0 105.814 -177.811 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.17 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.38 1.928 0 C-N-CA 127.55 2.34 . . . . 0.0 110.701 176.4 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.74 50.02 0.24 Allowed Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 169.795 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.39 148.11 29.08 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 175.59 . . . . . . . . 2 2 . 1 . 036 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.6 t -105.02 151.34 24.07 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.39 2.276 . . . . 0.0 110.124 -161.944 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -134.0 135.1 43.19 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.489 1.915 . . . . 0.0 106.16 178.551 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -120.36 119.74 33.97 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.441 1.096 . . . . 0.0 108.538 178.53 . . . . . . . . 1 1 . 1 . 036 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 . . . . . 0 N--CA 1.435 -1.188 0 C-N-CA 126.53 1.932 . . . . 0.0 106.219 -178.597 . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.1 mt . . . . . 0 N--CA 1.445 -0.713 0 N-CA-C 102.492 -3.151 . . . . 0.0 102.492 . . . . . . . . . 0 0 . 1 . 037 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.6 pt -101.45 -179.29 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 124.721 1.208 . . . . 0.0 110.744 -175.972 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -121.77 78.45 1.46 Allowed 'General case' 0 C--N 1.362 1.15 0 C-N-CA 125.691 1.596 . . . . 0.0 107.27 -176.206 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -132.12 124.59 53.0 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 N-CA-C 103.674 -2.713 . . . . 0.0 103.674 170.888 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -87.96 140.94 28.99 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 126.18 1.792 . . . . 0.0 108.372 -175.739 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.01 -176.21 5.06 Favored 'General case' 0 C--N 1.357 0.919 0 CA-C-O 121.429 0.633 . . . . 0.0 110.059 -162.574 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.0 t -154.33 24.93 0.47 Allowed 'General case' 0 C--N 1.359 1.005 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 164.534 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.0 p -173.53 150.54 1.8 Allowed Pre-proline 0 C--N 1.365 1.271 0 C-N-CA 124.399 1.08 . . . . 0.0 108.524 -170.08 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.41 ' HA ' ' HB2' ' A' ' 29' ' ' CYS . 51.8 Cg_exo -69.01 -15.22 39.73 Favored 'Trans proline' 0 C--N 1.362 1.277 1 C-N-CA 125.559 4.173 . . . . 0.0 115.119 164.96 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -88.09 5.18 42.38 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.253 1.821 . . . . 0.0 113.819 171.596 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -113.06 28.2 8.99 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.139 2.176 . . . . 0.0 106.671 168.245 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.0 t -147.46 -21.43 0.38 Allowed 'General case' 0 C--N 1.356 0.863 0 C-N-CA 125.693 1.597 . . . . 0.0 109.95 -175.864 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.7 p -86.27 0.27 54.2 Favored 'General case' 0 C--N 1.372 1.55 0 CA-C-N 121.434 1.924 . . . . 0.0 111.308 175.81 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -79.63 -58.53 0.63 Allowed Pre-proline 0 C--N 1.357 0.922 0 C-N-CA 129.737 3.215 . . . . 0.0 111.472 170.109 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.18 -40.31 4.79 Favored 'Trans proline' 0 C--N 1.365 1.441 1 C-N-CA 125.312 4.008 . . . . 0.0 113.787 174.041 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -70.08 -30.71 68.01 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.751 2.421 . . . . 0.0 114.727 -177.901 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -88.0 -7.17 57.45 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 124.836 1.254 . . . . 0.0 113.2 171.646 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -86.98 -18.92 29.54 Favored 'General case' 0 C--N 1.36 1.022 0 C-N-CA 125.697 1.599 . . . . 0.0 111.322 165.512 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -94.22 -66.63 0.9 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.596 2.358 . . . . 0.0 111.278 178.495 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -94.62 -9.46 34.97 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.998 2.519 . . . . 0.0 112.199 -167.892 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -77.95 0.29 Allowed Glycine 0 C--N 1.364 2.138 0 C-N-CA 124.953 1.264 . . . . 0.0 113.318 165.641 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.418 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.6 t -153.56 -7.43 0.17 Allowed 'General case' 0 C--N 1.355 0.806 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 -175.082 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.418 ' H ' ' H ' ' A' ' 23' ' ' SER . 18.6 t -108.68 70.93 0.76 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 126.766 2.026 . . . . 0.0 105.596 175.354 . . . . . . . . 2 2 . 1 . 037 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.7 126.12 42.97 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.642 1.577 . . . . 0.0 107.002 -178.077 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.51 83.59 0.59 Allowed Glycine 0 C--N 1.362 1.981 0 N-CA-C 107.053 -2.419 . . . . 0.0 107.053 171.096 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.85 115.04 27.72 Favored 'General case' 0 C--N 1.359 1.0 0 C-N-CA 125.623 1.569 . . . . 0.0 109.748 -171.117 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -124.62 147.12 48.69 Favored 'General case' 0 CA--C 1.485 -1.534 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 -170.487 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.41 ' HB2' ' HA ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -146.3 131.49 18.41 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -177.619 . . . . . . . . 3 3 . 1 . 037 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -109.43 84.89 2.0 Allowed 'General case' 0 C--N 1.359 1.021 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 171.992 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.271 5.4 p30 1.32 64.93 0.0 OUTLIER 'General case' 0 C--N 1.382 2.005 1 C-N-CA 134.438 5.095 . . . . 0.0 119.273 179.345 . . . . . . . . 3 2 . 1 . 037 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.0 -47.11 0.27 Allowed Glycine 0 C--N 1.354 1.54 0 N-CA-C 108.927 -1.669 . . . . 0.0 108.927 -162.63 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -154.0 154.98 34.72 Favored 'General case' 0 C--N 1.37 1.475 0 CA-C-N 119.398 1.599 . . . . 0.0 109.353 -177.036 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.4 t -107.75 152.43 24.36 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 129.45 3.1 . . . . 0.0 110.196 -166.913 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -133.61 139.84 46.75 Favored 'General case' 0 C--N 1.363 1.165 0 C-N-CA 126.808 2.043 . . . . 0.0 106.425 177.554 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.4 m -123.18 112.92 18.26 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 124.704 1.202 . . . . 0.0 108.816 178.877 . . . . . . . . 1 1 . 1 . 037 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 . . . . . 0 N--CA 1.439 -0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 106.539 177.084 . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 mt . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 . . . . . . . . . 0 0 . 1 . 038 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt -99.28 -174.84 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.212 0 C-N-CA 126.076 1.75 . . . . 0.0 110.113 -176.76 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -128.25 82.91 2.11 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -174.167 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.3 t -134.63 126.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 104.273 -2.491 . . . . 0.0 104.273 172.856 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -80.28 138.75 36.81 Favored 'General case' 0 C--N 1.366 1.315 0 C-N-CA 127.036 2.134 . . . . 0.0 110.253 -178.928 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.7 p -145.1 171.18 14.87 Favored 'General case' 0 C--N 1.356 0.883 0 CA-C-O 121.782 0.801 . . . . 0.0 109.356 -166.888 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -119.85 -22.84 6.64 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 127.04 2.136 . . . . 0.0 108.156 161.184 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.5 p -135.9 162.44 56.8 Favored Pre-proline 0 C--N 1.366 1.288 0 C-N-CA 125.951 1.7 . . . . 0.0 110.046 -169.132 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -69.62 -17.07 38.42 Favored 'Trans proline' 0 C--N 1.361 1.213 1 C-N-CA 125.364 4.043 . . . . 0.0 115.113 163.397 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.32 -11.12 59.94 Favored 'General case' 0 C--N 1.369 1.441 0 C-N-CA 127.101 2.16 . . . . 0.0 114.187 171.0 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -98.23 7.31 46.43 Favored 'General case' 0 C--N 1.372 1.564 0 C-N-CA 127.36 2.264 . . . . 0.0 109.43 172.245 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -123.79 -13.18 7.48 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 127.662 2.385 . . . . 0.0 108.602 177.767 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -85.36 -1.11 56.65 Favored 'General case' 0 C--N 1.371 1.525 0 C-N-CA 126.26 1.824 . . . . 0.0 110.905 173.679 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -81.88 -57.23 0.52 Allowed Pre-proline 0 N--CA 1.44 -0.974 0 C-N-CA 129.31 3.044 . . . . 0.0 111.112 172.827 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.76 -42.41 3.43 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 124.958 3.772 . . . . 0.0 113.962 172.568 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -70.0 -29.45 66.53 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.345 2.258 . . . . 0.0 114.845 -176.661 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -88.04 -8.62 55.31 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.784 1.234 . . . . 0.0 113.303 171.356 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -84.79 -25.88 27.9 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 125.732 1.613 . . . . 0.0 111.182 165.777 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.8 mt -89.78 -63.42 1.29 Allowed 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.516 2.326 . . . . 0.0 111.761 179.934 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -98.53 -8.98 25.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.629 2.371 . . . . 0.0 111.964 -167.645 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -80.95 0.47 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.039 1.304 . . . . 0.0 113.651 164.956 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.3 m -147.51 -9.69 0.42 Allowed 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.858 1.663 . . . . 0.0 106.965 -175.058 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -106.19 69.92 0.82 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 126.946 2.098 . . . . 0.0 105.726 176.326 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 127.15 42.55 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -175.363 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 87.19 0.51 Allowed Glycine 0 C--N 1.36 1.868 0 N-CA-C 107.211 -2.356 . . . . 0.0 107.211 172.219 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.56 117.31 28.36 Favored 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.328 1.451 . . . . 0.0 109.935 -174.089 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -122.99 140.15 53.33 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 102.986 -2.968 . . . . 0.0 102.986 -175.575 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.25 107.53 6.83 Favored 'General case' 0 CA--C 1.501 -0.935 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 -178.115 . . . . . . . . 2 2 . 1 . 038 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 62.4 mtt -110.61 123.89 50.84 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 127.295 2.238 . . . . 0.0 106.042 -174.377 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 80.39 -86.29 0.02 OUTLIER 'General case' 0 C--N 1.38 1.919 0 C-N-CA 127.403 2.281 . . . . 0.0 109.908 177.854 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.77 49.51 0.24 Allowed Glycine 0 N--CA 1.435 -1.429 0 N-CA-C 106.444 -2.662 . . . . 0.0 106.444 170.03 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -151.37 150.58 30.64 Favored 'General case' 0 C--N 1.367 1.335 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 177.822 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.9 t -105.03 150.29 25.08 Favored 'General case' 0 C--N 1.362 1.127 0 C-N-CA 127.137 2.175 . . . . 0.0 110.819 -160.712 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -131.98 144.47 50.83 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 127.437 2.295 . . . . 0.0 105.948 178.092 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.6 m -127.8 127.53 43.68 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 108.168 177.859 . . . . . . . . 1 1 . 1 . 038 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.437 -1.11 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 178.926 . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.9 mt . . . . . 0 N--CA 1.443 -0.786 0 N-CA-C 103.465 -2.791 . . . . 0.0 103.465 . . . . . . . . . 0 0 . 1 . 039 nuclear build core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.0 pt -104.32 -176.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.261 0 C-N-CA 125.78 1.632 . . . . 0.0 108.906 178.738 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -134.97 104.01 5.8 Favored 'General case' 0 C--N 1.361 1.105 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -178.101 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.3 t -114.44 -50.06 5.14 Favored 'Isoleucine or valine' 0 C--N 1.364 1.228 0 C-N-CA 125.012 1.325 . . . . 0.0 110.851 -172.491 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 82.14 121.39 0.05 OUTLIER 'General case' 0 C--N 1.364 1.211 0 C-N-CA 131.638 3.975 . . . . 0.0 110.45 -167.192 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.8 p -148.0 -177.73 5.9 Favored 'General case' 0 C--N 1.356 0.877 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -166.227 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.1 t -152.71 24.23 0.59 Allowed 'General case' 0 C--N 1.358 0.96 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 167.008 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.2 p -173.04 150.41 1.95 Allowed Pre-proline 0 C--N 1.364 1.218 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 -171.086 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -69.77 -14.28 35.84 Favored 'Trans proline' 0 C--N 1.36 1.149 1 C-N-CA 125.428 4.086 . . . . 0.0 114.949 162.106 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.8 -15.26 59.79 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 127.674 2.389 . . . . 0.0 114.19 170.489 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -97.78 8.8 44.07 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.686 2.395 . . . . 0.0 109.222 173.149 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -124.51 -14.47 6.85 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.827 2.051 . . . . 0.0 109.446 -179.827 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.9 m -86.51 -6.87 58.79 Favored 'General case' 0 C--N 1.367 1.351 0 C-N-CA 125.712 1.605 . . . . 0.0 111.237 175.72 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -82.52 -54.45 0.6 Allowed Pre-proline 0 C--N 1.356 0.866 0 C-N-CA 129.3 3.04 . . . . 0.0 111.956 171.37 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.38 -46.0 4.61 Favored 'Trans proline' 0 C--N 1.367 1.504 1 C-N-CA 125.974 4.45 . . . . 0.0 113.802 172.92 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.05 -30.87 69.3 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.589 2.356 . . . . 0.0 115.353 -178.152 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -88.01 -6.06 58.18 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 124.662 1.185 . . . . 0.0 113.444 172.979 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -88.59 -21.43 24.04 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 126.003 1.721 . . . . 0.0 111.081 165.889 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.7 mt -92.64 -66.65 0.91 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.396 2.278 . . . . 0.0 111.196 178.51 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.1 -7.29 33.04 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 128.283 2.633 . . . . 0.0 112.34 -167.565 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.56 -79.9 0.57 Allowed Glycine 0 C--N 1.364 2.123 0 C-N-CA 125.05 1.31 . . . . 0.0 113.72 164.83 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.51 -9.61 0.42 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.854 1.661 . . . . 0.0 107.198 -175.684 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 t -105.79 69.0 0.8 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 126.875 2.07 . . . . 0.0 106.031 177.37 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.49 124.83 39.28 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.736 1.614 . . . . 0.0 106.985 -174.155 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.24 89.91 0.78 Allowed Glycine 0 C--N 1.363 2.043 0 N-CA-C 107.091 -2.403 . . . . 0.0 107.091 170.065 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.42 111.88 23.82 Favored 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.303 1.441 . . . . 0.0 109.894 -169.719 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -125.54 140.26 52.91 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 104.102 -2.555 . . . . 0.0 104.102 -173.382 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.16 110.28 9.47 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 -174.78 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.7 mmm -122.34 129.57 52.28 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.592 1.957 . . . . 0.0 105.747 -172.539 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m120 76.15 -7.25 1.85 Allowed 'General case' 0 C--N 1.382 1.98 0 C-N-CA 126.793 2.037 . . . . 0.0 115.342 168.972 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.27 42.0 3.58 Favored Glycine 0 C--N 1.362 2.017 0 C-N-CA 126.63 2.062 . . . . 0.0 111.082 -174.114 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.03 156.97 38.33 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 102.968 -2.975 . . . . 0.0 102.968 169.862 . . . . . . . . 2 2 . 1 . 039 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 39.0 t -105.05 155.58 18.85 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 126.305 1.842 . . . . 0.0 109.896 -166.077 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -132.56 134.51 45.04 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 176.95 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.3 m -123.02 117.34 25.25 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 . . . . . 0 N--CA 1.437 -1.084 0 C-N-CA 126.851 2.06 . . . . 0.0 106.21 -179.524 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 38.4 p . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt -127.27 130.56 70.91 Favored 'Isoleucine or valine' 0 C--N 1.363 1.157 0 N-CA-C 104.164 -2.532 . . . . 0.0 104.164 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -108.18 -174.42 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.175 1.39 . . . . 0.0 109.287 177.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -130.98 80.39 1.94 Allowed 'General case' 0 C--N 1.362 1.139 0 C-N-CA 124.984 1.314 . . . . 0.0 107.634 -176.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.411 HG11 ' HG3' ' A' ' 16' ' ' PRO . 6.9 t -131.16 129.75 63.09 Favored 'Isoleucine or valine' 0 C--N 1.361 1.093 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -79.88 135.72 36.5 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.017 1.727 . . . . 0.0 110.56 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.66 171.95 13.48 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -169.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.39 22.88 0.54 Allowed 'General case' 0 C--N 1.355 0.821 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.3 p -171.96 149.72 2.34 Favored Pre-proline 0 C--N 1.36 1.059 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -71.66 -16.88 30.04 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.197 3.264 . . . . 0.0 114.549 168.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -79.09 -10.75 59.91 Favored 'General case' 0 C--N 1.369 1.45 0 C-N-CA 127.516 2.326 . . . . 0.0 114.799 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -89.94 -11.53 41.46 Favored 'General case' 0 C--N 1.37 1.5 0 C-N-CA 127.735 2.414 . . . . 0.0 110.275 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.5 t -109.72 -13.63 14.46 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.289 2.236 . . . . 0.0 108.76 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.5 m -83.69 -1.39 53.94 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.182 1.793 . . . . 0.0 111.445 174.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -80.35 -59.06 0.54 Allowed Pre-proline 0 N--CA 1.44 -0.938 0 C-N-CA 129.545 3.138 . . . . 0.0 111.471 172.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.411 ' HG3' HG11 ' A' ' 5' ' ' VAL . 68.4 Cg_endo -70.61 -40.35 4.08 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 125.097 3.865 . . . . 0.0 113.703 174.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.5 m -69.52 -31.45 69.69 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 127.6 2.36 . . . . 0.0 114.696 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -88.14 -7.17 57.31 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 124.837 1.255 . . . . 0.0 113.296 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.1 -19.21 28.87 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.746 1.618 . . . . 0.0 111.468 165.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 mt -93.9 -67.39 0.86 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 127.608 2.363 . . . . 0.0 111.14 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -94.72 -9.54 34.42 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.09 2.556 . . . . 0.0 112.4 -167.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -78.06 0.29 Allowed Glycine 0 C--N 1.365 2.153 0 C-N-CA 124.97 1.271 . . . . 0.0 113.161 166.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -152.99 -8.52 0.17 Allowed 'General case' 0 C--N 1.355 0.836 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -105.42 71.12 0.91 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 126.992 2.117 . . . . 0.0 105.748 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.38 123.24 31.21 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 125.684 1.594 . . . . 0.0 106.776 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.19 85.19 0.73 Allowed Glycine 0 C--N 1.364 2.098 0 N-CA-C 107.488 -2.245 . . . . 0.0 107.488 171.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.46 114.39 26.4 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.602 1.561 . . . . 0.0 109.949 -169.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.3 mttp -122.95 142.02 51.28 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -171.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.8 t -122.49 112.52 18.14 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.7 mmm -121.7 123.53 42.1 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.747 -2.316 . . . . 0.0 104.747 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.72 -84.61 0.02 OUTLIER 'General case' 0 C--N 1.381 1.964 0 C-N-CA 127.623 2.369 . . . . 0.0 111.099 176.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.83 54.47 0.19 Allowed Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 105.58 -3.008 . . . . 0.0 105.58 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mttm -154.04 152.19 30.21 Favored 'General case' 0 C--N 1.362 1.149 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.4 t -105.78 144.07 33.04 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 127.518 2.327 . . . . 0.0 109.465 -164.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -124.33 139.53 53.82 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.35 1.86 . . . . 0.0 106.671 174.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 67.7 m -125.2 111.45 15.28 Favored 'General case' 0 CA--C 1.5 -0.967 0 C-N-CA 124.09 0.956 . . . . 0.0 108.498 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -111.61 -148.23 0.43 Allowed 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 127.001 2.12 . . . . 0.0 106.647 178.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -134.62 156.12 49.28 Favored 'General case' 0 C--N 1.358 0.976 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 176.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -90.01 125.27 35.34 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 171.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.329 0 O-C-N 123.399 0.437 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 44.4 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.568 -0.16 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 39.7 mt -129.61 124.99 60.52 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.0 pt -112.88 -171.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 125.578 1.551 . . . . 0.0 108.208 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -131.9 80.29 1.91 Allowed 'General case' 0 C--N 1.363 1.156 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.413 HG11 ' HG3' ' A' ' 16' ' ' PRO . 11.3 t -130.62 129.52 64.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.082 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 171.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.64 134.26 35.16 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 125.734 1.614 . . . . 0.0 110.448 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.5 p -142.51 170.44 15.7 Favored 'General case' 0 C--N 1.36 1.029 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -167.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.03 22.37 0.76 Allowed 'General case' 0 C--N 1.355 0.843 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -170.42 150.16 3.31 Favored Pre-proline 0 C--N 1.362 1.121 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -71.46 -15.79 30.92 Favored 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 124.196 3.264 . . . . 0.0 114.891 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -82.66 -2.35 53.74 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.947 2.099 . . . . 0.0 114.315 171.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -101.87 7.53 41.56 Favored 'General case' 0 C--N 1.372 1.568 0 C-N-CA 127.195 2.198 . . . . 0.0 109.233 170.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.2 t -128.25 -14.3 4.86 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 127.229 2.212 . . . . 0.0 108.253 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.9 m -84.24 -1.15 54.72 Favored 'General case' 0 C--N 1.372 1.571 0 C-N-CA 126.064 1.746 . . . . 0.0 111.756 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -79.47 -58.67 0.64 Allowed Pre-proline 0 C--N 1.358 0.965 0 C-N-CA 128.926 2.89 . . . . 0.0 111.74 170.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.413 ' HG3' HG11 ' A' ' 5' ' ' VAL . 66.7 Cg_endo -70.89 -39.66 4.16 Favored 'Trans proline' 0 C--N 1.364 1.366 0 C-N-CA 124.966 3.778 . . . . 0.0 113.522 175.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.6 m -69.42 -31.79 70.35 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.824 2.45 . . . . 0.0 114.679 -178.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -88.06 -6.38 57.97 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.853 1.261 . . . . 0.0 113.184 172.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -88.23 -19.65 26.57 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.814 1.646 . . . . 0.0 111.232 165.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.0 mt -93.38 -67.11 0.88 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 127.636 2.374 . . . . 0.0 111.059 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -94.89 -11.36 28.87 Favored 'General case' 0 C--N 1.362 1.14 0 C-N-CA 128.115 2.566 . . . . 0.0 112.277 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.86 -79.72 0.31 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 124.753 1.168 . . . . 0.0 113.284 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -146.42 -15.1 0.44 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 125.495 1.518 . . . . 0.0 107.097 -175.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.7 t -103.43 72.8 1.16 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 126.94 2.096 . . . . 0.0 106.14 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.0 122.58 30.37 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 125.792 1.637 . . . . 0.0 106.777 -174.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.9 85.25 0.75 Allowed Glycine 0 C--N 1.365 2.156 0 N-CA-C 107.647 -2.181 . . . . 0.0 107.647 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.09 115.07 27.34 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 125.567 1.547 . . . . 0.0 109.896 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -123.37 142.92 50.47 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -171.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.8 t -123.31 114.52 20.31 Favored 'General case' 0 C--N 1.351 0.645 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.45 123.0 39.67 Favored 'General case' 0 C--N 1.358 0.95 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 177.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 77.33 -84.6 0.02 OUTLIER 'General case' 0 C--N 1.381 1.949 0 C-N-CA 127.481 2.312 . . . . 0.0 111.27 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.59 54.52 0.19 Allowed Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 168.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -152.85 152.23 31.31 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.8 t -104.99 145.04 30.98 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 127.514 2.326 . . . . 0.0 109.038 -164.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -125.97 138.07 53.73 Favored 'General case' 0 CA--C 1.5 -0.968 0 C-N-CA 126.074 1.749 . . . . 0.0 106.624 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.0 m -124.36 112.69 17.26 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 124.482 1.113 . . . . 0.0 108.573 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -114.34 -147.05 0.41 Allowed 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 126.985 2.114 . . . . 0.0 106.396 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -135.87 155.61 50.05 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 105.821 -1.918 . . . . 0.0 105.821 176.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -88.08 122.13 31.3 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 107.321 -1.362 . . . . 0.0 107.321 172.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.366 0 CA-C-N 116.201 -0.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 87.6 m . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.3 mt -119.42 117.57 54.46 Favored 'Isoleucine or valine' 0 C--N 1.361 1.085 0 N-CA-C 104.066 -2.568 . . . . 0.0 104.066 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 pt -100.8 177.94 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.288 0 C-N-CA 125.188 1.395 . . . . 0.0 110.953 -176.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.5 t30 -113.38 71.4 0.74 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 126.273 1.829 . . . . 0.0 108.34 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t -133.56 143.92 37.48 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.179 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -103.25 139.97 38.01 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 126.827 2.051 . . . . 0.0 107.068 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.4 p -143.28 177.82 8.16 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 -170.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -155.02 22.99 0.44 Allowed 'General case' 0 C--N 1.355 0.815 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 174.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.2 p -174.79 148.01 1.14 Allowed Pre-proline 0 C--N 1.361 1.078 0 N-CA-C 105.235 -2.135 . . . . 0.0 105.235 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -71.81 -13.19 29.32 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.444 3.429 . . . . 0.0 114.157 167.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -73.97 -21.41 60.02 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 128.495 2.718 . . . . 0.0 114.833 170.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -87.4 -15.08 38.82 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.095 2.558 . . . . 0.0 110.743 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.45 -14.22 15.79 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 126.732 2.013 . . . . 0.0 109.955 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 p -87.97 3.33 49.09 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 120.498 -1.376 . . . . 0.0 111.371 174.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -79.16 -59.62 0.6 Allowed Pre-proline 0 C--N 1.361 1.099 0 C-N-CA 129.364 3.066 . . . . 0.0 111.221 169.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.75 -39.42 4.62 Favored 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 125.08 3.853 . . . . 0.0 113.653 174.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.99 -30.65 66.97 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.87 2.468 . . . . 0.0 114.653 -177.18 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -88.1 -7.37 57.05 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.766 1.226 . . . . 0.0 113.281 171.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.66 -18.98 29.95 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.702 1.601 . . . . 0.0 111.468 165.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.2 mt -94.04 -66.8 0.89 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 127.615 2.366 . . . . 0.0 111.153 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -95.25 -9.44 33.17 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 128.001 2.521 . . . . 0.0 112.329 -167.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.39 -79.79 0.32 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 124.868 1.223 . . . . 0.0 113.234 166.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.42 -14.2 0.39 Allowed 'General case' 0 C--N 1.354 0.78 0 C-N-CA 125.543 1.537 . . . . 0.0 106.949 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 t -103.51 72.46 1.14 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.022 2.129 . . . . 0.0 106.369 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.67 124.8 34.51 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 -175.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.71 84.47 0.67 Allowed Glycine 0 C--N 1.364 2.108 0 N-CA-C 107.493 -2.243 . . . . 0.0 107.493 172.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.35 116.15 28.7 Favored 'General case' 0 C--N 1.36 1.032 0 C-N-CA 125.563 1.545 . . . . 0.0 109.923 -170.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -122.99 139.73 53.76 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -171.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -121.01 111.94 18.11 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.89 -1.892 . . . . 0.0 105.89 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -119.91 123.17 42.91 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 77.58 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.382 2.004 0 C-N-CA 127.646 2.378 . . . . 0.0 111.027 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.54 55.95 0.19 Allowed Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 105.219 -3.152 . . . . 0.0 105.219 168.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -153.08 148.31 26.85 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.2 t -106.45 143.36 34.68 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 127.373 2.269 . . . . 0.0 109.529 -165.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -125.99 142.28 51.59 Favored 'General case' 0 C--N 1.357 0.926 0 C-N-CA 126.575 1.95 . . . . 0.0 107.083 175.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.09 120.56 32.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.687 1.195 . . . . 0.0 108.399 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -121.5 -147.43 0.39 Allowed 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -135.08 156.5 48.91 Favored 'General case' 0 C--N 1.358 0.961 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 177.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -90.38 126.8 36.0 Favored 'General case' 0 C--N 1.359 0.986 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 1.296 0 O-C-N 123.427 0.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 80.6 p . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 121.951 0.881 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.6 mt -124.48 116.87 48.85 Favored 'Isoleucine or valine' 0 C--N 1.36 1.039 0 N-CA-C 103.525 -2.769 . . . . 0.0 103.525 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.9 pt -103.63 -176.38 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.279 0 C-N-CA 125.357 1.463 . . . . 0.0 109.128 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.1 m-80 -129.38 79.23 1.9 Allowed 'General case' 0 C--N 1.361 1.102 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -176.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.6 t -129.55 127.83 65.18 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.621 -2.733 . . . . 0.0 103.621 171.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -82.37 133.82 35.23 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 126.183 1.793 . . . . 0.0 109.967 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.2 p -142.65 172.51 12.6 Favored 'General case' 0 C--N 1.357 0.904 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -167.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.0 26.91 0.48 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 170.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -170.4 148.29 2.83 Favored Pre-proline 0 C--N 1.36 1.039 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 -176.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -71.34 -16.08 31.25 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 124.199 3.266 . . . . 0.0 114.672 169.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -80.75 -7.28 59.33 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 127.217 2.207 . . . . 0.0 114.636 171.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -94.55 -3.25 50.13 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.195 2.198 . . . . 0.0 109.945 170.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.3 t -116.69 -13.92 10.8 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.28 2.232 . . . . 0.0 108.238 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -83.97 -1.18 54.15 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 126.196 1.799 . . . . 0.0 111.394 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.11 -59.35 0.54 Allowed Pre-proline 0 C--N 1.357 0.931 0 C-N-CA 129.556 3.142 . . . . 0.0 111.322 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -70.68 -40.87 3.5 Favored 'Trans proline' 0 C--N 1.365 1.397 0 C-N-CA 125.079 3.853 . . . . 0.0 113.48 174.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.4 m -69.93 -31.33 69.03 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 127.736 2.415 . . . . 0.0 114.824 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -88.07 -7.37 57.09 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 124.624 1.169 . . . . 0.0 113.338 172.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -87.14 -20.66 26.72 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.649 1.58 . . . . 0.0 111.447 165.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.1 mt -92.74 -66.7 0.91 Allowed 'General case' 0 C--N 1.366 1.303 0 C-N-CA 127.553 2.341 . . . . 0.0 111.086 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -96.59 -7.86 33.28 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 128.107 2.563 . . . . 0.0 112.253 -167.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.81 -80.03 0.5 Allowed Glycine 0 C--N 1.365 2.167 0 C-N-CA 124.936 1.255 . . . . 0.0 113.621 165.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.1 m -147.63 -11.38 0.4 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.74 1.616 . . . . 0.0 107.093 -175.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 t -105.13 69.17 0.84 Allowed 'General case' 0 C--N 1.366 1.298 0 C-N-CA 126.907 2.083 . . . . 0.0 106.142 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.78 126.14 42.91 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 125.741 1.616 . . . . 0.0 106.855 -175.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.56 85.8 0.57 Allowed Glycine 0 C--N 1.363 2.054 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 170.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.08 112.88 24.53 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 125.327 1.451 . . . . 0.0 109.812 -169.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -121.91 141.78 50.94 Favored 'General case' 0 C--N 1.361 1.088 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -127.96 110.62 12.71 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -118.93 128.11 54.11 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 78.75 -85.54 0.02 OUTLIER 'General case' 0 C--N 1.383 2.023 0 C-N-CA 127.537 2.335 . . . . 0.0 111.023 173.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 55.6 0.18 Allowed Glycine 0 N--CA 1.432 -1.582 0 N-CA-C 106.083 -2.807 . . . . 0.0 106.083 169.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -153.45 151.99 30.5 Favored 'General case' 0 C--N 1.362 1.148 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -106.35 144.98 32.26 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.558 2.343 . . . . 0.0 109.239 -165.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.3 mtmm -127.11 139.02 53.28 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 126.059 1.744 . . . . 0.0 106.835 173.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.7 m -120.66 119.42 32.79 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 124.523 1.129 . . . . 0.0 108.16 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 -118.55 -160.98 0.81 Allowed 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 126.37 1.868 . . . . 0.0 106.008 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -130.97 94.25 3.56 Favored 'General case' 0 C--N 1.36 1.026 0 N-CA-C 106.198 -1.778 . . . . 0.0 106.198 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -139.97 95.31 2.88 Favored 'General case' 0 C--N 1.356 0.878 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 175.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.375 0 CA-C-N 116.093 -0.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 45.5 p . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.6 mt -129.84 125.17 60.28 Favored 'Isoleucine or valine' 0 C--N 1.364 1.222 0 N-CA-C 104.311 -2.477 . . . . 0.0 104.311 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -113.56 -169.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.303 0 C-N-CA 125.631 1.572 . . . . 0.0 107.961 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.97 80.73 1.86 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 124.406 1.083 . . . . 0.0 108.431 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.35 126.97 66.7 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 103.665 -2.717 . . . . 0.0 103.665 172.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -78.56 134.19 37.26 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 126.395 1.878 . . . . 0.0 110.919 -175.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.2 p -145.95 168.82 19.93 Favored 'General case' 0 C--N 1.357 0.929 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -166.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.92 26.37 0.64 Allowed 'General case' 0 C--N 1.357 0.9 0 N-CA-C 105.445 -2.058 . . . . 0.0 105.445 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.7 p -168.85 149.77 4.31 Favored Pre-proline 0 C--N 1.361 1.074 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 -177.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -71.86 -13.46 29.27 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.257 3.304 . . . . 0.0 114.727 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -86.63 6.91 28.71 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 126.855 2.062 . . . . 0.0 113.582 170.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -113.09 22.23 14.56 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 127.38 2.272 . . . . 0.0 107.24 170.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.8 t -144.93 -19.01 0.5 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.4 m -82.58 -1.26 50.21 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 126.347 1.859 . . . . 0.0 111.798 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -82.6 -56.81 0.49 Allowed Pre-proline 0 C--N 1.357 0.919 0 C-N-CA 129.357 3.063 . . . . 0.0 111.424 172.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.34 -40.47 5.94 Favored 'Trans proline' 0 C--N 1.365 1.441 0 C-N-CA 124.939 3.759 . . . . 0.0 113.881 172.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.41 -31.8 70.39 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.698 2.399 . . . . 0.0 114.74 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -88.06 -6.73 57.78 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 124.992 1.317 . . . . 0.0 113.252 172.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -87.44 -19.51 27.92 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.749 1.619 . . . . 0.0 111.392 165.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -93.77 -67.38 0.86 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 127.598 2.359 . . . . 0.0 111.089 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -94.75 -10.61 31.07 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 128.089 2.555 . . . . 0.0 112.269 -167.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.22 -79.97 0.31 Allowed Glycine 0 C--N 1.365 2.142 0 C-N-CA 124.882 1.23 . . . . 0.0 113.106 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.37 -15.39 0.44 Allowed 'General case' 0 C--N 1.355 0.824 0 C-N-CA 125.569 1.548 . . . . 0.0 107.092 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.1 t -102.85 74.74 1.35 Allowed 'General case' 0 C--N 1.364 1.228 0 C-N-CA 127.005 2.122 . . . . 0.0 106.134 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.87 122.95 26.52 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 -174.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.59 86.51 0.76 Allowed Glycine 0 C--N 1.363 2.071 0 N-CA-C 107.565 -2.214 . . . . 0.0 107.565 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.72 116.0 28.21 Favored 'General case' 0 C--N 1.359 1.013 0 C-N-CA 125.504 1.521 . . . . 0.0 109.957 -169.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -123.93 143.41 50.4 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -171.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.3 t -122.83 114.87 21.09 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -125.62 124.15 40.55 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 104.429 -2.434 . . . . 0.0 104.429 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.43 -84.13 0.02 OUTLIER 'General case' 0 C--N 1.383 2.03 0 C-N-CA 127.579 2.352 . . . . 0.0 110.88 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.08 53.14 0.19 Allowed Glycine 0 N--CA 1.433 -1.538 0 N-CA-C 106.059 -2.816 . . . . 0.0 106.059 168.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -152.75 153.92 34.17 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 105.982 -1.858 . . . . 0.0 105.982 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.1 t -105.08 145.33 30.65 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 127.384 2.274 . . . . 0.0 108.73 -164.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -126.37 138.67 53.58 Favored 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 126.225 1.81 . . . . 0.0 106.447 175.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.5 m -125.33 112.51 16.43 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 124.473 1.109 . . . . 0.0 108.51 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -113.63 -146.23 0.4 Allowed 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 126.931 2.092 . . . . 0.0 106.546 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -135.68 155.97 49.58 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -89.35 123.8 33.85 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 171.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.401 0 CA-C-N 116.184 -0.462 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 81.2 p . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 121.956 0.884 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.0 mt -127.06 115.19 40.28 Favored 'Isoleucine or valine' 0 C--N 1.36 1.024 0 N-CA-C 102.955 -2.98 . . . . 0.0 102.955 175.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.0 pt -102.0 -177.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.32 0 C-N-CA 125.435 1.494 . . . . 0.0 109.831 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -126.87 76.8 1.67 Allowed 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.815 1.246 . . . . 0.0 108.196 -173.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.2 t -132.11 130.59 60.99 Favored 'Isoleucine or valine' 0 C--N 1.36 1.058 0 N-CA-C 103.957 -2.608 . . . . 0.0 103.957 173.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -80.56 137.11 36.37 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.202 1.801 . . . . 0.0 110.605 -178.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.82 172.51 12.92 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.83 27.85 0.43 Allowed 'General case' 0 C--N 1.355 0.82 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.4 p -171.23 149.14 2.55 Favored Pre-proline 0 C--N 1.36 1.037 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -71.35 -16.78 31.11 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 124.278 3.319 . . . . 0.0 114.775 169.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.62 -6.84 59.38 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.139 2.176 . . . . 0.0 114.647 172.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -94.49 -4.11 48.72 Favored 'General case' 0 C--N 1.37 1.48 0 C-N-CA 127.173 2.189 . . . . 0.0 110.1 170.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.6 t -116.19 -13.45 11.13 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 127.402 2.281 . . . . 0.0 108.048 -178.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.4 m -84.04 0.09 49.6 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 126.367 1.867 . . . . 0.0 111.304 173.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.27 -59.37 0.53 Allowed Pre-proline 0 C--N 1.358 0.94 0 C-N-CA 129.365 3.066 . . . . 0.0 111.14 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.22 -40.49 3.16 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 124.902 3.735 . . . . 0.0 113.509 174.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.79 -31.13 68.88 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 127.535 2.334 . . . . 0.0 114.747 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.09 -7.87 56.32 Favored 'General case' 0 C--N 1.371 1.516 0 C-N-CA 124.59 1.156 . . . . 0.0 113.289 172.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -86.92 -21.16 26.45 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 125.798 1.639 . . . . 0.0 111.528 165.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.7 mt -92.16 -66.46 0.92 Allowed 'General case' 0 C--N 1.366 1.301 0 C-N-CA 127.601 2.36 . . . . 0.0 111.04 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -95.72 -12.14 25.93 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 128.022 2.529 . . . . 0.0 112.106 -167.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.74 -74.59 0.4 Allowed Glycine 0 C--N 1.364 2.133 0 C-N-CA 124.915 1.245 . . . . 0.0 113.836 164.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -141.72 -36.59 0.43 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.584 1.553 . . . . 0.0 107.218 -170.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.6 t -90.5 75.07 6.78 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.86 2.464 . . . . 0.0 108.346 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.32 124.8 35.24 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -176.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.52 87.06 0.63 Allowed Glycine 0 C--N 1.362 1.992 0 N-CA-C 107.545 -2.222 . . . . 0.0 107.545 172.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.26 115.21 27.12 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.286 1.434 . . . . 0.0 109.721 -171.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -123.33 142.27 51.13 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.9 t -123.56 113.87 19.29 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 105.885 -1.894 . . . . 0.0 105.885 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 79.0 mtp -120.38 123.4 42.98 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 175.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 78.58 -84.78 0.02 OUTLIER 'General case' 0 C--N 1.383 2.039 0 C-N-CA 127.512 2.325 . . . . 0.0 110.936 174.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.8 55.28 0.2 Allowed Glycine 0 N--CA 1.434 -1.499 0 N-CA-C 105.806 -2.917 . . . . 0.0 105.806 168.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -154.04 152.5 30.57 Favored 'General case' 0 C--N 1.363 1.18 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.91 146.44 29.98 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 127.438 2.295 . . . . 0.0 109.568 -163.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -126.13 141.82 51.78 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.294 1.838 . . . . 0.0 106.793 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -124.79 122.89 38.73 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.255 1.022 . . . . 0.0 108.261 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -122.52 -159.72 0.85 Allowed 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 -132.36 90.68 2.83 Favored 'General case' 0 C--N 1.36 1.045 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -138.99 93.63 2.72 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.298 -2.112 . . . . 0.0 105.298 176.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.356 0 CA-C-N 116.038 -0.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 74.3 p . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 121.952 0.882 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.9 mt -124.89 119.45 56.01 Favored 'Isoleucine or valine' 0 C--N 1.361 1.067 0 N-CA-C 103.51 -2.774 . . . . 0.0 103.51 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.4 pt -104.16 -176.72 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.279 1.431 . . . . 0.0 109.299 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -127.73 77.19 1.73 Allowed 'General case' 0 C--N 1.362 1.115 0 C-N-CA 124.699 1.2 . . . . 0.0 107.8 -175.599 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.433 HG11 ' HG3' ' A' ' 16' ' ' PRO . 12.3 t -129.98 129.69 65.87 Favored 'Isoleucine or valine' 0 C--N 1.361 1.087 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 172.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -79.72 137.02 36.92 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 126.451 1.901 . . . . 0.0 110.447 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -145.86 173.43 12.14 Favored 'General case' 0 C--N 1.358 0.965 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.96 27.27 0.42 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 p -172.06 147.32 1.87 Allowed Pre-proline 0 C--N 1.359 1.017 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -71.07 -13.71 31.52 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.609 3.539 . . . . 0.0 114.28 167.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -72.18 -23.27 61.24 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 128.879 2.872 . . . . 0.0 114.438 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -89.42 -8.74 52.4 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 127.555 2.342 . . . . 0.0 110.931 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -110.45 -15.24 13.96 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 126.984 2.114 . . . . 0.0 109.417 -178.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.3 p -87.89 3.01 50.07 Favored 'General case' 0 C--N 1.369 1.422 0 O-C-N 120.179 -1.576 . . . . 0.0 111.156 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -79.87 -58.25 0.63 Allowed Pre-proline 0 C--N 1.359 1.002 0 C-N-CA 129.846 3.258 . . . . 0.0 111.347 170.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.433 ' HG3' HG11 ' A' ' 5' ' ' VAL . 67.0 Cg_endo -70.15 -40.22 4.95 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 125.119 3.879 . . . . 0.0 113.756 173.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -69.78 -31.68 69.75 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.647 2.379 . . . . 0.0 114.796 -176.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -88.1 -8.0 56.11 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 124.952 1.301 . . . . 0.0 113.16 172.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -86.85 -20.16 27.89 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 125.81 1.644 . . . . 0.0 111.434 165.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.5 mt -92.02 -66.66 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.692 2.397 . . . . 0.0 111.097 177.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -96.9 -11.21 25.02 Favored 'General case' 0 C--N 1.362 1.129 0 C-N-CA 127.914 2.486 . . . . 0.0 112.288 -166.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -78.55 0.43 Allowed Glycine 0 C--N 1.363 2.08 0 C-N-CA 124.933 1.254 . . . . 0.0 113.097 166.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.7 m -148.47 -6.96 0.4 Allowed 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.764 1.625 . . . . 0.0 107.201 -175.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.7 t -107.39 64.46 0.63 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 126.77 2.028 . . . . 0.0 106.156 178.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -124.6 127.0 46.71 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 125.944 1.697 . . . . 0.0 107.227 -174.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.92 87.74 0.58 Allowed Glycine 0 C--N 1.362 1.983 0 N-CA-C 107.023 -2.431 . . . . 0.0 107.023 169.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.04 114.75 26.59 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 125.227 1.411 . . . . 0.0 109.868 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -124.42 140.53 52.86 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 -171.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.3 t -124.33 119.2 28.59 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.5 mtt -127.42 126.98 43.37 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.05 -84.24 0.02 OUTLIER 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.553 2.341 . . . . 0.0 110.82 173.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.3 55.94 0.17 Allowed Glycine 0 N--CA 1.432 -1.586 0 N-CA-C 106.088 -2.805 . . . . 0.0 106.088 167.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -154.0 151.54 29.49 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.5 t -106.81 146.69 30.6 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.543 2.337 . . . . 0.0 109.367 -163.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -127.29 139.12 53.11 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 106.701 174.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.8 m -123.81 116.15 22.51 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 124.458 1.103 . . . . 0.0 108.043 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -114.55 -168.05 1.31 Allowed 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 126.51 1.924 . . . . 0.0 106.883 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -124.42 88.97 2.99 Favored 'General case' 0 C--N 1.359 1.012 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -137.68 95.61 3.09 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.376 0 CA-C-N 116.054 -0.521 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 122.026 0.917 . . . . 0.0 109.956 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 45.5 mt -119.67 119.37 60.21 Favored 'Isoleucine or valine' 0 C--N 1.36 1.06 0 N-CA-C 103.728 -2.693 . . . . 0.0 103.728 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 33.6 pt -103.21 -173.11 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.39 1.476 . . . . 0.0 109.015 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -134.95 78.16 1.72 Allowed 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.244 1.018 . . . . 0.0 108.379 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.3 t -128.31 128.1 68.05 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.725 -2.694 . . . . 0.0 103.725 172.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -79.2 134.62 36.68 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.354 1.861 . . . . 0.0 110.472 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -144.39 169.47 17.86 Favored 'General case' 0 C--N 1.358 0.961 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -167.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -148.8 18.86 1.01 Allowed 'General case' 0 C--N 1.353 0.733 0 C-N-CA 125.874 1.67 . . . . 0.0 106.515 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.7 p -169.6 151.19 4.25 Favored Pre-proline 0 C--N 1.36 1.033 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 -175.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -71.26 -15.15 31.68 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 124.597 3.531 . . . . 0.0 114.326 166.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -73.63 -19.61 60.81 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.306 2.642 . . . . 0.0 114.744 170.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.0 tp60 -88.96 -13.76 38.2 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.415 2.686 . . . . 0.0 110.883 175.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.7 t -106.29 -13.79 15.29 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.11 2.164 . . . . 0.0 109.407 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.2 p -87.82 4.41 44.61 Favored 'General case' 0 C--N 1.368 1.398 0 O-C-N 120.303 -1.498 . . . . 0.0 111.251 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.04 -59.33 0.63 Allowed Pre-proline 0 C--N 1.361 1.107 0 C-N-CA 129.279 3.032 . . . . 0.0 111.139 169.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.72 -39.41 4.68 Favored 'Trans proline' 0 C--N 1.366 1.484 0 C-N-CA 125.089 3.859 . . . . 0.0 113.651 174.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.7 m -70.78 -30.32 66.77 Favored 'General case' 0 C--N 1.368 1.398 0 C-N-CA 127.57 2.348 . . . . 0.0 114.818 -176.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -88.08 -8.85 54.89 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 124.787 1.235 . . . . 0.0 112.682 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -86.43 -19.93 28.91 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 125.731 1.612 . . . . 0.0 111.696 166.098 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.1 mt -94.01 -67.9 0.83 Allowed 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.521 2.328 . . . . 0.0 110.873 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -93.99 -10.47 33.51 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 128.169 2.587 . . . . 0.0 112.2 -168.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.1 -79.71 0.42 Allowed Glycine 0 C--N 1.364 2.136 0 C-N-CA 124.897 1.237 . . . . 0.0 113.69 164.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.3 m -145.2 -15.39 0.51 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.681 1.592 . . . . 0.0 107.284 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.0 t -105.6 72.66 0.98 Allowed 'General case' 0 C--N 1.364 1.239 0 C-N-CA 126.835 2.054 . . . . 0.0 105.89 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.43 121.9 30.08 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 125.687 1.595 . . . . 0.0 106.864 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.97 84.27 0.64 Allowed Glycine 0 C--N 1.365 2.178 0 N-CA-C 107.672 -2.171 . . . . 0.0 107.672 171.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.04 117.08 29.66 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.532 1.533 . . . . 0.0 110.141 -170.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -124.64 140.33 53.04 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 -171.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.2 t -124.62 119.4 28.92 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 -178.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -129.39 126.3 38.51 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 103.857 -2.646 . . . . 0.0 103.857 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.2 m120 78.6 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.008 0 C-N-CA 127.564 2.346 . . . . 0.0 110.968 174.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.34 55.64 0.18 Allowed Glycine 0 N--CA 1.432 -1.567 0 N-CA-C 106.069 -2.812 . . . . 0.0 106.069 168.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -154.01 153.16 31.46 Favored 'General case' 0 C--N 1.362 1.141 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -107.54 146.07 32.33 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 127.596 2.358 . . . . 0.0 109.092 -164.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -127.65 139.47 52.7 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.391 1.876 . . . . 0.0 106.451 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -121.58 118.72 29.94 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 124.563 1.145 . . . . 0.0 108.149 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -119.5 -149.18 0.43 Allowed 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -134.96 154.92 51.53 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -88.48 122.37 31.89 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 172.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 5.3 t . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.414 HG23 ' HG2' ' A' ' 35' ' ' LYS . 85.4 mt -104.88 124.34 59.48 Favored 'Isoleucine or valine' 0 C--N 1.367 1.356 0 C-N-CA 126.777 2.031 . . . . 0.0 105.82 -174.171 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.6 pt -102.47 179.22 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.082 0 C-N-CA 125.272 1.429 . . . . 0.0 111.113 -171.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -120.41 67.96 0.85 Allowed 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.741 1.616 . . . . 0.0 108.42 -172.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.2 t -125.91 129.64 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -87.68 133.73 33.78 Favored 'General case' 0 C--N 1.363 1.185 0 C-N-CA 125.98 1.712 . . . . 0.0 108.991 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -138.5 175.26 9.72 Favored 'General case' 0 C--N 1.358 0.947 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -168.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -154.54 23.12 0.47 Allowed 'General case' 0 C--N 1.356 0.855 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.3 p -173.68 149.39 1.58 Allowed Pre-proline 0 C--N 1.361 1.1 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -173.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -71.4 -16.34 31.01 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.189 3.259 . . . . 0.0 114.617 168.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -78.31 -13.75 59.71 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 127.624 2.37 . . . . 0.0 114.897 173.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -88.2 -11.26 47.23 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 127.962 2.505 . . . . 0.0 110.324 171.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -110.13 -12.34 14.5 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 127.322 2.249 . . . . 0.0 108.758 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.6 m -85.68 -1.65 57.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.535 1.934 . . . . 0.0 111.12 173.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -79.08 -59.27 0.63 Allowed Pre-proline 0 C--N 1.359 0.979 0 C-N-CA 129.203 3.001 . . . . 0.0 111.319 171.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.22 -41.9 2.3 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 125.004 3.803 . . . . 0.0 113.551 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.32 -29.05 65.66 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.656 2.383 . . . . 0.0 114.813 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -88.0 -8.39 55.7 Favored 'General case' 0 C--N 1.37 1.476 0 CA-C-N 120.069 1.304 . . . . 0.0 113.545 170.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -86.55 -20.74 27.53 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.694 1.598 . . . . 0.0 111.536 166.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.9 mt -93.96 -66.21 0.93 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.549 2.339 . . . . 0.0 111.141 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -95.4 -7.76 37.5 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.812 2.445 . . . . 0.0 112.212 -167.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.8 -78.77 0.37 Allowed Glycine 0 C--N 1.366 2.196 0 C-N-CA 125.124 1.345 . . . . 0.0 113.334 165.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.413 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -153.12 -7.92 0.17 Allowed 'General case' 0 C--N 1.354 0.787 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.413 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.3 t -104.93 69.7 0.88 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.103 2.161 . . . . 0.0 105.687 175.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.99 127.49 41.76 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 125.709 1.604 . . . . 0.0 106.691 -175.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.56 89.57 0.66 Allowed Glycine 0 C--N 1.36 1.91 0 N-CA-C 107.084 -2.406 . . . . 0.0 107.084 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.11 116.52 29.11 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 125.144 1.378 . . . . 0.0 109.736 -171.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -123.44 141.73 51.7 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 -173.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -123.03 110.29 15.16 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 -178.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 49.9 mtt -117.38 122.8 44.83 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 79.12 -85.34 0.02 OUTLIER 'General case' 0 C--N 1.383 2.022 0 C-N-CA 127.561 2.345 . . . . 0.0 110.204 175.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.28 56.49 0.18 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 105.218 -3.153 . . . . 0.0 105.218 169.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -152.37 149.88 29.09 Favored 'General case' 0 C--N 1.362 1.135 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.0 t -105.83 142.33 35.74 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.238 2.215 . . . . 0.0 109.086 -165.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.414 ' HG2' HG23 ' A' ' 2' ' ' ILE . 51.6 mtmt -120.82 146.14 46.86 Favored 'General case' 0 CA--C 1.5 -0.96 0 C-N-CA 126.219 1.807 . . . . 0.0 107.168 172.023 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.88 142.84 48.31 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -138.67 -160.6 1.08 Allowed 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 103.631 -2.729 . . . . 0.0 103.631 177.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -132.36 96.66 3.91 Favored 'General case' 0 C--N 1.358 0.974 0 N-CA-C 105.845 -1.909 . . . . 0.0 105.845 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -138.31 98.59 3.64 Favored 'General case' 0 C--N 1.356 0.868 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.382 0 CA-C-N 116.103 -0.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 40.1 p . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 38.1 mt -125.2 128.84 73.13 Favored 'Isoleucine or valine' 0 C--N 1.363 1.166 0 N-CA-C 104.377 -2.453 . . . . 0.0 104.377 -176.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -107.65 -174.88 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.295 0 C-N-CA 125.143 1.377 . . . . 0.0 109.189 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 -131.63 80.05 1.91 Allowed 'General case' 0 C--N 1.361 1.101 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.8 t -129.16 126.46 64.2 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -85.75 138.19 32.27 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.902 1.681 . . . . 0.0 108.872 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 p -146.74 171.07 15.71 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -162.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.63 21.73 0.71 Allowed 'General case' 0 C--N 1.355 0.817 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 174.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.8 p -170.15 149.96 3.44 Favored Pre-proline 0 C--N 1.36 1.036 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -70.98 -17.37 32.09 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.443 3.429 . . . . 0.0 114.55 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -79.8 -10.86 59.83 Favored 'General case' 0 C--N 1.369 1.455 0 C-N-CA 127.353 2.261 . . . . 0.0 114.923 173.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -89.03 -10.64 46.77 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 127.685 2.394 . . . . 0.0 110.248 170.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.5 t -108.83 -14.6 14.55 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.193 2.197 . . . . 0.0 108.646 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.6 m -83.97 -0.68 52.52 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 126.208 1.803 . . . . 0.0 111.358 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -79.15 -59.65 0.6 Allowed Pre-proline 0 C--N 1.358 0.969 0 C-N-CA 128.85 2.86 . . . . 0.0 111.277 170.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.04 -42.51 3.05 Favored 'Trans proline' 0 C--N 1.366 1.451 0 C-N-CA 125.017 3.812 . . . . 0.0 113.423 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.5 -32.59 72.67 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 127.442 2.297 . . . . 0.0 115.135 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -88.06 -7.41 57.04 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 124.429 1.092 . . . . 0.0 112.605 173.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -87.82 -22.57 24.41 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 125.795 1.638 . . . . 0.0 111.73 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.06 -66.68 0.91 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 127.527 2.331 . . . . 0.0 110.964 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -91.95 -18.65 23.4 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 128.21 2.604 . . . . 0.0 111.685 -169.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.96 -75.21 0.46 Allowed Glycine 0 C--N 1.365 2.192 0 C-N-CA 125.081 1.324 . . . . 0.0 113.211 165.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.3 m -144.95 -9.48 0.6 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.227 1.811 . . . . 0.0 107.694 -171.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.6 t -111.31 61.99 0.61 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 126.353 1.861 . . . . 0.0 106.216 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.8 124.09 45.27 Favored 'General case' 0 C--N 1.358 0.959 0 C-N-CA 126.063 1.745 . . . . 0.0 107.458 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.11 85.77 0.47 Allowed Glycine 0 C--N 1.362 2.012 0 N-CA-C 106.652 -2.579 . . . . 0.0 106.652 168.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.84 111.96 23.72 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 125.224 1.409 . . . . 0.0 110.094 -168.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -119.68 146.23 45.77 Favored 'General case' 0 CA--C 1.497 -1.089 0 C-N-CA 125.194 1.397 . . . . 0.0 107.268 -171.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.5 t -129.97 114.87 16.37 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.1 mmt -126.78 127.02 44.39 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 176.496 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 80.11 -83.65 0.02 OUTLIER 'General case' 0 C--N 1.383 2.048 0 C-N-CA 127.469 2.308 . . . . 0.0 109.946 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.26 56.83 0.12 Allowed Glycine 0 N--CA 1.431 -1.675 0 N-CA-C 105.42 -3.072 . . . . 0.0 105.42 168.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -153.68 152.08 30.4 Favored 'General case' 0 C--N 1.364 1.198 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -106.19 142.72 35.41 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 127.713 2.405 . . . . 0.0 109.314 -164.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -124.87 138.01 54.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 126.045 1.738 . . . . 0.0 106.887 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.1 m -121.27 110.71 16.47 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 124.428 1.091 . . . . 0.0 108.103 178.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -107.73 -173.78 2.37 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 126.744 2.018 . . . . 0.0 107.858 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -118.27 86.12 2.47 Favored 'General case' 0 C--N 1.361 1.071 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -134.58 97.26 3.75 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 105.893 -1.892 . . . . 0.0 105.893 178.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.394 0 CA-C-N 116.089 -0.505 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 65.6 p . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.3 mt -104.99 115.3 46.61 Favored 'Isoleucine or valine' 0 C--N 1.365 1.255 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 -171.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.9 pt -101.67 -178.41 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.221 0 C-N-CA 125.819 1.648 . . . . 0.0 109.852 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.71 76.63 1.69 Allowed 'General case' 0 C--N 1.362 1.132 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.404 HG11 ' HG3' ' A' ' 16' ' ' PRO . 18.4 t -127.23 126.08 67.23 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 172.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -83.49 132.54 34.94 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.962 1.705 . . . . 0.0 110.151 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -141.66 171.56 13.89 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -165.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.43 26.93 0.51 Allowed 'General case' 0 C--N 1.356 0.87 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 170.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -170.13 148.76 3.11 Favored Pre-proline 0 C--N 1.359 1.006 0 N-CA-C 105.196 -2.15 . . . . 0.0 105.196 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -71.58 -15.93 30.51 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.216 3.278 . . . . 0.0 114.764 169.452 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -79.43 -11.04 59.92 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.493 2.317 . . . . 0.0 114.356 171.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -92.23 -2.23 56.62 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 127.216 2.207 . . . . 0.0 110.238 171.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.81 -13.55 9.53 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.254 2.221 . . . . 0.0 108.243 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -85.1 -0.84 55.83 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 126.077 1.751 . . . . 0.0 111.251 174.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.9 mmmm -81.45 -57.31 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.927 0 C-N-CA 128.915 2.886 . . . . 0.0 111.282 171.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.404 ' HG3' HG11 ' A' ' 5' ' ' VAL . 61.9 Cg_endo -70.04 -41.36 3.98 Favored 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 124.796 3.664 . . . . 0.0 113.832 173.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.75 -30.59 68.22 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.522 2.329 . . . . 0.0 114.824 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.05 -7.62 56.74 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 124.747 1.219 . . . . 0.0 113.071 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.69 -20.26 26.51 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 125.656 1.582 . . . . 0.0 111.706 165.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.0 mt -94.9 -67.86 0.83 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.499 2.32 . . . . 0.0 110.967 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -91.65 -13.22 32.18 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 128.373 2.669 . . . . 0.0 111.789 -169.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.95 -75.63 0.29 Allowed Glycine 0 C--N 1.365 2.148 0 C-N-CA 124.916 1.246 . . . . 0.0 113.942 162.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.41 -34.76 0.48 Allowed 'General case' 0 C--N 1.354 0.795 0 C-N-CA 125.543 1.537 . . . . 0.0 107.071 -170.054 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 t -92.61 78.93 4.86 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.877 2.471 . . . . 0.0 107.778 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -132.82 120.13 21.17 Favored 'General case' 0 C--N 1.361 1.077 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.32 85.53 0.73 Allowed Glycine 0 C--N 1.363 2.076 0 N-CA-C 107.638 -2.185 . . . . 0.0 107.638 172.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.18 117.6 30.26 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.65 1.58 . . . . 0.0 110.095 -169.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -123.99 141.39 52.09 Favored 'General case' 0 C--N 1.362 1.146 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -171.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.5 t -122.68 111.0 16.22 Favored 'General case' 0 C--N 1.351 0.671 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.3 mtp -117.81 123.67 46.52 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 105.109 -2.182 . . . . 0.0 105.109 175.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.58 -84.3 0.02 OUTLIER 'General case' 0 C--N 1.383 2.026 0 C-N-CA 127.641 2.376 . . . . 0.0 110.826 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.04 56.07 0.18 Allowed Glycine 0 N--CA 1.432 -1.571 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -154.0 152.36 30.44 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 175.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.9 t -105.58 145.5 30.88 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 127.262 2.225 . . . . 0.0 109.574 -164.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -126.04 143.62 51.04 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 126.225 1.81 . . . . 0.0 106.964 173.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -127.59 116.6 20.58 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 124.949 1.3 . . . . 0.0 108.298 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -117.58 -146.45 0.4 Allowed 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 126.429 1.892 . . . . 0.0 105.935 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.21 154.69 51.51 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -86.64 120.43 27.94 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 172.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.33 0 CA-C-N 116.187 -0.46 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 77.0 p . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 122.015 0.912 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.4 mt -126.49 117.99 49.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 175.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 pt -103.42 -171.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.273 0 C-N-CA 125.442 1.497 . . . . 0.0 109.335 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -133.48 77.71 1.74 Allowed 'General case' 0 C--N 1.361 1.077 0 C-N-CA 124.464 1.106 . . . . 0.0 108.685 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -129.49 127.7 65.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 171.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -82.43 132.78 35.2 Favored 'General case' 0 C--N 1.366 1.289 0 C-N-CA 125.964 1.706 . . . . 0.0 109.9 -176.657 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.0 p -141.38 166.62 24.25 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 123.821 1.772 . . . . 0.0 110.079 -165.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 83.3 m -128.91 -49.11 1.23 Allowed 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 129.634 3.174 . . . . 0.0 104.699 -174.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.9 p -114.23 163.24 19.64 Favored Pre-proline 0 C--N 1.36 1.058 0 C-N-CA 127.443 2.297 . . . . 0.0 109.011 -177.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -72.6 -17.31 26.51 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.546 3.497 . . . . 0.0 114.409 164.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.68 -14.98 60.36 Favored 'General case' 0 C--N 1.372 1.57 0 C-N-CA 127.681 2.392 . . . . 0.0 114.469 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -84.81 -14.63 47.46 Favored 'General case' 0 C--N 1.37 1.491 0 C-N-CA 128.399 2.679 . . . . 0.0 110.62 172.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -107.46 -14.08 14.94 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 127.343 2.257 . . . . 0.0 109.077 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.7 m -84.52 -2.06 56.75 Favored 'General case' 0 C--N 1.369 1.413 0 C-N-CA 126.067 1.747 . . . . 0.0 111.386 174.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -80.43 -57.29 0.63 Allowed Pre-proline 0 N--CA 1.442 -0.866 0 C-N-CA 129.042 2.937 . . . . 0.0 111.5 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.63 -41.52 4.37 Favored 'Trans proline' 0 C--N 1.365 1.434 0 C-N-CA 124.984 3.789 . . . . 0.0 114.049 173.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.75 -30.9 68.59 Favored 'General case' 0 C--N 1.368 1.379 0 C-N-CA 127.579 2.352 . . . . 0.0 114.815 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -88.08 -7.7 56.58 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 124.921 1.288 . . . . 0.0 113.33 172.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -86.99 -20.12 27.71 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 125.654 1.582 . . . . 0.0 111.436 165.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.4 mt -92.39 -66.51 0.92 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 127.51 2.324 . . . . 0.0 111.168 177.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.2 -8.83 29.04 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 128.032 2.533 . . . . 0.0 112.245 -166.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.64 0.46 Allowed Glycine 0 C--N 1.364 2.109 0 C-N-CA 125.042 1.306 . . . . 0.0 113.377 165.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.42 -8.65 0.38 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 125.843 1.657 . . . . 0.0 107.143 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.1 t -106.56 67.78 0.73 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 126.822 2.049 . . . . 0.0 105.933 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.74 126.26 43.16 Favored 'General case' 0 CA--C 1.5 -0.969 0 C-N-CA 125.748 1.619 . . . . 0.0 106.946 -174.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.79 88.07 0.63 Allowed Glycine 0 C--N 1.361 1.97 0 N-CA-C 107.372 -2.291 . . . . 0.0 107.372 170.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.97 114.17 25.86 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 125.048 1.339 . . . . 0.0 109.84 -171.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.65 141.95 48.88 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -173.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.0 t -122.2 110.37 15.64 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -120.9 123.42 42.47 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.02 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.591 2.356 . . . . 0.0 110.901 177.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.91 54.62 0.17 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.631 -2.988 . . . . 0.0 105.631 168.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -152.55 152.3 31.71 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.6 t -105.15 144.29 32.16 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.16 2.184 . . . . 0.0 109.417 -165.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -125.28 139.69 53.49 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 126.463 1.905 . . . . 0.0 107.181 173.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.9 m -123.76 118.97 28.39 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.361 1.064 . . . . 0.0 108.319 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -117.75 -161.63 0.83 Allowed 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 126.569 1.948 . . . . 0.0 106.381 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -129.54 94.32 3.74 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.9 m120 -139.98 92.01 2.51 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.09 -2.189 . . . . 0.0 105.09 175.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.417 0 CA-C-N 116.031 -0.531 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 95.1 m . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt -120.13 122.14 67.63 Favored 'Isoleucine or valine' 0 C--N 1.361 1.099 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt -103.54 -170.77 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.337 0 C-N-CA 125.601 1.56 . . . . 0.0 109.142 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -135.01 78.43 1.73 Allowed 'General case' 0 C--N 1.361 1.07 0 C-N-CA 124.33 1.052 . . . . 0.0 108.555 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.0 t -128.87 127.21 66.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.7 133.13 34.82 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 125.613 1.565 . . . . 0.0 110.201 -174.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -142.12 171.71 13.68 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -165.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -153.28 27.33 0.51 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 169.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.3 p -170.53 149.22 2.97 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -71.31 -14.25 31.14 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 124.228 3.286 . . . . 0.0 114.822 168.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -87.75 9.43 21.7 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 126.71 2.004 . . . . 0.0 113.464 171.259 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -113.1 19.55 17.08 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.189 2.196 . . . . 0.0 107.614 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.3 t -142.58 -16.06 0.72 Allowed 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.36 1.864 . . . . 0.0 109.001 -175.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.8 m -83.83 -0.7 52.2 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 126.333 1.853 . . . . 0.0 111.717 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.1 mptp? -83.13 -57.3 0.44 Allowed Pre-proline 0 C--N 1.358 0.959 0 C-N-CA 129.069 2.947 . . . . 0.0 110.885 173.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.83 -40.01 5.71 Favored 'Trans proline' 0 C--N 1.367 1.521 0 C-N-CA 124.877 3.718 . . . . 0.0 113.714 174.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -70.07 -31.44 69.05 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 127.805 2.442 . . . . 0.0 114.782 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -88.07 -5.02 58.69 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 124.78 1.232 . . . . 0.0 113.463 171.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -87.05 -24.92 24.45 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 125.98 1.712 . . . . 0.0 110.655 164.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.9 mt -89.78 -63.38 1.29 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.473 2.309 . . . . 0.0 111.913 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -98.21 -9.05 26.24 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 127.797 2.439 . . . . 0.0 111.893 -167.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.56 -80.12 0.36 Allowed Glycine 0 C--N 1.365 2.176 0 C-N-CA 124.898 1.237 . . . . 0.0 113.407 165.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 24' ' ' SER . 74.8 m -146.31 -15.79 0.44 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.458 1.503 . . . . 0.0 107.006 -176.002 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.5 t -102.71 74.3 1.34 Allowed 'General case' 0 C--N 1.365 1.265 0 C-N-CA 126.948 2.099 . . . . 0.0 106.435 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -130.27 125.45 34.83 Favored 'General case' 0 C--N 1.36 1.025 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 -176.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.99 85.91 0.65 Allowed Glycine 0 C--N 1.362 2.016 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 171.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.05 117.74 30.53 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.49 1.516 . . . . 0.0 109.964 -170.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -124.51 144.32 50.18 Favored 'General case' 0 C--N 1.362 1.138 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -170.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -122.96 113.46 19.11 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -126.01 125.85 43.32 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 104.438 -2.43 . . . . 0.0 104.438 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 81.04 -86.25 0.02 OUTLIER 'General case' 0 C--N 1.384 2.068 0 C-N-CA 127.592 2.357 . . . . 0.0 109.158 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -173.23 54.51 0.16 Allowed Glycine 0 N--CA 1.432 -1.593 0 N-CA-C 104.923 -3.271 . . . . 0.0 104.923 166.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -150.23 152.95 35.39 Favored 'General case' 0 C--N 1.365 1.27 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.9 t -105.05 144.12 32.3 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 126.771 2.029 . . . . 0.0 109.297 -164.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -124.32 142.31 51.37 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 126.179 1.792 . . . . 0.0 106.774 174.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.8 m -125.97 119.01 26.58 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 124.342 1.057 . . . . 0.0 108.198 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -120.08 -147.01 0.39 Allowed 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.769 -1.938 . . . . 0.0 105.769 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.09 156.77 48.45 Favored 'General case' 0 C--N 1.359 0.98 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 177.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -88.66 124.32 33.97 Favored 'General case' 0 C--N 1.36 1.029 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 171.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.367 0 CA-C-N 116.168 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 122.115 0.959 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.6 mt -124.65 113.69 37.32 Favored 'Isoleucine or valine' 0 C--N 1.36 1.036 0 N-CA-C 102.897 -3.001 . . . . 0.0 102.897 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.0 pt -99.5 -177.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.314 0 C-N-CA 125.556 1.543 . . . . 0.0 110.235 -178.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.39 74.47 1.52 Allowed 'General case' 0 C--N 1.362 1.146 0 C-N-CA 124.813 1.245 . . . . 0.0 107.957 -174.607 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.4 t -126.81 122.6 60.95 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 N-CA-C 103.36 -2.83 . . . . 0.0 103.36 171.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -85.62 136.45 33.37 Favored 'General case' 0 C--N 1.364 1.226 0 C-N-CA 125.771 1.628 . . . . 0.0 109.029 -173.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 p -145.61 170.47 16.39 Favored 'General case' 0 C--N 1.356 0.891 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 -160.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.43 22.63 0.72 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.789 -1.93 . . . . 0.0 105.789 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 p -170.62 148.36 2.71 Favored Pre-proline 0 C--N 1.36 1.054 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -174.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -71.52 -13.36 30.13 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 124.632 3.554 . . . . 0.0 114.291 165.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -75.57 -15.22 60.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 128.156 2.582 . . . . 0.0 114.786 170.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -91.85 -9.8 42.05 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 128.052 2.541 . . . . 0.0 110.332 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.7 t -112.64 -12.86 13.35 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.857 2.063 . . . . 0.0 109.456 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.2 p -87.96 0.43 55.9 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 125.71 1.604 . . . . 0.0 111.345 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -78.96 -58.05 0.73 Allowed Pre-proline 0 C--N 1.36 1.053 0 C-N-CA 128.42 2.688 . . . . 0.0 111.775 169.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.98 -41.41 2.74 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.945 3.763 . . . . 0.0 113.204 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -69.89 -31.66 69.58 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.831 2.452 . . . . 0.0 114.971 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -88.01 -6.64 57.88 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 124.659 1.184 . . . . 0.0 113.304 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.09 -22.32 22.96 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 126.255 1.822 . . . . 0.0 111.638 165.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.2 mt -91.3 -68.17 0.81 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.287 2.235 . . . . 0.0 110.966 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.24 -30.07 15.37 Favored 'General case' 0 C--N 1.36 1.055 0 C-N-CA 128.001 2.52 . . . . 0.0 111.672 -167.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.48 -169.64 14.88 Favored Glycine 0 C--N 1.36 1.883 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 34.2 m -69.23 -4.92 19.73 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 128.496 2.719 . . . . 0.0 116.302 -174.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 t -109.57 67.1 0.64 Allowed 'General case' 0 C--N 1.363 1.159 0 C-N-CA 126.717 2.007 . . . . 0.0 106.196 167.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.47 140.73 49.04 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.055 1.742 . . . . 0.0 106.6 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.82 87.11 0.62 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.476 -2.25 . . . . 0.0 107.476 173.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.94 112.59 24.29 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.357 1.463 . . . . 0.0 109.425 -171.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -123.23 139.0 54.5 Favored 'General case' 0 C--N 1.362 1.111 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -171.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.9 t -119.88 112.45 19.23 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -121.97 123.52 41.86 Favored 'General case' 0 C--N 1.358 0.957 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 37.7 t30 79.23 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.381 1.963 0 C-N-CA 127.285 2.234 . . . . 0.0 110.217 175.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.48 55.35 0.17 Allowed Glycine 0 N--CA 1.432 -1.599 0 N-CA-C 105.495 -3.042 . . . . 0.0 105.495 168.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -154.05 153.95 32.81 Favored 'General case' 0 C--N 1.363 1.175 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -105.03 148.47 26.72 Favored 'General case' 0 C--N 1.359 0.983 0 C-N-CA 127.23 2.212 . . . . 0.0 109.454 -165.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -128.15 142.66 51.12 Favored 'General case' 0 CA--C 1.501 -0.921 0 C-N-CA 126.238 1.815 . . . . 0.0 106.89 174.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.8 m -123.67 123.72 41.17 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -123.35 -154.5 0.61 Allowed 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -130.55 22.53 5.1 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 125.042 1.337 . . . . 0.0 108.89 -175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -94.97 76.82 3.56 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.84 1.256 . . . . 0.0 109.629 -176.238 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.391 0 CA-C-N 116.227 -0.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 122.112 0.958 . . . . 0.0 109.815 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt -123.73 114.86 43.29 Favored 'Isoleucine or valine' 0 C--N 1.36 1.062 0 N-CA-C 102.995 -2.965 . . . . 0.0 102.995 174.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.1 pt -99.8 -178.93 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.287 0 C-N-CA 125.576 1.55 . . . . 0.0 109.858 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -127.21 75.66 1.6 Allowed 'General case' 0 C--N 1.363 1.183 0 C-N-CA 124.541 1.137 . . . . 0.0 107.935 -174.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.413 HG11 ' HG3' ' A' ' 16' ' ' PRO . 15.6 t -129.38 129.22 67.08 Favored 'Isoleucine or valine' 0 C--N 1.36 1.055 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 172.805 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -82.59 140.88 32.98 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 125.914 1.686 . . . . 0.0 109.613 -175.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.9 p -147.67 167.35 24.83 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -167.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -148.83 22.12 1.0 Allowed 'General case' 0 C--N 1.355 0.81 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 171.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.0 p -169.01 150.73 4.53 Favored Pre-proline 0 C--N 1.361 1.067 0 N-CA-C 105.304 -2.109 . . . . 0.0 105.304 -175.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -71.62 -16.32 30.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.114 3.21 . . . . 0.0 114.815 169.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.51 -4.82 57.02 Favored 'General case' 0 C--N 1.369 1.437 0 C-N-CA 127.009 2.123 . . . . 0.0 114.569 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -99.14 3.01 46.42 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 127.161 2.184 . . . . 0.0 109.648 171.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -122.99 -14.04 7.68 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 127.465 2.306 . . . . 0.0 108.007 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 m -85.66 0.66 52.06 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 126.195 1.798 . . . . 0.0 110.81 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.45 -57.21 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.965 0 C-N-CA 129.297 3.039 . . . . 0.0 110.92 172.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.413 ' HG3' HG11 ' A' ' 5' ' ' VAL . 62.2 Cg_endo -70.05 -42.04 3.43 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 124.867 3.711 . . . . 0.0 113.919 171.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.3 -28.98 65.61 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.293 2.237 . . . . 0.0 114.941 -175.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -88.09 -11.08 48.12 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.589 1.156 . . . . 0.0 113.026 171.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -84.78 -20.37 31.13 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 125.527 1.531 . . . . 0.0 111.872 166.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.5 mt -93.42 -67.01 0.88 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.626 2.37 . . . . 0.0 111.03 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -96.78 -6.61 35.75 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 127.866 2.466 . . . . 0.0 112.518 -166.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.22 -78.73 0.52 Allowed Glycine 0 C--N 1.366 2.203 0 C-N-CA 125.074 1.321 . . . . 0.0 113.672 164.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.405 ' H ' ' H ' ' A' ' 24' ' ' SER . 10.1 t -153.2 -7.96 0.17 Allowed 'General case' 0 C--N 1.354 0.776 0 N-CA-C 106.528 -1.656 . . . . 0.0 106.528 -174.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.405 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.5 t -106.21 68.71 0.77 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.001 2.12 . . . . 0.0 105.66 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.86 128.88 48.32 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.013 1.725 . . . . 0.0 106.892 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.46 87.53 0.54 Allowed Glycine 0 C--N 1.362 2.005 0 N-CA-C 106.965 -2.454 . . . . 0.0 106.965 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.42 113.45 25.11 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.235 1.414 . . . . 0.0 109.704 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -124.03 140.36 53.04 Favored 'General case' 0 C--N 1.36 1.054 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -171.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 45.3 t -121.24 113.62 20.21 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.6 mmm -124.23 123.62 40.66 Favored 'General case' 0 C--N 1.359 1.003 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 79.23 -85.73 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.463 2.305 . . . . 0.0 110.266 175.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.76 54.12 0.19 Allowed Glycine 0 N--CA 1.433 -1.522 0 N-CA-C 105.453 -3.059 . . . . 0.0 105.453 169.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -154.02 154.35 33.57 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.2 t -106.1 147.15 29.28 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.368 2.267 . . . . 0.0 109.407 -164.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -126.81 141.06 51.93 Favored 'General case' 0 CA--C 1.501 -0.916 0 C-N-CA 126.165 1.786 . . . . 0.0 106.794 173.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.4 m -123.56 124.42 42.77 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -123.83 -159.38 0.86 Allowed 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -131.99 86.91 2.38 Favored 'General case' 0 C--N 1.359 1.011 0 N-CA-C 106.449 -1.685 . . . . 0.0 106.449 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -113.61 98.72 7.23 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 173.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.362 0 CA-C-N 116.245 -0.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 40.0 p . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.434 HG23 ' HG2' ' A' ' 35' ' ' LYS . 88.1 mt -104.88 121.65 57.04 Favored 'Isoleucine or valine' 0 C--N 1.364 1.197 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 -170.266 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -105.38 -177.56 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.117 0 C-N-CA 125.938 1.695 . . . . 0.0 109.933 -172.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -127.26 75.93 1.62 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 124.918 1.287 . . . . 0.0 107.686 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 t -126.76 125.66 67.28 Favored 'Isoleucine or valine' 0 C--N 1.362 1.126 0 N-CA-C 103.909 -2.626 . . . . 0.0 103.909 173.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -80.58 133.13 35.73 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.13 1.772 . . . . 0.0 110.067 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.0 169.94 16.66 Favored 'General case' 0 C--N 1.357 0.934 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -166.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.49 22.07 0.72 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.918 -1.882 . . . . 0.0 105.918 174.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 p -170.06 149.51 3.37 Favored Pre-proline 0 C--N 1.36 1.044 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 -175.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -71.64 -16.64 30.16 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.317 3.345 . . . . 0.0 114.601 168.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -82.27 -3.43 55.19 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.931 2.093 . . . . 0.0 114.628 171.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -94.23 -5.81 46.05 Favored 'General case' 0 C--N 1.37 1.499 0 C-N-CA 127.319 2.248 . . . . 0.0 109.827 169.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.0 t -116.35 -13.05 11.03 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 126.921 2.089 . . . . 0.0 108.795 -177.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -86.25 -2.38 58.33 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 126.655 1.982 . . . . 0.0 110.604 172.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -79.15 -57.97 0.72 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.099 2.959 . . . . 0.0 111.389 171.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.18 -45.01 0.96 Allowed 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 124.984 3.789 . . . . 0.0 113.577 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.2 m -69.43 -28.93 66.55 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 127.296 2.238 . . . . 0.0 115.048 -177.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -88.05 -9.3 53.79 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.73 170.528 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -86.04 -23.28 26.84 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 125.651 1.58 . . . . 0.0 111.319 167.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.8 mt -87.99 -61.16 1.78 Allowed 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.785 2.434 . . . . 0.0 111.389 176.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -107.34 1.71 23.94 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.664 1.986 . . . . 0.0 112.323 -162.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.84 -82.79 0.75 Allowed Glycine 0 C--N 1.365 2.163 0 C-N-CA 125.163 1.363 . . . . 0.0 113.711 165.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.5 m -148.2 -6.75 0.42 Allowed 'General case' 0 C--N 1.355 0.81 0 C-N-CA 125.909 1.684 . . . . 0.0 106.797 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 23' ' ' SER . 22.0 t -102.65 77.89 1.65 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.392 2.277 . . . . 0.0 106.316 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -145.36 125.9 14.12 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.21 87.35 0.66 Allowed Glycine 0 C--N 1.366 2.208 0 N-CA-C 107.535 -2.226 . . . . 0.0 107.535 171.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.1 113.18 25.36 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 125.171 1.388 . . . . 0.0 110.71 -168.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -117.91 145.62 44.52 Favored 'General case' 0 C--N 1.363 1.177 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -125.09 112.95 17.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 105.469 -2.048 . . . . 0.0 105.469 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.85 123.91 41.49 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 104.4 -2.445 . . . . 0.0 104.4 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.0 m120 77.65 -84.03 0.03 OUTLIER 'General case' 0 C--N 1.383 2.027 0 C-N-CA 127.617 2.367 . . . . 0.0 111.09 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.64 55.44 0.16 Allowed Glycine 0 N--CA 1.433 -1.505 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 169.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -152.51 153.02 32.62 Favored 'General case' 0 C--N 1.364 1.197 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.0 t -104.99 142.98 33.82 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.347 2.259 . . . . 0.0 109.238 -165.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HG2' HG23 ' A' ' 2' ' ' ILE . 57.3 mtmt -125.63 145.53 50.11 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 126.031 1.732 . . . . 0.0 108.107 174.466 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 16.6 m -117.43 135.44 53.89 Favored 'General case' 0 C--N 1.36 1.049 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -117.44 -27.22 6.43 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.801 1.24 . . . . 0.0 109.097 -174.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 81.52 39.28 0.06 Allowed 'General case' 0 C--N 1.365 1.272 0 C-N-CA 128.376 2.67 . . . . 0.0 111.676 173.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -85.02 -79.99 0.22 Allowed 'General case' 0 C--N 1.357 0.929 0 C-N-CA 125.738 1.615 . . . . 0.0 110.011 -174.63 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.335 0 O-C-N 123.025 0.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 38.6 p . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.8 mt -125.44 129.29 72.94 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 N-CA-C 104.318 -2.475 . . . . 0.0 104.318 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.3 pt -106.68 -172.58 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.249 0 C-N-CA 125.385 1.474 . . . . 0.0 108.949 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -133.33 85.74 2.24 Favored 'General case' 0 C--N 1.361 1.085 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.0 t -131.42 129.45 62.15 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 N-CA-C 103.473 -2.788 . . . . 0.0 103.473 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -79.29 135.38 36.73 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 126.283 1.833 . . . . 0.0 110.187 -178.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.72 173.06 12.17 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -168.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.01 27.34 0.42 Allowed 'General case' 0 C--N 1.355 0.844 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 169.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.3 p -171.32 148.54 2.38 Favored Pre-proline 0 C--N 1.361 1.075 0 N-CA-C 105.1 -2.185 . . . . 0.0 105.1 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -70.7 -17.46 33.28 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 124.286 3.324 . . . . 0.0 114.857 169.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.63 -8.77 59.41 Favored 'General case' 0 C--N 1.368 1.392 0 C-N-CA 127.556 2.342 . . . . 0.0 114.204 172.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -93.96 -1.84 54.03 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 126.954 2.102 . . . . 0.0 110.193 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.8 t -118.51 -12.97 9.74 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 127.157 2.183 . . . . 0.0 108.209 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.3 m -83.47 -1.94 54.75 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 125.987 1.715 . . . . 0.0 112.099 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -80.99 -56.96 0.6 Allowed Pre-proline 0 C--N 1.361 1.067 0 C-N-CA 128.304 2.642 . . . . 0.0 111.358 171.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.26 -40.81 4.16 Favored 'Trans proline' 0 C--N 1.366 1.456 0 C-N-CA 124.78 3.653 . . . . 0.0 113.59 175.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.7 m -69.19 -31.87 70.78 Favored 'General case' 0 C--N 1.368 1.391 0 C-N-CA 127.787 2.435 . . . . 0.0 114.888 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -88.07 -6.01 58.16 Favored 'General case' 0 C--N 1.369 1.436 0 C-N-CA 124.852 1.261 . . . . 0.0 113.267 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -88.59 -20.31 25.16 Favored 'General case' 0 C--N 1.36 1.053 0 C-N-CA 125.906 1.682 . . . . 0.0 111.243 165.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.7 mt -93.1 -67.09 0.88 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.571 2.348 . . . . 0.0 111.119 178.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -95.56 -10.07 30.58 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 128.163 2.585 . . . . 0.0 112.121 -167.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.62 -79.55 0.39 Allowed Glycine 0 C--N 1.365 2.139 0 C-N-CA 125.01 1.29 . . . . 0.0 113.404 165.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.69 -13.38 0.44 Allowed 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.65 1.58 . . . . 0.0 107.071 -175.048 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 t -104.43 70.18 0.94 Allowed 'General case' 0 C--N 1.366 1.321 0 C-N-CA 126.862 2.065 . . . . 0.0 106.1 177.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.45 126.25 43.47 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.738 1.615 . . . . 0.0 106.826 -175.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.25 86.54 0.57 Allowed Glycine 0 C--N 1.361 1.95 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 171.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.36 114.73 26.83 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 125.185 1.394 . . . . 0.0 109.822 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -121.34 145.54 47.78 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -173.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.1 t -127.93 112.08 14.29 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 65.9 mtt -131.92 130.85 42.11 Favored 'General case' 0 C--N 1.359 1.009 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 79.36 -14.36 0.87 Allowed 'General case' 0 C--N 1.384 2.072 0 C-N-CA 126.869 2.068 . . . . 0.0 114.516 172.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.22 41.18 4.06 Favored Glycine 0 C--N 1.361 1.952 0 C-N-CA 127.36 2.41 . . . . 0.0 110.451 -171.101 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -148.54 151.33 34.92 Favored 'General case' 0 C--N 1.365 1.246 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.5 t -104.94 140.09 38.69 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.583 1.953 . . . . 0.0 109.462 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -121.76 140.53 52.23 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 126.128 1.771 . . . . 0.0 107.066 173.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.2 m -125.72 113.2 17.01 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -112.87 -155.86 0.58 Allowed 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 127.243 2.217 . . . . 0.0 106.767 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -133.76 103.55 5.92 Favored 'General case' 0 C--N 1.359 1.006 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -142.47 100.15 3.63 Favored 'General case' 0 C--N 1.355 0.835 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.401 0 CA-C-N 116.155 -0.475 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp -123.86 120.54 59.96 Favored 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 103.9 -2.63 . . . . 0.0 103.9 178.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -102.52 -179.73 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.318 0 C-N-CA 125.715 1.606 . . . . 0.0 110.013 -178.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -123.77 71.9 1.12 Allowed 'General case' 0 C--N 1.363 1.157 0 C-N-CA 125.075 1.35 . . . . 0.0 108.323 -173.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.469 HG11 ' HG3' ' A' ' 16' ' ' PRO . 14.1 t -128.94 131.18 68.44 Favored 'Isoleucine or valine' 0 C--N 1.362 1.111 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 173.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.73 140.18 30.71 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 125.868 1.667 . . . . 0.0 109.308 -173.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 p -146.3 168.56 20.78 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -168.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -153.38 26.02 0.52 Allowed 'General case' 0 C--N 1.355 0.848 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 167.388 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.4 p -167.46 148.22 4.88 Favored Pre-proline 0 C--N 1.361 1.068 0 N-CA-C 105.19 -2.152 . . . . 0.0 105.19 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -72.59 -14.74 27.52 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 123.966 3.111 . . . . 0.0 114.844 171.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -76.88 -15.97 59.54 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 127.234 2.214 . . . . 0.0 114.28 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -88.65 -3.76 58.71 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 127.262 2.225 . . . . 0.0 110.636 173.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.2 t -117.41 -13.84 10.36 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 127.556 2.342 . . . . 0.0 108.433 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -85.99 -1.85 57.73 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 126.184 1.793 . . . . 0.0 111.075 174.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -77.4 -59.01 0.9 Allowed Pre-proline 0 C--N 1.357 0.895 0 C-N-CA 129.006 2.923 . . . . 0.0 111.813 170.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.469 ' HG3' HG11 ' A' ' 5' ' ' VAL . 71.1 Cg_endo -71.32 -41.04 2.7 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 124.961 3.774 . . . . 0.0 113.676 174.892 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.47 -29.31 65.83 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 127.509 2.324 . . . . 0.0 114.566 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -88.06 -9.91 51.89 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 124.732 1.213 . . . . 0.0 113.103 171.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -85.5 -20.08 30.22 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 125.613 1.565 . . . . 0.0 111.706 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.1 mt -93.81 -66.53 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.681 2.393 . . . . 0.0 111.092 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -96.12 -7.63 35.44 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.875 2.47 . . . . 0.0 112.346 -167.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.14 -78.91 0.4 Allowed Glycine 0 C--N 1.364 2.125 0 C-N-CA 124.982 1.277 . . . . 0.0 113.445 165.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.7 t -153.06 -8.43 0.17 Allowed 'General case' 0 C--N 1.354 0.775 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 t -106.3 68.78 0.77 Allowed 'General case' 0 C--N 1.365 1.272 0 C-N-CA 126.947 2.099 . . . . 0.0 105.649 175.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.57 126.57 45.01 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 125.956 1.702 . . . . 0.0 106.725 -174.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.29 86.32 0.56 Allowed Glycine 0 C--N 1.361 1.962 0 N-CA-C 107.326 -2.31 . . . . 0.0 107.326 171.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.07 113.09 24.99 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.356 1.462 . . . . 0.0 109.534 -172.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -121.61 137.7 54.63 Favored 'General case' 0 C--N 1.36 1.032 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 -171.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.5 t -115.0 126.62 54.97 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 -177.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 95.9 mmm -110.42 69.14 0.68 Allowed 'General case' 0 C--N 1.359 1.02 0 N-CA-C 104.349 -2.463 . . . . 0.0 104.349 172.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -2.9 71.32 0.0 OUTLIER 'General case' 0 C--N 1.38 1.927 1 C-N-CA 134.678 5.191 . . . . 0.0 118.433 -172.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.48 -39.38 0.58 Allowed Glycine 0 C--N 1.354 1.545 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -164.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -154.06 158.27 40.26 Favored 'General case' 0 C--N 1.37 1.474 0 CA-C-N 119.443 1.622 . . . . 0.0 108.666 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -107.46 153.81 22.27 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 128.661 2.784 . . . . 0.0 109.688 -166.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -131.46 142.77 50.06 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.04 2.136 . . . . 0.0 106.896 175.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.1 m -125.6 122.58 36.87 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.301 1.04 . . . . 0.0 108.748 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -122.17 -160.72 0.89 Allowed 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 126.443 1.897 . . . . 0.0 105.911 179.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -131.63 89.39 2.7 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.5 m120 -135.32 86.58 2.26 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 105.192 -2.151 . . . . 0.0 105.192 175.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.438 0 CA-C-N 115.93 -0.577 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 63.3 m . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.408 HG23 ' HG2' ' A' ' 35' ' ' LYS . 72.1 mt -104.94 121.14 56.51 Favored 'Isoleucine or valine' 0 C--N 1.365 1.266 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 -171.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.8 pt -103.72 -176.55 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.597 1.559 . . . . 0.0 110.354 -173.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -127.41 79.86 1.92 Allowed 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -128.37 123.07 59.2 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.038 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 170.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -81.82 130.28 35.01 Favored 'General case' 0 C--N 1.366 1.285 0 C-N-CA 125.954 1.702 . . . . 0.0 109.651 -175.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.1 p -139.01 171.48 14.26 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -164.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.87 22.85 0.68 Allowed 'General case' 0 C--N 1.355 0.847 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 174.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.4 p -171.52 148.01 2.2 Favored Pre-proline 0 C--N 1.36 1.043 0 N-CA-C 105.526 -2.028 . . . . 0.0 105.526 -174.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -71.56 -13.63 30.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.632 3.554 . . . . 0.0 114.173 165.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -75.28 -16.15 60.46 Favored 'General case' 0 C--N 1.369 1.447 0 C-N-CA 128.35 2.66 . . . . 0.0 114.76 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -89.8 -12.05 40.35 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 128.225 2.61 . . . . 0.0 110.441 174.396 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.8 t -111.82 -12.92 13.75 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 126.797 2.039 . . . . 0.0 109.636 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.2 p -88.04 -1.22 57.86 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 125.613 1.565 . . . . 0.0 111.61 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -78.03 -58.49 0.85 Allowed Pre-proline 0 C--N 1.36 1.03 0 C-N-CA 128.586 2.754 . . . . 0.0 111.668 169.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.9 -43.92 2.27 Favored 'Trans proline' 0 C--N 1.365 1.438 0 C-N-CA 124.98 3.787 . . . . 0.0 113.198 177.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 66.0 m -67.58 -33.58 75.3 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 128.26 2.624 . . . . 0.0 115.411 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -88.06 -5.04 58.69 Favored 'General case' 0 C--N 1.37 1.465 0 CA-C-N 119.628 1.103 . . . . 0.0 113.337 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -88.97 -23.44 22.65 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.97 1.708 . . . . 0.0 111.628 164.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.6 mt -90.77 -64.14 1.17 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 127.41 2.284 . . . . 0.0 111.611 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -90.05 -32.82 16.56 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.154 2.581 . . . . 0.0 110.797 -168.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.66 92.6 1.37 Allowed Glycine 0 C--N 1.364 2.116 0 C-N-CA 124.966 1.27 . . . . 0.0 114.299 163.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . 0.259 20.1 m 83.57 -53.01 0.15 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 128.439 2.696 . . . . 0.0 114.554 169.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.1 t -109.31 71.74 0.78 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 126.652 1.981 . . . . 0.0 107.103 -177.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.96 146.84 34.55 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 125.559 1.544 . . . . 0.0 107.572 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.5 89.44 0.78 Allowed Glycine 0 C--N 1.359 1.854 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.46 115.94 28.12 Favored 'General case' 0 C--N 1.355 0.827 0 C-N-CA 125.283 1.433 . . . . 0.0 109.438 -172.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.6 mtpt -122.81 140.29 53.09 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.1 t -119.44 110.45 16.94 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -120.05 122.91 42.14 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 178.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.44 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.635 2.374 . . . . 0.0 111.195 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.15 55.27 0.18 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 105.38 -3.088 . . . . 0.0 105.38 169.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -153.67 152.2 30.55 Favored 'General case' 0 C--N 1.364 1.203 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 176.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.2 t -105.22 143.15 33.8 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 127.119 2.167 . . . . 0.0 109.214 -166.021 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG2' HG23 ' A' ' 2' ' ' ILE . 54.0 mtmt -122.06 148.15 45.22 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 126.045 1.738 . . . . 0.0 107.232 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 m -126.02 133.69 51.67 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -132.89 -160.13 1.02 Allowed 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 104.561 -2.385 . . . . 0.0 104.561 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -135.12 62.06 1.65 Allowed 'General case' 0 C--N 1.36 1.062 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -102.17 121.01 41.4 Favored 'General case' 0 C--N 1.358 0.954 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 178.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 44.8 p . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 110.711 -0.107 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.9 mt -130.0 126.33 61.9 Favored 'Isoleucine or valine' 0 C--N 1.364 1.224 0 N-CA-C 104.398 -2.445 . . . . 0.0 104.398 -177.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -111.53 -171.65 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.631 1.572 . . . . 0.0 108.305 174.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -131.45 82.01 2.01 Favored 'General case' 0 C--N 1.364 1.22 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.448 HG11 ' HG3' ' A' ' 16' ' ' PRO . 9.0 t -132.89 130.0 58.37 Favored 'Isoleucine or valine' 0 C--N 1.361 1.092 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 171.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.68 135.05 35.53 Favored 'General case' 0 C--N 1.366 1.297 0 C-N-CA 125.866 1.666 . . . . 0.0 110.357 -177.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.2 p -143.72 171.8 13.7 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -168.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -153.72 27.28 0.49 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 105.307 -2.109 . . . . 0.0 105.307 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 76.1 p -170.71 149.16 2.84 Favored Pre-proline 0 C--N 1.36 1.04 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -71.69 -13.1 29.58 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 124.46 3.44 . . . . 0.0 114.081 167.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.05 -13.72 59.92 Favored 'General case' 0 C--N 1.371 1.501 0 C-N-CA 128.793 2.837 . . . . 0.0 113.915 172.001 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -98.17 0.71 46.42 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 127.719 2.408 . . . . 0.0 109.913 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.5 t -122.51 -17.5 6.97 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 126.504 1.922 . . . . 0.0 108.669 -175.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 p -87.04 1.58 52.41 Favored 'General case' 0 C--N 1.369 1.416 0 O-C-N 120.155 -1.591 . . . . 0.0 111.095 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.86 -56.81 0.54 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 129.67 3.188 . . . . 0.0 110.942 170.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.448 ' HG3' HG11 ' A' ' 5' ' ' VAL . 55.6 Cg_endo -67.35 -46.8 2.59 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 124.863 3.709 . . . . 0.0 113.646 171.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -62.87 -37.79 88.28 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.984 2.514 . . . . 0.0 115.517 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.1 -3.25 58.91 Favored 'General case' 0 C--N 1.368 1.4 0 C-N-CA 125.012 1.325 . . . . 0.0 113.447 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -89.02 -25.85 21.76 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 125.401 1.48 . . . . 0.0 111.911 162.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.5 mt -94.58 -61.85 1.43 Allowed 'General case' 0 C--N 1.367 1.332 0 C-N-CA 127.044 2.137 . . . . 0.0 112.844 -173.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -91.41 -33.59 15.19 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 127.092 2.157 . . . . 0.0 112.416 -161.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 173.88 -113.39 0.46 Allowed Glycine 0 C--N 1.356 1.661 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 176.542 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -148.52 -10.5 0.36 Allowed 'General case' 0 C--N 1.356 0.877 0 C-N-CA 126.258 1.823 . . . . 0.0 106.51 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -128.54 73.87 1.52 Allowed 'General case' 0 C--N 1.362 1.116 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.88 153.37 19.91 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.908 1.683 . . . . 0.0 108.687 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.55 87.35 0.94 Allowed Glycine 0 C--N 1.364 2.124 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.75 115.82 28.09 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 125.239 1.416 . . . . 0.0 109.459 -171.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -124.91 140.6 52.77 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 -172.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -121.33 114.7 21.71 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 -178.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -124.94 124.14 41.4 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 78.41 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.007 0 C-N-CA 127.592 2.357 . . . . 0.0 110.916 176.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.6 54.34 0.18 Allowed Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 105.48 -3.048 . . . . 0.0 105.48 168.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -153.99 151.74 29.73 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 105.631 -1.989 . . . . 0.0 105.631 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.5 t -104.96 145.92 29.76 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 127.44 2.296 . . . . 0.0 109.067 -164.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -125.77 138.86 53.87 Favored 'General case' 0 CA--C 1.499 -1.003 0 C-N-CA 126.34 1.856 . . . . 0.0 106.441 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 66.5 m -125.5 116.11 21.28 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.286 1.034 . . . . 0.0 108.717 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -116.16 -167.92 1.35 Allowed 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.197 2.199 . . . . 0.0 106.536 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -126.97 78.1 1.78 Allowed 'General case' 0 C--N 1.36 1.037 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.7 m120 -117.85 -97.33 0.46 Allowed 'General case' 0 C--N 1.357 0.934 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 176.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.39 0 CA-C-N 117.822 0.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.9 mt -127.84 120.9 55.19 Favored 'Isoleucine or valine' 0 C--N 1.365 1.28 0 N-CA-C 103.106 -2.924 . . . . 0.0 103.106 177.057 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.0 pt -105.8 -175.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.269 0 C-N-CA 125.307 1.443 . . . . 0.0 109.445 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -129.63 78.42 1.85 Allowed 'General case' 0 C--N 1.362 1.114 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.66 127.62 66.9 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 N-CA-C 103.772 -2.677 . . . . 0.0 103.772 172.557 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -80.35 132.84 35.85 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.218 1.807 . . . . 0.0 110.409 -176.116 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.8 p -142.85 173.13 11.82 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 123.219 1.485 . . . . 0.0 109.009 -165.938 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 96.3 m -142.05 -52.73 0.42 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 102.625 -3.102 . . . . 0.0 102.625 -168.634 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.7 p -107.98 162.74 18.82 Favored Pre-proline 0 C--N 1.362 1.127 0 C-N-CA 127.635 2.374 . . . . 0.0 109.351 179.018 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -72.12 -18.35 27.32 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.685 3.59 . . . . 0.0 114.417 164.27 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.43 -2.29 48.96 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.735 2.014 . . . . 0.0 114.505 171.759 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -93.13 -10.27 36.52 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.162 2.585 . . . . 0.0 109.773 169.762 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.6 t -112.74 -14.67 13.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 127.511 2.324 . . . . 0.0 108.159 -177.031 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -82.91 -0.69 49.6 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 126.749 2.019 . . . . 0.0 111.25 173.426 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -82.09 -57.65 0.49 Allowed Pre-proline 0 N--CA 1.439 -1.01 0 C-N-CA 129.272 3.029 . . . . 0.0 110.881 172.78 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.07 -43.69 3.07 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 124.911 3.741 . . . . 0.0 113.796 171.411 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -68.1 -30.39 69.54 Favored 'General case' 0 C--N 1.367 1.36 0 C-N-CA 127.138 2.175 . . . . 0.0 115.215 -176.01 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -88.05 -9.31 53.78 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.946 1.298 . . . . 0.0 113.076 173.108 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -87.5 -22.13 25.07 Favored 'General case' 0 C--N 1.362 1.114 0 C-N-CA 125.917 1.687 . . . . 0.0 112.219 165.735 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.8 mt -96.54 -71.13 0.69 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.214 2.206 . . . . 0.0 110.756 -177.336 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -89.45 -25.89 21.25 Favored 'General case' 0 C--N 1.361 1.102 0 C-N-CA 128.568 2.747 . . . . 0.0 111.531 -169.851 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.73 -155.86 20.14 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 125.669 1.604 . . . . 0.0 109.826 177.333 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.4 m -72.46 -4.51 30.72 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 128.337 2.655 . . . . 0.0 114.911 179.661 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.7 t -104.52 71.78 1.01 Allowed 'General case' 0 C--N 1.365 1.245 0 C-N-CA 127.261 2.224 . . . . 0.0 105.73 165.014 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.46 127.07 36.63 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.6 87.45 0.65 Allowed Glycine 0 C--N 1.361 1.96 0 N-CA-C 107.085 -2.406 . . . . 0.0 107.085 170.956 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.81 111.37 23.16 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.473 1.509 . . . . 0.0 109.754 -170.342 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -120.81 141.63 50.36 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -170.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.2 t -122.59 111.77 17.18 Favored 'General case' 0 C--N 1.352 0.675 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 -178.194 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.8 mmm -120.59 124.79 46.15 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 104.415 -2.439 . . . . 0.0 104.415 178.55 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.47 12.5 p30 70.41 -79.07 0.04 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 128.647 2.779 . . . . 0.0 113.596 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.23 54.0 0.14 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.854 -2.898 . . . . 0.0 105.854 169.466 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -153.23 151.49 30.13 Favored 'General case' 0 C--N 1.361 1.095 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 176.428 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.11 144.37 32.0 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.212 2.205 . . . . 0.0 109.295 -163.656 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -124.99 140.63 52.75 Favored 'General case' 0 CA--C 1.501 -0.912 0 C-N-CA 126.01 1.724 . . . . 0.0 107.027 174.219 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -125.31 110.79 14.42 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.307 1.043 . . . . 0.0 108.492 179.014 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -107.78 -161.42 0.78 Allowed 'General case' 0 C--N 1.357 0.928 0 C-N-CA 127.23 2.212 . . . . 0.0 106.829 177.462 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -132.29 95.72 3.71 Favored 'General case' 0 C--N 1.36 1.025 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 178.791 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.3 m120 -139.63 100.35 3.94 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.01 -2.218 . . . . 0.0 105.01 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.425 0 CA-C-N 116.1 -0.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 122.081 0.943 . . . . 0.0 109.809 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt -121.78 117.43 52.45 Favored 'Isoleucine or valine' 0 C--N 1.361 1.098 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 174.8 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.7 pt -101.01 -172.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.286 0 C-N-CA 125.422 1.489 . . . . 0.0 109.644 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -133.38 73.15 1.5 Allowed 'General case' 0 C--N 1.36 1.049 0 C-N-CA 124.424 1.09 . . . . 0.0 108.669 -173.1 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.8 t -125.32 125.48 69.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -88.77 125.0 34.68 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 125.264 1.426 . . . . 0.0 108.813 -171.107 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 p -131.37 176.09 8.58 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.177 0.991 . . . . 0.0 109.314 -162.931 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.84 23.27 0.45 Allowed 'General case' 0 C--N 1.356 0.88 0 N-CA-C 105.734 -1.951 . . . . 0.0 105.734 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -173.47 149.56 1.67 Allowed Pre-proline 0 C--N 1.359 1.002 0 N-CA-C 105.118 -2.179 . . . . 0.0 105.118 -173.59 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -70.58 -17.33 33.9 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.538 3.492 . . . . 0.0 114.36 167.847 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -78.02 -14.28 59.57 Favored 'General case' 0 C--N 1.37 1.473 0 C-N-CA 128.584 2.754 . . . . 0.0 114.001 174.765 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -88.66 -11.44 45.29 Favored 'General case' 0 C--N 1.372 1.574 0 C-N-CA 127.852 2.461 . . . . 0.0 110.263 172.266 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.5 t -109.08 -13.41 14.7 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.04 2.136 . . . . 0.0 109.135 -179.144 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -84.8 -0.41 53.77 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.021 1.728 . . . . 0.0 111.202 173.714 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -80.09 -59.06 0.56 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.108 2.963 . . . . 0.0 111.266 171.21 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -70.88 -41.77 2.65 Favored 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 125.023 3.815 . . . . 0.0 113.509 174.663 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.59 -30.06 66.65 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 127.482 2.313 . . . . 0.0 114.941 -176.621 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -88.07 -8.94 54.79 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.823 1.192 . . . . 0.0 112.792 171.975 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -86.27 -21.37 27.39 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.836 1.654 . . . . 0.0 111.586 166.471 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.9 mt -91.92 -66.27 0.94 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 127.563 2.345 . . . . 0.0 111.023 178.006 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.16 -8.57 29.75 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.863 2.465 . . . . 0.0 112.263 -167.179 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.38 -79.64 0.58 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 125.099 1.333 . . . . 0.0 113.655 164.92 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.8 m -147.97 -7.13 0.43 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.005 1.722 . . . . 0.0 107.225 -174.683 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.3 t -108.73 66.6 0.64 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 126.733 2.013 . . . . 0.0 105.886 177.372 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.58 125.31 42.98 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.715 1.606 . . . . 0.0 106.838 -175.871 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.16 83.59 0.43 Allowed Glycine 0 C--N 1.362 2.018 0 N-CA-C 106.897 -2.481 . . . . 0.0 106.897 170.177 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.89 113.59 25.34 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.291 1.437 . . . . 0.0 110.172 -168.427 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -119.78 149.28 42.3 Favored 'General case' 0 CA--C 1.495 -1.148 0 C-N-CA 125.197 1.399 . . . . 0.0 108.026 -171.165 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -131.33 115.34 16.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 -179.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 94.7 mtp -124.34 127.37 47.49 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 173.527 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.44 -83.31 0.02 OUTLIER 'General case' 0 C--N 1.384 2.104 0 C-N-CA 127.562 2.345 . . . . 0.0 110.533 174.518 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.54 57.14 0.11 Allowed Glycine 0 N--CA 1.43 -1.756 0 N-CA-C 105.558 -3.017 . . . . 0.0 105.558 167.527 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -152.09 150.21 29.66 Favored 'General case' 0 C--N 1.365 1.25 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 175.758 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -105.04 142.88 34.04 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.28 2.232 . . . . 0.0 109.555 -164.747 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -123.58 140.6 52.83 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.83 1.652 . . . . 0.0 107.315 173.008 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -120.62 119.26 32.35 Favored 'General case' 0 C--N 1.361 1.082 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.385 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -117.5 -168.0 1.42 Allowed 'General case' 0 N--CA 1.438 -1.061 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 178.039 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -126.18 89.38 3.0 Favored 'General case' 0 C--N 1.36 1.022 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -177.703 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -137.74 94.85 2.95 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 177.494 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.385 0 CA-C-N 116.063 -0.517 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.0 mt -124.8 119.66 56.66 Favored 'Isoleucine or valine' 0 C--N 1.366 1.304 0 N-CA-C 103.064 -2.939 . . . . 0.0 103.064 176.344 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.1 pt -103.78 -175.85 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.248 0 C-N-CA 125.12 1.368 . . . . 0.0 109.679 -179.88 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -128.73 78.69 1.86 Allowed 'General case' 0 C--N 1.362 1.12 0 C-N-CA 124.913 1.285 . . . . 0.0 107.589 -175.061 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.26 124.37 62.11 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -80.87 134.94 35.84 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 126.904 2.082 . . . . 0.0 110.125 -177.87 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.3 p -142.33 -179.18 6.12 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.726 0.774 . . . . 0.0 110.079 -164.253 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.5 t -148.94 18.64 0.99 Allowed 'General case' 0 C--N 1.355 0.839 0 C-N-CA 126.064 1.746 . . . . 0.0 106.772 168.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.2 p -172.96 155.96 3.03 Favored Pre-proline 0 C--N 1.363 1.189 0 C-N-CA 124.651 1.181 . . . . 0.0 108.196 -172.705 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -69.75 -18.22 37.17 Favored 'Trans proline' 0 C--N 1.361 1.198 1 C-N-CA 125.395 4.064 . . . . 0.0 114.804 163.224 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -76.09 -17.11 59.76 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 128.161 2.584 . . . . 0.0 113.744 174.65 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.5 tp60 -91.6 -7.86 48.94 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 128.499 2.72 . . . . 0.0 110.179 174.293 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 t -109.06 -13.54 14.69 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.522 2.329 . . . . 0.0 109.144 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.1 m -84.39 -1.88 56.24 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 126.332 1.853 . . . . 0.0 111.295 174.511 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -79.95 -59.37 0.55 Allowed Pre-proline 0 C--N 1.357 0.907 0 C-N-CA 129.331 3.053 . . . . 0.0 111.314 171.744 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -70.61 -41.02 3.47 Favored 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 125.114 3.876 . . . . 0.0 113.584 175.332 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.12 -31.44 70.13 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 127.684 2.394 . . . . 0.0 114.735 -177.85 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.08 -6.4 57.95 Favored 'General case' 0 C--N 1.37 1.486 0 C-N-CA 124.651 1.18 . . . . 0.0 113.2 172.396 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -88.65 -20.44 24.91 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.68 1.592 . . . . 0.0 111.471 165.632 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -93.36 -66.88 0.89 Allowed 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.506 2.322 . . . . 0.0 111.111 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -92.68 -14.92 27.4 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 128.181 2.592 . . . . 0.0 111.705 -169.416 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.0 -74.29 0.29 Allowed Glycine 0 C--N 1.365 2.154 0 C-N-CA 124.9 1.238 . . . . 0.0 113.746 163.734 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.39 -35.22 0.47 Allowed 'General case' 0 C--N 1.354 0.766 0 C-N-CA 125.588 1.555 . . . . 0.0 107.13 -169.882 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.8 t -93.14 75.64 4.66 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.823 2.449 . . . . 0.0 108.034 176.466 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.53 121.15 28.16 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 -177.24 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.36 85.08 0.78 Allowed Glycine 0 C--N 1.364 2.104 0 N-CA-C 107.783 -2.127 . . . . 0.0 107.783 172.194 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.65 114.55 27.14 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 125.556 1.542 . . . . 0.0 109.843 -170.841 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -123.99 143.21 50.55 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 -172.654 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.8 113.38 8.54 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -176.696 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.5 mmt -115.0 122.32 45.85 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 -175.003 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 77.92 -83.91 0.03 OUTLIER 'General case' 0 C--N 1.38 1.895 0 C-N-CA 127.491 2.316 . . . . 0.0 111.152 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.76 49.44 0.25 Allowed Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 107.194 -2.362 . . . . 0.0 107.194 170.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.9 mttm -151.28 149.25 29.15 Favored 'General case' 0 C--N 1.367 1.343 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.173 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -104.97 150.11 25.19 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.91 2.484 . . . . 0.0 110.076 -161.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -132.31 138.39 47.8 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.559 1.943 . . . . 0.0 106.035 177.743 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.4 m -124.41 113.43 18.16 Favored 'General case' 0 C--N 1.359 1.001 0 C-N-CA 124.336 1.054 . . . . 0.0 108.685 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -113.0 -148.36 0.43 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 127.112 2.165 . . . . 0.0 106.311 178.312 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -133.77 155.93 48.91 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 175.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -86.98 121.09 28.96 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 172.351 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 122.069 0.938 . . . . 0.0 109.837 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.9 mt -123.75 115.7 45.96 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 174.647 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.6 pt -99.88 -177.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.382 0 C-N-CA 125.367 1.467 . . . . 0.0 109.777 -179.094 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -127.36 77.58 1.75 Allowed 'General case' 0 C--N 1.362 1.123 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -173.853 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.7 t -128.63 125.44 63.51 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.535 -2.395 . . . . 0.0 104.535 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -78.27 138.78 38.78 Favored 'General case' 0 C--N 1.367 1.338 0 C-N-CA 127.091 2.156 . . . . 0.0 110.914 -177.705 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 p -147.96 -176.35 5.24 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-O 121.421 0.629 . . . . 0.0 109.606 -166.865 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.11 27.3 0.42 Allowed 'General case' 0 C--N 1.359 0.984 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 163.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.9 p -174.44 151.25 1.57 Allowed Pre-proline 0 C--N 1.364 1.213 0 C-N-CA 124.669 1.188 . . . . 0.0 108.137 -170.272 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -69.12 -17.15 40.62 Favored 'Trans proline' 0 C--N 1.361 1.185 1 C-N-CA 125.333 4.022 . . . . 0.0 115.305 165.059 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.02 6.89 33.83 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 126.093 1.757 . . . . 0.0 113.746 172.385 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -113.0 25.42 11.41 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 126.917 2.087 . . . . 0.0 107.366 167.129 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.9 t -145.2 -18.26 0.49 Allowed 'General case' 0 C--N 1.356 0.857 0 C-N-CA 126.329 1.852 . . . . 0.0 109.549 -175.547 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -88.02 1.26 54.62 Favored 'General case' 0 C--N 1.37 1.496 0 CA-C-N 121.147 1.794 . . . . 0.0 110.464 177.26 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -82.79 -55.34 0.53 Allowed Pre-proline 0 C--N 1.359 1.011 0 C-N-CA 129.346 3.058 . . . . 0.0 110.955 171.155 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.83 -39.09 6.77 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 124.99 3.793 . . . . 0.0 113.79 172.724 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.8 m -70.18 -29.42 66.29 Favored 'General case' 0 C--N 1.367 1.347 0 C-N-CA 127.601 2.36 . . . . 0.0 114.828 -179.394 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -88.08 -8.27 55.75 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.922 1.289 . . . . 0.0 113.204 170.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -87.71 -20.42 26.25 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 125.797 1.639 . . . . 0.0 111.157 167.394 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.3 mt -92.91 -66.47 0.92 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.663 2.385 . . . . 0.0 111.016 177.578 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.42 -7.48 31.6 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.682 2.393 . . . . 0.0 112.447 -167.055 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.56 -80.75 0.52 Allowed Glycine 0 C--N 1.364 2.1 0 C-N-CA 124.953 1.263 . . . . 0.0 113.738 165.318 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.29 -11.2 0.42 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.762 1.625 . . . . 0.0 107.167 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t -105.78 70.59 0.87 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 126.811 2.045 . . . . 0.0 105.842 176.694 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.81 129.39 48.21 Favored 'General case' 0 C--N 1.36 1.033 0 C-N-CA 125.718 1.607 . . . . 0.0 107.042 -174.255 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 89.37 0.61 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.208 -2.357 . . . . 0.0 107.208 171.39 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.48 115.66 27.87 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 125.253 1.421 . . . . 0.0 109.653 -173.286 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -128.89 142.97 50.78 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 -171.501 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.7 115.37 9.07 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -174.236 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 92.1 mtp -113.29 121.92 45.86 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 126.28 1.832 . . . . 0.0 106.183 -177.581 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 78.58 -84.34 0.02 OUTLIER 'General case' 0 C--N 1.38 1.899 0 C-N-CA 127.385 2.274 . . . . 0.0 111.332 173.769 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -165.11 48.95 0.28 Allowed Glycine 0 N--CA 1.434 -1.471 0 N-CA-C 107.54 -2.224 . . . . 0.0 107.54 171.71 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -151.75 150.86 30.66 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 171.078 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.01 154.05 20.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.016 2.526 . . . . 0.0 110.472 -162.193 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -134.74 140.81 46.22 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 126.623 1.969 . . . . 0.0 105.945 177.502 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -125.86 128.02 46.96 Favored 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.417 1.087 . . . . 0.0 108.067 178.247 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -128.42 -157.73 0.84 Allowed 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -177.841 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -132.66 89.81 2.69 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -115.82 99.44 7.3 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 105.002 -2.221 . . . . 0.0 105.002 172.897 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.377 0 CA-C-N 116.174 -0.466 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 81.3 p . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 122.035 0.921 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.3 mt -125.71 113.38 34.45 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 N-CA-C 102.832 -3.025 . . . . 0.0 102.832 175.303 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.6 pt -100.64 -179.05 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.17 -177.849 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -124.52 73.94 1.29 Allowed 'General case' 0 C--N 1.363 1.156 0 C-N-CA 124.952 1.301 . . . . 0.0 108.397 -173.071 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.41 HG11 ' HG3' ' A' ' 16' ' ' PRO . 12.6 t -128.96 126.51 64.76 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 174.009 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -84.26 140.96 31.31 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 126.424 1.89 . . . . 0.0 109.146 -175.944 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.96 -178.79 6.38 Favored 'General case' 0 C--N 1.357 0.909 0 CA-C-O 121.552 0.692 . . . . 0.0 110.41 -164.822 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -154.94 25.19 0.43 Allowed 'General case' 0 C--N 1.358 0.959 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 167.233 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.5 p -173.81 152.07 1.93 Allowed Pre-proline 0 C--N 1.365 1.274 0 C-N-CA 124.653 1.181 . . . . 0.0 107.975 -172.776 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -69.79 -17.89 37.18 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 125.269 3.98 . . . . 0.0 115.288 164.512 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.2 tptt -78.89 -13.74 59.63 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.676 1.99 . . . . 0.0 114.374 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -90.37 -3.71 57.54 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 127.239 2.215 . . . . 0.0 110.077 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.19 -14.15 12.33 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.285 2.234 . . . . 0.0 109.138 179.725 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -85.14 -3.77 58.92 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 126.071 1.748 . . . . 0.0 111.013 174.874 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -77.83 -59.33 0.8 Allowed Pre-proline 0 N--CA 1.441 -0.906 0 C-N-CA 129.408 3.083 . . . . 0.0 111.907 170.832 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.41 ' HG3' HG11 ' A' ' 5' ' ' VAL . 66.6 Cg_endo -71.14 -39.96 3.62 Favored 'Trans proline' 0 C--N 1.364 1.344 0 C-N-CA 125.138 3.892 . . . . 0.0 113.841 175.111 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.72 -29.7 66.04 Favored 'General case' 0 C--N 1.367 1.369 0 C-N-CA 127.487 2.315 . . . . 0.0 114.294 -177.115 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -88.04 -8.19 55.92 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 124.889 1.276 . . . . 0.0 113.143 171.615 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -87.07 -19.94 27.87 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 125.608 1.563 . . . . 0.0 111.443 165.924 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.4 mt -92.83 -66.51 0.92 Allowed 'General case' 0 C--N 1.364 1.227 0 C-N-CA 127.666 2.386 . . . . 0.0 111.122 178.211 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -95.53 -10.4 29.77 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.991 2.516 . . . . 0.0 112.247 -167.769 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.35 -79.97 0.37 Allowed Glycine 0 C--N 1.366 2.198 0 C-N-CA 124.863 1.221 . . . . 0.0 113.351 165.517 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.76 -14.01 0.43 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.661 1.584 . . . . 0.0 107.072 -174.968 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.7 t -104.56 70.1 0.93 Allowed 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.866 2.066 . . . . 0.0 106.146 176.816 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.1 122.89 38.47 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.134 1.774 . . . . 0.0 106.813 -176.276 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.23 84.01 0.68 Allowed Glycine 0 C--N 1.364 2.097 0 N-CA-C 107.597 -2.201 . . . . 0.0 107.597 171.718 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.86 115.8 28.45 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.298 1.439 . . . . 0.0 109.689 -171.932 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -122.57 145.55 48.24 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 102.984 -2.969 . . . . 0.0 102.984 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.89 132.05 28.09 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.747 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 96.8 mtp -105.46 73.39 1.02 Allowed 'General case' 0 C--N 1.359 1.009 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 175.259 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -0.76 68.28 0.0 OUTLIER 'General case' 0 C--N 1.378 1.813 1 C-N-CA 135.193 5.397 . . . . 0.0 118.537 -175.354 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 160.61 -42.24 0.43 Allowed Glycine 0 C--N 1.355 1.624 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -161.799 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -153.96 155.4 35.53 Favored 'General case' 0 C--N 1.37 1.482 0 CA-C-N 119.264 1.532 . . . . 0.0 109.369 179.74 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.8 t -107.02 153.63 22.31 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 129.275 3.03 . . . . 0.0 110.519 -165.266 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -133.37 137.18 45.75 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 126.79 2.036 . . . . 0.0 106.557 176.148 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 63.4 m -121.11 122.7 40.6 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 124.369 1.067 . . . . 0.0 108.721 177.935 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -123.63 -149.7 0.43 Allowed 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 178.758 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -133.26 156.73 47.03 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 105.761 -1.94 . . . . 0.0 105.761 177.034 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -88.31 124.34 33.8 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 171.564 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 90.4 m . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.8 mt -120.37 121.02 64.53 Favored 'Isoleucine or valine' 0 C--N 1.361 1.093 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 177.832 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.5 pt -103.15 -171.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.289 0 C-N-CA 125.538 1.535 . . . . 0.0 108.936 177.554 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -134.99 91.62 2.77 Favored 'General case' 0 C--N 1.36 1.046 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.941 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.46 124.37 48.37 Favored 'Isoleucine or valine' 0 C--N 1.359 1.007 0 N-CA-C 103.251 -2.87 . . . . 0.0 103.251 169.746 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -79.32 134.63 36.61 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 126.689 1.996 . . . . 0.0 109.814 -178.485 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.5 p -143.32 -177.87 5.59 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-O 121.505 0.669 . . . . 0.0 110.052 -163.453 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.3 t -152.42 22.29 0.63 Allowed 'General case' 0 C--N 1.358 0.948 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 168.556 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.2 p -173.49 151.84 2.03 Favored Pre-proline 0 C--N 1.364 1.237 0 C-N-CA 124.455 1.102 . . . . 0.0 108.28 -171.102 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -69.45 -17.79 38.79 Favored 'Trans proline' 0 C--N 1.36 1.177 1 C-N-CA 125.377 4.051 . . . . 0.0 115.153 164.139 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -77.91 -15.28 59.13 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.02 2.128 . . . . 0.0 114.455 172.483 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -89.67 -4.49 57.73 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 127.256 2.222 . . . . 0.0 110.005 171.749 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.5 t -113.18 -13.49 12.99 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 127.236 2.214 . . . . 0.0 109.245 178.923 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.4 m -85.29 -4.03 59.02 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 126.128 1.771 . . . . 0.0 111.057 174.6 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -78.61 -58.85 0.73 Allowed Pre-proline 0 C--N 1.356 0.882 0 C-N-CA 129.499 3.119 . . . . 0.0 111.7 171.05 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.21 -42.23 3.11 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 125.253 3.969 . . . . 0.0 113.725 174.833 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -69.43 -30.77 68.78 Favored 'General case' 0 C--N 1.367 1.367 0 C-N-CA 127.451 2.3 . . . . 0.0 114.888 -177.458 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -87.97 -7.02 57.7 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 124.817 1.247 . . . . 0.0 113.495 171.915 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -85.79 -25.74 26.16 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 125.913 1.685 . . . . 0.0 110.956 165.317 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.7 mt -89.36 -63.3 1.31 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.553 2.341 . . . . 0.0 111.781 179.706 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.77 -8.84 25.31 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.786 2.434 . . . . 0.0 111.898 -167.495 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.14 -79.94 0.48 Allowed Glycine 0 C--N 1.365 2.189 0 C-N-CA 125.048 1.309 . . . . 0.0 113.551 165.237 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -147.31 -11.45 0.42 Allowed 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.711 1.604 . . . . 0.0 106.98 -175.43 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -105.26 69.51 0.85 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 126.887 2.075 . . . . 0.0 106.132 177.388 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.22 128.13 46.73 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 125.842 1.657 . . . . 0.0 106.723 -175.956 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.18 86.03 0.5 Allowed Glycine 0 C--N 1.362 1.975 0 N-CA-C 107.017 -2.433 . . . . 0.0 107.017 170.999 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.84 113.8 25.91 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 125.14 1.376 . . . . 0.0 109.832 -171.483 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -121.52 144.13 48.89 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 -173.595 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.82 110.76 6.23 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 -178.491 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.7 mtt -115.26 126.06 54.06 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.751 2.02 . . . . 0.0 105.695 -175.797 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 t30 81.67 -85.64 0.02 OUTLIER 'General case' 0 C--N 1.382 1.991 0 C-N-CA 127.32 2.248 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -168.86 50.84 0.22 Allowed Glycine 0 N--CA 1.433 -1.525 0 N-CA-C 106.527 -2.629 . . . . 0.0 106.527 169.363 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -151.41 149.98 29.91 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 174.595 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.4 t -104.94 150.06 25.21 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 127.686 2.395 . . . . 0.0 110.368 -162.785 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -132.36 138.88 47.9 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 126.812 2.045 . . . . 0.0 106.395 177.111 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -123.16 121.99 37.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 124.334 1.053 . . . . 0.0 108.546 178.087 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -120.6 -158.98 0.77 Allowed 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.156 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -133.32 89.14 2.57 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 -178.708 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -115.87 100.59 8.1 Favored 'General case' 0 C--N 1.358 0.963 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 173.479 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.397 0 CA-C-N 116.247 -0.433 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 121.548 0.689 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 57.1 mt -105.07 124.08 59.58 Favored 'Isoleucine or valine' 0 C--N 1.363 1.193 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 178.598 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.7 pt -100.87 -171.62 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 126.098 1.759 . . . . 0.0 110.111 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -130.99 82.46 2.05 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -176.309 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 t -132.84 128.05 56.44 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.56 -2.755 . . . . 0.0 103.56 172.301 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -83.03 132.0 35.15 Favored 'General case' 0 C--N 1.364 1.234 0 C-N-CA 126.084 1.754 . . . . 0.0 109.551 -177.328 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -140.83 170.03 16.51 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -166.018 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -152.14 25.91 0.62 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 170.577 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -168.73 149.31 4.23 Favored Pre-proline 0 C--N 1.36 1.032 0 N-CA-C 105.175 -2.158 . . . . 0.0 105.175 -177.686 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -71.43 -15.48 31.06 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.469 3.446 . . . . 0.0 114.394 168.422 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.43 -11.65 59.96 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.047 2.539 . . . . 0.0 113.736 172.24 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -94.24 -3.93 49.8 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.509 2.324 . . . . 0.0 110.138 173.478 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.5 t -118.12 -13.41 9.95 Favored 'General case' 0 C--N 1.36 1.061 0 C-N-CA 126.886 2.074 . . . . 0.0 108.895 -177.383 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -88.03 1.0 55.26 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 125.897 1.679 . . . . 0.0 110.949 172.651 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -79.69 -58.8 0.61 Allowed Pre-proline 0 C--N 1.359 1.003 0 C-N-CA 129.165 2.986 . . . . 0.0 111.592 170.871 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.23 -40.02 3.49 Favored 'Trans proline' 0 C--N 1.365 1.404 0 C-N-CA 125.024 3.816 . . . . 0.0 113.668 175.829 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -74.3 -25.67 59.72 Favored 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.591 2.356 . . . . 0.0 114.669 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.13 -8.16 55.84 Favored 'General case' 0 C--N 1.371 1.531 0 CA-C-N 120.15 1.341 . . . . 0.0 113.248 168.122 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -86.91 -19.71 28.45 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 125.565 1.546 . . . . 0.0 111.398 166.56 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.9 mt -93.54 -65.92 0.96 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.575 2.35 . . . . 0.0 111.133 177.606 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -95.41 -6.73 40.23 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 127.797 2.439 . . . . 0.0 112.35 -167.407 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.64 -80.11 0.45 Allowed Glycine 0 C--N 1.365 2.188 0 C-N-CA 125.103 1.335 . . . . 0.0 113.392 165.459 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.7 m -146.68 -5.87 0.54 Allowed 'General case' 0 C--N 1.353 0.745 0 C-N-CA 125.722 1.609 . . . . 0.0 106.903 -177.164 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -102.22 73.24 1.34 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.092 2.157 . . . . 0.0 106.907 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -152.02 116.55 5.06 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.253 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -108.97 72.61 0.2 Allowed Glycine 0 C--N 1.36 1.862 0 N-CA-C 106.481 -2.648 . . . . 0.0 106.481 169.035 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.11 140.54 34.98 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 128.366 2.666 . . . . 0.0 111.484 -167.662 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -122.13 142.97 49.83 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.787 1.235 . . . . 0.0 107.79 -163.41 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.5 t -117.91 103.73 10.23 Favored 'General case' 0 C--N 1.353 0.732 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 178.845 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.7 mtp -111.83 121.94 46.43 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 176.975 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 78.32 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.383 2.051 0 C-N-CA 127.781 2.432 . . . . 0.0 110.706 178.618 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 53.56 0.18 Allowed Glycine 0 N--CA 1.433 -1.5 0 N-CA-C 105.299 -3.121 . . . . 0.0 105.299 168.574 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -151.88 151.82 31.78 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 179.031 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.98 141.2 36.99 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 126.497 1.919 . . . . 0.0 109.907 -163.296 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -120.08 146.64 45.73 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.669 1.988 . . . . 0.0 106.746 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.1 m -117.13 137.7 52.13 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.114 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -132.41 -179.98 5.77 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 105.112 -2.181 . . . . 0.0 105.112 -178.554 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -126.34 88.01 2.77 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 -177.545 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -131.5 98.66 4.57 Favored 'General case' 0 C--N 1.357 0.893 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 178.505 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.377 0 CA-C-N 116.133 -0.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.438 HG23 ' HG2' ' A' ' 35' ' ' LYS . 98.3 mt -105.05 126.44 60.01 Favored 'Isoleucine or valine' 0 C--N 1.368 1.389 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 -176.531 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.3 pt -106.13 -174.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.037 0 C-N-CA 125.751 1.62 . . . . 0.0 110.093 -172.622 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -130.1 82.34 2.06 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -177.206 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 t -130.79 126.17 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.123 0 N-CA-C 103.101 -2.926 . . . . 0.0 103.101 171.457 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -83.23 131.59 35.09 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 125.673 1.589 . . . . 0.0 109.519 -175.953 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.8 p -138.72 171.84 13.75 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -165.941 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -152.88 26.73 0.55 Allowed 'General case' 0 C--N 1.356 0.886 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 170.202 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.8 p -170.18 148.39 2.98 Favored Pre-proline 0 C--N 1.36 1.056 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -177.443 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -71.14 -16.29 31.91 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 124.293 3.329 . . . . 0.0 114.801 168.965 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -84.08 -0.36 51.51 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.564 1.946 . . . . 0.0 114.449 171.525 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -97.17 -0.64 46.54 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 127.115 2.166 . . . . 0.0 109.619 168.118 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.6 t -122.69 -12.52 8.08 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 127.013 2.125 . . . . 0.0 108.866 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -87.68 1.11 54.64 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 126.797 2.039 . . . . 0.0 110.16 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -81.4 -58.73 0.48 Allowed Pre-proline 0 N--CA 1.44 -0.957 0 C-N-CA 129.347 3.059 . . . . 0.0 111.096 171.342 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -71.52 -40.33 3.04 Favored 'Trans proline' 0 C--N 1.364 1.393 0 C-N-CA 124.972 3.782 . . . . 0.0 113.534 173.762 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.0 m -71.88 -23.96 61.58 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 127.353 2.261 . . . . 0.0 114.764 -179.325 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -88.09 -9.06 54.46 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.471 1.487 . . . . 0.0 114.117 166.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -88.08 -20.07 26.22 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 125.525 1.53 . . . . 0.0 111.445 167.948 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.7 mt -98.8 -71.79 0.68 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.437 2.295 . . . . 0.0 110.292 179.368 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.82 40.48 1.56 Allowed 'General case' 0 C--N 1.359 1.004 0 C-N-CA 128.643 2.777 . . . . 0.0 109.963 -169.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.84 83.97 1.5 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 126.212 1.863 . . . . 0.0 116.051 -167.59 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.3 m -154.95 -61.48 0.12 Allowed 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 103.508 -2.775 . . . . 0.0 103.508 171.237 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.7 t -137.35 71.78 1.41 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 104.184 -2.525 . . . . 0.0 104.184 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.45 135.85 34.52 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 125.311 1.444 . . . . 0.0 111.899 177.079 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.51 148.62 18.38 Favored Glycine 0 C--N 1.362 2.002 0 N-CA-C 106.686 -2.566 . . . . 0.0 106.686 164.558 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.98 118.5 4.51 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 -170.788 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -122.28 147.15 46.58 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.5 t -123.05 107.93 12.33 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 177.763 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.2 mmm -119.54 123.69 44.57 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.755 -2.313 . . . . 0.0 104.755 177.991 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.08 -84.35 0.02 OUTLIER 'General case' 0 C--N 1.382 1.983 0 C-N-CA 127.645 2.378 . . . . 0.0 110.904 177.256 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.67 55.92 0.16 Allowed Glycine 0 N--CA 1.433 -1.51 0 N-CA-C 104.808 -3.317 . . . . 0.0 104.808 168.842 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -152.91 152.18 31.2 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -104.93 138.36 41.29 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.122 2.169 . . . . 0.0 108.882 -166.73 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HG2' HG23 ' A' ' 2' ' ' ILE . 52.3 mtmt -115.56 145.85 42.28 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 125.814 1.646 . . . . 0.0 107.227 169.769 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.7 m -114.42 148.51 37.61 Favored 'General case' 0 C--N 1.357 0.905 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 169.747 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -139.69 155.28 47.47 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -174.71 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -111.38 111.61 22.77 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 126.42 1.888 . . . . 0.0 107.142 -176.375 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -117.37 165.96 12.88 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 176.934 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.379 0 CA-C-N 116.027 -0.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 122.064 0.935 . . . . 0.0 109.973 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.8 mt -121.63 117.16 51.67 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 174.433 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.8 pt -101.9 -174.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.345 0 C-N-CA 125.435 1.494 . . . . 0.0 108.773 177.924 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -135.01 86.6 2.27 Favored 'General case' 0 C--N 1.361 1.1 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -179.198 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.2 t -127.69 124.72 63.88 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 N-CA-C 103.573 -2.751 . . . . 0.0 103.573 170.687 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -85.69 129.76 34.74 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 126.191 1.796 . . . . 0.0 109.521 -171.824 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.4 p -138.36 -175.72 4.21 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.36 0.664 . . . . 0.0 109.607 -160.561 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -153.79 26.02 0.5 Allowed 'General case' 0 C--N 1.359 0.982 0 N-CA-C 105.585 -2.005 . . . . 0.0 105.585 164.938 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.5 p -173.87 150.55 1.69 Allowed Pre-proline 0 C--N 1.363 1.162 0 C-N-CA 124.604 1.162 . . . . 0.0 108.241 -171.525 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -68.54 -17.84 43.27 Favored 'Trans proline' 0 C--N 1.36 1.16 1 C-N-CA 125.331 4.021 . . . . 0.0 115.444 164.217 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -75.26 -20.74 59.02 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.015 2.126 . . . . 0.0 114.148 171.713 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.95 1.55 55.28 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.239 2.216 . . . . 0.0 110.541 173.878 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.5 t -117.44 -12.27 10.44 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 127.616 2.366 . . . . 0.0 108.785 177.264 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.4 m -86.02 -4.75 59.24 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 125.934 1.694 . . . . 0.0 111.831 174.784 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -56.79 1.19 Allowed Pre-proline 0 C--N 1.359 1.016 0 C-N-CA 127.382 2.273 . . . . 0.0 112.634 167.797 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.86 -41.62 2.77 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 124.88 3.72 . . . . 0.0 113.587 176.981 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.6 m -70.71 -29.66 66.0 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.757 2.423 . . . . 0.0 114.593 -178.059 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -88.12 -6.64 57.79 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.623 1.169 . . . . 0.0 113.332 171.591 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -88.68 -21.11 24.08 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 125.723 1.609 . . . . 0.0 111.068 166.347 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.3 mt -92.39 -65.65 0.99 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 127.525 2.33 . . . . 0.0 111.26 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -97.69 -5.62 34.83 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.964 2.506 . . . . 0.0 112.26 -167.611 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.26 -79.33 0.52 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.027 1.298 . . . . 0.0 113.891 164.331 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 t -152.93 -7.53 0.18 Allowed 'General case' 0 C--N 1.353 0.75 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 -175.345 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.2 68.02 0.71 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.014 2.126 . . . . 0.0 105.528 174.769 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.1 126.62 47.41 Favored 'General case' 0 C--N 1.359 1.016 0 C-N-CA 125.806 1.642 . . . . 0.0 106.87 -176.599 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.24 85.37 0.56 Allowed Glycine 0 C--N 1.361 1.969 0 N-CA-C 107.265 -2.334 . . . . 0.0 107.265 170.411 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.9 113.02 24.95 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 125.253 1.421 . . . . 0.0 109.539 -171.963 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.08 143.15 49.69 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 -171.996 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -143.7 115.63 8.31 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -177.028 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -121.0 127.41 51.74 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 -176.164 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 79.72 -85.17 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.544 2.337 . . . . 0.0 110.571 175.386 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.44 51.91 0.21 Allowed Glycine 0 N--CA 1.434 -1.464 0 N-CA-C 106.635 -2.586 . . . . 0.0 106.635 169.717 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -151.61 148.83 28.44 Favored 'General case' 0 C--N 1.369 1.426 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.009 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -105.1 154.05 20.68 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 128.022 2.529 . . . . 0.0 109.963 -163.44 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -138.21 137.06 37.2 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 57.7 m -120.65 124.42 45.18 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 124.355 1.062 . . . . 0.0 108.179 178.353 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -124.54 -158.78 0.84 Allowed 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 105.702 -1.962 . . . . 0.0 105.702 -179.329 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -132.09 95.76 3.75 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 27.9 m120 -139.85 93.42 2.65 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 104.807 -2.294 . . . . 0.0 104.807 174.407 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.384 0 CA-C-N 116.038 -0.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 86.8 m . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.9 mt -120.35 116.92 51.68 Favored 'Isoleucine or valine' 0 C--N 1.361 1.083 0 N-CA-C 104.199 -2.519 . . . . 0.0 104.199 178.853 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.3 pt -101.12 179.52 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.335 0 C-N-CA 125.419 1.488 . . . . 0.0 110.236 -178.757 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -119.81 73.89 0.99 Allowed 'General case' 0 C--N 1.361 1.088 0 C-N-CA 125.412 1.485 . . . . 0.0 108.546 -172.379 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -130.57 126.39 60.59 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 N-CA-C 105.521 -2.029 . . . . 0.0 105.521 175.289 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -83.58 138.18 33.5 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 127.131 2.172 . . . . 0.0 109.611 179.847 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -143.26 -177.75 5.52 Favored 'General case' 0 C--N 1.359 1.006 0 CA-C-O 121.735 0.779 . . . . 0.0 109.844 -165.957 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.9 t -149.08 18.73 0.97 Allowed 'General case' 0 C--N 1.356 0.876 0 C-N-CA 126.06 1.744 . . . . 0.0 106.495 168.566 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 51.9 p -173.67 155.52 2.57 Favored Pre-proline 0 C--N 1.364 1.236 0 C-N-CA 124.673 1.189 . . . . 0.0 108.292 -171.933 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -69.68 -18.59 37.29 Favored 'Trans proline' 0 C--N 1.362 1.24 1 C-N-CA 125.41 4.073 . . . . 0.0 115.025 163.767 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -79.26 -11.22 59.95 Favored 'General case' 0 C--N 1.369 1.431 0 C-N-CA 126.999 2.12 . . . . 0.0 114.768 173.416 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -94.02 -4.79 48.9 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 127.902 2.481 . . . . 0.0 109.974 171.791 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.3 t -111.69 -14.45 13.61 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.468 2.307 . . . . 0.0 108.65 179.605 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -84.79 -1.19 56.04 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 126.655 1.982 . . . . 0.0 110.753 173.038 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -81.77 -57.47 0.52 Allowed Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 129.056 2.942 . . . . 0.0 110.928 172.17 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.33 -45.37 1.85 Allowed 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 124.876 3.717 . . . . 0.0 113.68 172.011 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.88 -29.42 67.71 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 127.416 2.286 . . . . 0.0 115.081 -175.158 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -88.04 -10.83 49.05 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 124.436 1.094 . . . . 0.0 113.429 172.641 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -85.98 -21.22 27.96 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 125.858 1.663 . . . . 0.0 112.086 166.375 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 mt -94.97 -69.05 0.77 Allowed 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.307 2.243 . . . . 0.0 110.942 -178.882 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -91.4 -27.83 18.07 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 128.035 2.534 . . . . 0.0 111.856 -167.97 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.75 -171.02 15.83 Favored Glycine 0 C--N 1.362 1.997 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.417 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.1 m -71.8 -4.88 30.32 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 128.003 2.521 . . . . 0.0 115.571 -174.897 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.3 t -108.65 64.08 0.61 Allowed 'General case' 0 C--N 1.363 1.193 0 C-N-CA 127.059 2.144 . . . . 0.0 106.411 168.359 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.62 143.35 43.95 Favored 'General case' 0 C--N 1.364 1.205 0 C-N-CA 126.399 1.879 . . . . 0.0 106.924 176.557 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.71 85.49 0.52 Allowed Glycine 0 C--N 1.361 1.927 0 N-CA-C 107.559 -2.216 . . . . 0.0 107.559 171.839 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.55 111.07 23.06 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 125.246 1.418 . . . . 0.0 109.037 -173.368 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -123.14 141.92 51.45 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 104.181 -2.525 . . . . 0.0 104.181 -171.111 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.82 109.25 6.19 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 -175.662 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -110.15 123.54 49.93 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 127.071 2.148 . . . . 0.0 106.122 -176.862 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.7 m120 78.54 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.554 2.342 . . . . 0.0 111.05 177.076 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.03 49.77 0.25 Allowed Glycine 0 N--CA 1.435 -1.407 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 170.352 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -150.52 147.99 28.16 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.308 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.94 151.74 23.53 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 127.842 2.457 . . . . 0.0 110.506 -161.97 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -134.34 139.43 45.64 Favored 'General case' 0 C--N 1.361 1.083 0 C-N-CA 126.726 2.01 . . . . 0.0 106.241 177.788 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.8 m -121.78 125.77 47.3 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 124.375 1.07 . . . . 0.0 108.576 176.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -126.1 -163.68 1.24 Allowed 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.282 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -132.67 69.6 1.48 Allowed 'General case' 0 C--N 1.36 1.054 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -179.642 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -90.15 -84.74 0.23 Allowed 'General case' 0 C--N 1.359 1.005 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 176.877 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.411 0 O-C-N 123.048 0.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 122.073 0.94 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp -124.75 116.47 47.46 Favored 'Isoleucine or valine' 0 C--N 1.36 1.051 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 173.894 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -99.87 -179.99 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 125.945 1.698 . . . . 0.0 110.38 -176.071 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -123.36 70.9 1.05 Allowed 'General case' 0 C--N 1.363 1.165 0 C-N-CA 125.021 1.328 . . . . 0.0 108.422 -173.17 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.437 HG11 ' HG3' ' A' ' 16' ' ' PRO . 11.7 t -128.63 132.71 67.57 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.154 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 173.682 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -84.66 140.99 30.93 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 125.869 1.668 . . . . 0.0 109.425 -174.999 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.5 p -147.07 160.76 42.02 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 121.656 0.741 . . . . 0.0 109.289 -169.379 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.3 t -133.13 -0.29 3.36 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 126.589 1.956 . . . . 0.0 108.171 169.994 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -152.55 157.36 33.59 Favored Pre-proline 0 C--N 1.364 1.205 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -176.087 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -71.99 -16.16 29.1 Favored 'Trans proline' 0 C--N 1.359 1.095 0 C-N-CA 124.418 3.412 . . . . 0.0 114.702 169.446 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -83.0 -1.71 53.35 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 126.595 1.958 . . . . 0.0 114.579 170.788 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -99.71 -0.77 39.42 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.773 2.429 . . . . 0.0 109.627 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.9 t -124.34 -14.71 6.89 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.89 2.076 . . . . 0.0 108.439 -173.079 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 78.4 p -87.92 3.13 49.71 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 125.44 1.496 . . . . 0.0 110.927 173.278 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -77.49 -59.2 0.86 Allowed Pre-proline 0 C--N 1.359 1.001 0 C-N-CA 129.757 3.223 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.437 ' HG3' HG11 ' A' ' 5' ' ' VAL . 74.2 Cg_endo -71.23 -38.42 4.85 Favored 'Trans proline' 0 C--N 1.364 1.357 0 C-N-CA 125.121 3.881 . . . . 0.0 113.878 174.156 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -71.68 -29.07 64.19 Favored 'General case' 0 C--N 1.366 1.326 0 C-N-CA 127.647 2.379 . . . . 0.0 114.46 -176.938 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -88.04 -9.0 54.77 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 125.148 1.379 . . . . 0.0 113.135 170.339 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -86.51 -20.53 27.9 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.632 1.573 . . . . 0.0 111.489 166.498 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.4 mt -92.78 -66.63 0.91 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.704 2.402 . . . . 0.0 110.962 177.962 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -95.84 -8.91 32.87 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.972 2.509 . . . . 0.0 112.175 -167.383 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.99 -79.83 0.54 Allowed Glycine 0 C--N 1.364 2.087 0 C-N-CA 125.289 1.423 . . . . 0.0 113.46 165.125 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.1 -6.29 0.44 Allowed 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.064 1.746 . . . . 0.0 106.929 -175.568 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 t -107.02 63.81 0.63 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 126.948 2.099 . . . . 0.0 106.212 177.552 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.73 140.23 52.55 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 125.973 1.709 . . . . 0.0 106.732 -176.875 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.79 -76.07 1.17 Allowed Glycine 0 C--N 1.361 1.962 0 C-N-CA 126.316 1.913 . . . . 0.0 110.943 172.373 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 84.97 98.9 0.04 OUTLIER 'General case' 0 C--N 1.367 1.336 0 C-N-CA 126.823 2.049 . . . . 0.0 110.984 169.024 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -125.44 141.37 52.09 Favored 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -171.552 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.4 t -116.24 124.8 51.12 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -176.171 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.2 mtp -109.34 72.17 0.8 Allowed 'General case' 0 C--N 1.36 1.058 0 N-CA-C 104.43 -2.433 . . . . 0.0 104.43 170.302 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -5.39 72.33 0.0 OUTLIER 'General case' 0 C--N 1.377 1.782 1 C-N-CA 134.63 5.172 . . . . 0.0 118.749 -171.8 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.76 -38.05 0.61 Allowed Glycine 0 C--N 1.354 1.536 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -166.185 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -154.05 157.68 39.38 Favored 'General case' 0 C--N 1.37 1.472 0 CA-C-N 119.45 1.625 . . . . 0.0 108.419 -175.833 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.26 154.62 20.98 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 128.66 2.784 . . . . 0.0 109.56 -166.156 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -129.82 147.49 51.6 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.733 2.013 . . . . 0.0 106.444 173.902 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.5 m -123.14 122.34 38.21 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 175.207 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -115.65 -177.73 3.22 Favored 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 126.541 1.936 . . . . 0.0 106.141 177.383 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -122.56 96.35 5.0 Favored 'General case' 0 C--N 1.359 0.99 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 -177.332 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -134.74 96.83 3.63 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 178.612 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.408 0 CA-C-N 116.097 -0.501 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 53.2 mt -125.61 119.36 54.8 Favored 'Isoleucine or valine' 0 C--N 1.366 1.298 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 176.398 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.4 pt -106.06 -172.63 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.276 0 C-N-CA 125.129 1.372 . . . . 0.0 109.25 178.873 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -135.04 77.49 1.68 Allowed 'General case' 0 C--N 1.361 1.093 0 C-N-CA 124.325 1.05 . . . . 0.0 108.207 -177.23 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.4 t -121.06 122.52 67.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 172.205 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -80.9 133.98 35.65 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 126.757 2.023 . . . . 0.0 110.185 -172.733 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.16 -176.64 5.18 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 121.399 0.618 . . . . 0.0 110.252 -162.634 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -155.0 26.25 0.43 Allowed 'General case' 0 C--N 1.358 0.971 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 165.428 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.7 p -173.63 149.87 1.67 Allowed Pre-proline 0 C--N 1.364 1.23 0 C-N-CA 124.498 1.119 . . . . 0.0 108.369 -170.751 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -68.69 -16.62 42.3 Favored 'Trans proline' 0 C--N 1.362 1.245 1 C-N-CA 125.505 4.137 . . . . 0.0 115.29 165.479 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.01 7.98 28.7 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 126.128 1.771 . . . . 0.0 113.824 171.006 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -113.06 27.75 9.36 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.09 2.156 . . . . 0.0 107.127 166.417 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.6 t -148.12 -19.63 0.34 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.688 1.595 . . . . 0.0 110.189 -175.111 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -85.99 0.85 52.25 Favored 'General case' 0 C--N 1.369 1.424 0 CA-C-N 121.527 1.967 . . . . 0.0 111.476 175.968 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -81.31 -56.49 0.6 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.124 2.97 . . . . 0.0 110.807 170.438 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.1 -42.13 4.4 Favored 'Trans proline' 0 C--N 1.368 1.596 0 C-N-CA 124.964 3.776 . . . . 0.0 113.725 173.08 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.0 m -68.08 -31.61 71.35 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.81 2.444 . . . . 0.0 115.188 -177.873 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -88.06 -8.03 56.13 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 124.986 1.314 . . . . 0.0 112.92 172.928 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -87.84 -20.48 25.99 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 125.679 1.592 . . . . 0.0 111.374 166.508 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -92.85 -66.48 0.92 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.54 2.336 . . . . 0.0 111.116 178.706 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.15 -10.26 28.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 127.908 2.483 . . . . 0.0 111.999 -168.197 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.94 0.46 Allowed Glycine 0 C--N 1.364 2.086 0 C-N-CA 125.011 1.291 . . . . 0.0 113.672 164.685 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.52 -10.63 0.47 Allowed 'General case' 0 C--N 1.355 0.806 0 C-N-CA 125.851 1.661 . . . . 0.0 107.266 -174.14 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.07 69.49 0.76 Allowed 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.88 2.072 . . . . 0.0 105.681 176.509 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.89 125.44 41.6 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 125.695 1.598 . . . . 0.0 106.826 -174.768 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.64 87.42 0.57 Allowed Glycine 0 C--N 1.362 2.0 0 N-CA-C 107.276 -2.33 . . . . 0.0 107.276 170.698 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.79 113.54 25.84 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.238 1.415 . . . . 0.0 109.667 -172.236 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -124.43 146.39 48.94 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 103.963 -2.606 . . . . 0.0 103.963 -172.577 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.45 116.1 7.19 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 -175.912 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 68.9 mtt -121.11 126.39 49.65 Favored 'General case' 0 C--N 1.361 1.074 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 -176.04 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.33 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.505 2.322 . . . . 0.0 110.906 173.946 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.88 50.65 0.25 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 107.388 -2.285 . . . . 0.0 107.388 171.105 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -151.99 150.61 30.19 Favored 'General case' 0 C--N 1.368 1.39 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.846 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.0 151.96 23.3 Favored 'General case' 0 C--N 1.36 1.029 0 C-N-CA 128.499 2.72 . . . . 0.0 109.644 -165.305 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -135.4 137.63 42.48 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 179.013 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.68 110.65 14.64 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 124.465 1.106 . . . . 0.0 108.437 -179.321 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -108.36 -160.73 0.74 Allowed 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 127.431 2.292 . . . . 0.0 107.189 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 56.7 m-80 -130.19 98.55 4.76 Favored 'General case' 0 C--N 1.359 1.003 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -135.34 -98.18 0.24 Allowed 'General case' 0 C--N 1.357 0.925 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 175.248 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.395 0 CA-C-N 117.847 0.294 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 41.3 p . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 56.0 mt -104.97 128.1 59.0 Favored 'Isoleucine or valine' 0 C--N 1.364 1.204 0 C-N-CA 125.631 1.572 . . . . 0.0 107.019 -170.327 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 pt -106.28 -173.21 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 126.229 1.811 . . . . 0.0 109.74 -175.478 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -130.96 79.95 1.92 Allowed 'General case' 0 C--N 1.362 1.112 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -175.971 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.8 127.07 63.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 173.615 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -80.83 131.8 35.42 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 126.133 1.773 . . . . 0.0 110.155 -176.515 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -141.28 171.08 14.56 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -166.316 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.77 22.37 0.69 Allowed 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 174.194 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 p -171.09 149.23 2.63 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -174.781 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -71.84 -15.37 29.8 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 124.22 3.28 . . . . 0.0 114.747 168.685 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -79.3 -11.75 59.94 Favored 'General case' 0 C--N 1.371 1.508 0 C-N-CA 127.231 2.212 . . . . 0.0 114.323 171.525 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -89.77 -5.17 57.22 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 127.335 2.254 . . . . 0.0 110.178 171.357 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.0 t -118.19 -11.78 10.07 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.162 2.185 . . . . 0.0 108.592 -176.685 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -88.0 1.26 54.58 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 126.497 1.919 . . . . 0.0 110.38 171.569 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -80.93 -58.03 0.54 Allowed Pre-proline 0 C--N 1.356 0.89 0 C-N-CA 129.121 2.969 . . . . 0.0 111.301 170.998 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -72.04 -39.44 3.15 Favored 'Trans proline' 0 C--N 1.364 1.377 0 C-N-CA 125.072 3.848 . . . . 0.0 113.582 173.883 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -73.16 -22.69 60.45 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 127.185 2.194 . . . . 0.0 114.571 -179.427 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -88.14 -9.73 52.26 Favored 'General case' 0 C--N 1.374 1.633 0 CA-C-N 120.455 1.48 . . . . 0.0 114.068 166.141 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.39 -19.36 28.21 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.663 1.585 . . . . 0.0 111.334 168.337 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.6 mt -98.69 -71.33 0.69 Allowed 'General case' 0 C--N 1.365 1.25 0 C-N-CA 127.539 2.336 . . . . 0.0 110.221 178.27 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -106.42 42.43 1.28 Allowed 'General case' 0 C--N 1.361 1.072 0 C-N-CA 128.655 2.782 . . . . 0.0 109.955 -169.781 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -79.47 89.04 1.22 Allowed Glycine 0 C--N 1.365 2.171 0 C-N-CA 126.488 1.994 . . . . 0.0 115.939 -169.078 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.0 t -168.06 -61.37 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 103.275 -2.861 . . . . 0.0 103.275 174.308 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -137.28 70.33 1.4 Allowed 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 179.352 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.61 138.93 31.83 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.532 1.533 . . . . 0.0 111.606 177.261 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -106.31 152.66 17.04 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 105.893 -2.883 . . . . 0.0 105.893 165.568 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.31 121.96 4.86 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -171.407 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -124.73 141.27 52.22 Favored 'General case' 0 C--N 1.361 1.071 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 -179.128 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.2 t -117.56 103.37 10.0 Favored 'General case' 0 C--N 1.352 0.71 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.913 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.6 mmt -108.84 121.61 45.46 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 178.857 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.466 3.6 p-10 68.66 -78.06 0.05 OUTLIER 'General case' 0 C--N 1.38 1.905 0 C-N-CA 128.718 2.807 . . . . 0.0 113.95 -177.842 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.28 54.46 0.14 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 105.407 -3.077 . . . . 0.0 105.407 170.664 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -153.92 152.12 30.24 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.2 t -104.99 141.32 36.78 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.637 1.975 . . . . 0.0 109.435 -164.016 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -119.86 147.04 45.17 Favored 'General case' 0 CA--C 1.499 -0.989 0 C-N-CA 126.571 1.948 . . . . 0.0 106.27 172.486 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -116.33 143.47 45.5 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 172.01 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -133.34 152.76 51.94 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 -174.617 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -113.14 102.8 10.73 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.361 1.865 . . . . 0.0 106.592 -175.989 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -102.26 160.0 14.91 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 177.8 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.362 0 CA-C-N 115.817 -0.629 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 94.1 m . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 26.3 mt -126.49 125.84 68.0 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 174.248 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.2 pt -102.41 -170.53 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 125.966 1.707 . . . . 0.0 109.429 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.98 76.6 1.63 Allowed 'General case' 0 C--N 1.36 1.056 0 C-N-CA 124.333 1.053 . . . . 0.0 108.378 -175.48 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.435 HG11 ' HG3' ' A' ' 16' ' ' PRO . 7.0 t -129.59 133.26 65.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.132 0 N-CA-C 103.938 -2.615 . . . . 0.0 103.938 173.301 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.75 134.75 35.48 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 125.847 1.659 . . . . 0.0 110.447 -177.041 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.7 p -140.25 -178.98 5.73 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 -169.227 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 55.4 m -154.93 -53.36 0.09 Allowed 'General case' 0 N--CA 1.432 -1.366 0 N-CA-C 100.969 -3.715 . . . . 0.0 100.969 -163.057 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.6 p -111.25 161.91 23.17 Favored Pre-proline 0 C--N 1.362 1.112 0 C-N-CA 127.647 2.379 . . . . 0.0 108.661 177.893 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -71.88 -16.2 29.45 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.468 3.446 . . . . 0.0 114.535 165.803 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -74.73 -17.05 60.71 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 127.759 2.424 . . . . 0.0 114.146 168.941 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -88.85 -2.93 58.83 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 127.649 2.38 . . . . 0.0 110.485 174.864 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.5 t -118.93 -12.45 9.56 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 128.068 2.547 . . . . 0.0 108.207 179.697 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.3 m -86.2 -0.78 56.52 Favored 'General case' 0 C--N 1.371 1.536 0 C-N-CA 126.317 1.847 . . . . 0.0 111.06 172.867 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -77.87 -58.06 0.92 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.193 2.997 . . . . 0.0 111.795 170.817 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.435 ' HG3' HG11 ' A' ' 5' ' ' VAL . 74.5 Cg_endo -72.08 -37.7 4.53 Favored 'Trans proline' 0 C--N 1.363 1.309 0 C-N-CA 125.111 3.874 . . . . 0.0 113.886 174.496 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.54 -27.6 64.28 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.309 2.244 . . . . 0.0 114.298 -179.531 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -88.04 -8.94 54.85 Favored 'General case' 0 C--N 1.371 1.534 0 C-N-CA 125.341 1.456 . . . . 0.0 113.141 170.236 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -87.44 -19.58 27.84 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.791 1.636 . . . . 0.0 111.357 167.182 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 mt -95.11 -67.35 0.86 Allowed 'General case' 0 C--N 1.365 1.252 0 C-N-CA 127.696 2.398 . . . . 0.0 110.94 178.694 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -93.37 -11.21 32.84 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 128.198 2.599 . . . . 0.0 112.032 -168.542 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.19 -81.09 0.44 Allowed Glycine 0 C--N 1.364 2.131 0 C-N-CA 125.067 1.318 . . . . 0.0 113.573 164.224 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.6 m -148.46 -8.59 0.38 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 125.952 1.701 . . . . 0.0 106.927 -173.81 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 t -108.25 63.59 0.61 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.969 2.107 . . . . 0.0 105.386 175.391 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.16 130.73 53.15 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 125.959 1.703 . . . . 0.0 107.878 -172.916 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.74 153.16 18.76 Favored Glycine 0 C--N 1.359 1.829 0 N-CA-C 105.837 -2.905 . . . . 0.0 105.837 161.175 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.21 120.39 5.36 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 105.024 -2.213 . . . . 0.0 105.024 -171.457 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -124.7 137.65 54.34 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 -177.181 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -117.94 106.81 13.34 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.443 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.7 mtp -111.34 121.97 46.62 Favored 'General case' 0 C--N 1.361 1.089 0 N-CA-C 105.312 -2.107 . . . . 0.0 105.312 176.69 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.467 12.0 p30 69.99 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.382 1.981 0 C-N-CA 128.627 2.771 . . . . 0.0 113.704 -179.617 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 53.5 0.17 Allowed Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 105.591 -3.003 . . . . 0.0 105.591 170.686 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -152.47 150.77 29.98 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 105.369 -2.085 . . . . 0.0 105.369 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.99 144.58 31.61 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 126.746 2.018 . . . . 0.0 109.788 -162.73 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -122.63 145.45 48.35 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 127.145 2.178 . . . . 0.0 106.119 173.544 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 85.8 m -123.84 127.64 48.34 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 122.25 1.024 . . . . 0.0 109.411 177.202 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -123.74 -165.77 1.39 Allowed 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 127.762 2.425 . . . . 0.0 105.383 -178.962 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -130.15 128.96 42.84 Favored 'General case' 0 C--N 1.359 0.988 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 177.839 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -111.95 86.54 2.36 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 170.833 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.417 0 CA-C-N 116.13 -0.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 81.2 p . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.75 0.786 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 mt -127.62 124.18 62.9 Favored 'Isoleucine or valine' 0 C--N 1.36 1.05 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 174.902 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.0 pt -104.47 -171.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 126.009 1.723 . . . . 0.0 108.936 177.686 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -132.5 84.0 2.12 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.922 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.5 t -132.15 125.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 N-CA-C 104.111 -2.552 . . . . 0.0 104.111 173.519 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -76.65 137.53 39.5 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.061 2.144 . . . . 0.0 111.007 -179.238 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.7 p -145.39 178.6 7.98 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.83 0.824 . . . . 0.0 110.492 -165.506 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -149.64 19.5 0.92 Allowed 'General case' 0 C--N 1.355 0.846 0 C-N-CA 126.2 1.8 . . . . 0.0 106.65 169.526 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.1 p -172.92 155.7 3.01 Favored Pre-proline 0 C--N 1.363 1.182 0 C-N-CA 124.853 1.261 . . . . 0.0 107.975 -172.935 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -70.56 -18.44 33.22 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 125.143 3.895 . . . . 0.0 115.181 164.273 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.6 -16.13 59.66 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 127.013 2.125 . . . . 0.0 114.374 172.474 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.5 tp60 -89.53 -4.01 58.09 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.614 2.366 . . . . 0.0 110.186 172.996 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -114.09 -13.1 12.47 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 127.737 2.415 . . . . 0.0 108.982 178.762 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.2 m -85.73 -4.12 59.08 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.173 1.789 . . . . 0.0 111.026 174.997 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -78.02 -57.29 0.96 Allowed Pre-proline 0 N--CA 1.441 -0.892 0 C-N-CA 129.393 3.077 . . . . 0.0 112.092 170.795 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.59 -41.31 3.31 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 125.248 3.965 . . . . 0.0 113.943 173.711 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.16 -27.83 64.84 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 127.313 2.245 . . . . 0.0 114.838 -177.86 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -87.99 -10.5 50.2 Favored 'General case' 0 C--N 1.371 1.519 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 170.781 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.96 -19.75 29.97 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 125.639 1.576 . . . . 0.0 111.539 167.365 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.2 mt -93.7 -66.65 0.91 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 127.645 2.378 . . . . 0.0 111.013 177.758 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -96.91 -8.21 31.37 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.643 2.377 . . . . 0.0 112.326 -167.126 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.84 -80.99 0.51 Allowed Glycine 0 C--N 1.364 2.11 0 C-N-CA 125.015 1.293 . . . . 0.0 113.529 165.308 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.66 -8.67 0.42 Allowed 'General case' 0 C--N 1.354 0.782 0 C-N-CA 125.927 1.691 . . . . 0.0 107.153 -174.81 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -107.13 68.0 0.71 Allowed 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.934 2.093 . . . . 0.0 105.683 176.479 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.27 125.82 42.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 C-N-CA 125.815 1.646 . . . . 0.0 107.078 -173.849 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.28 88.51 0.58 Allowed Glycine 0 C--N 1.359 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.0 107.463 172.025 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.39 116.38 28.92 Favored 'General case' 0 C--N 1.358 0.935 0 C-N-CA 125.043 1.337 . . . . 0.0 109.7 -174.144 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -123.17 141.43 51.98 Favored 'General case' 0 C--N 1.36 1.053 0 N-CA-C 102.317 -3.216 . . . . 0.0 102.317 -174.464 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.92 112.63 10.8 Favored 'General case' 0 CA--C 1.505 -0.787 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.456 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.9 mmt -110.52 119.62 39.76 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 126.806 2.042 . . . . 0.0 106.449 -174.515 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.5 m120 77.26 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.378 1.825 0 C-N-CA 127.452 2.301 . . . . 0.0 111.558 177.492 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -164.55 48.68 0.29 Allowed Glycine 0 C--N 1.352 1.462 0 N-CA-C 106.984 -2.446 . . . . 0.0 106.984 171.47 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -151.22 153.06 34.18 Favored 'General case' 0 C--N 1.366 1.308 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 173.387 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -105.03 152.55 22.6 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 127.458 2.303 . . . . 0.0 110.417 -161.592 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -133.92 141.43 47.33 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 127.411 2.285 . . . . 0.0 105.801 178.971 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.2 m -126.95 124.93 40.61 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.595 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -123.01 -165.27 1.29 Allowed 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 126.879 2.072 . . . . 0.0 105.922 179.901 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -127.55 93.28 3.67 Favored 'General case' 0 C--N 1.359 1.006 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 178.787 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -133.54 -99.38 0.26 Allowed 'General case' 0 C--N 1.356 0.88 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 175.874 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.372 0 CA-C-N 117.836 0.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 82.3 p . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 121.909 0.862 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 036 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.5 mt -123.76 120.16 59.03 Favored 'Isoleucine or valine' 0 C--N 1.361 1.075 0 N-CA-C 103.521 -2.77 . . . . 0.0 103.521 175.897 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.7 pt -104.53 -171.8 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.242 0 C-N-CA 125.497 1.519 . . . . 0.0 108.681 177.045 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -135.04 78.63 1.74 Allowed 'General case' 0 C--N 1.36 1.032 0 C-N-CA 123.995 0.918 . . . . 0.0 108.542 -175.774 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 t -126.6 126.38 68.78 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 N-CA-C 104.392 -2.448 . . . . 0.0 104.392 172.677 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -88.61 129.7 35.44 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 125.971 1.708 . . . . 0.0 109.132 -171.529 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.9 p -133.85 -174.59 3.57 Favored 'General case' 0 C--N 1.358 0.975 0 C-N-CA 123.797 0.839 . . . . 0.0 109.265 -162.373 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -151.8 22.6 0.69 Allowed 'General case' 0 C--N 1.358 0.949 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 166.609 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 p -175.5 153.39 1.46 Allowed Pre-proline 0 C--N 1.365 1.269 0 C-N-CA 124.59 1.156 . . . . 0.0 108.242 -169.115 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -69.4 -17.89 38.99 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 125.286 3.99 . . . . 0.0 115.113 163.425 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -82.14 -7.33 59.62 Favored 'General case' 0 C--N 1.368 1.41 0 C-N-CA 126.682 1.993 . . . . 0.0 114.658 173.59 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -100.51 6.03 44.21 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.941 2.096 . . . . 0.0 109.156 170.699 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.6 t -120.3 -14.76 8.72 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 127.603 2.361 . . . . 0.0 108.447 177.846 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -84.61 1.09 47.67 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 126.406 1.882 . . . . 0.0 110.876 173.365 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.77 -59.79 0.43 Allowed Pre-proline 0 N--CA 1.44 -0.972 0 C-N-CA 129.454 3.101 . . . . 0.0 110.91 171.682 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.55 -38.91 4.01 Favored 'Trans proline' 0 C--N 1.365 1.415 0 C-N-CA 125.066 3.844 . . . . 0.0 113.561 173.987 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -71.6 -27.68 63.29 Favored 'General case' 0 C--N 1.368 1.397 0 C-N-CA 127.3 2.24 . . . . 0.0 114.378 -178.531 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.17 -6.54 57.8 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.92 1.236 . . . . 0.0 113.936 169.202 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -88.94 -18.8 26.74 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 125.833 1.653 . . . . 0.0 111.403 166.187 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.1 mt -99.46 -73.64 0.62 Allowed 'General case' 0 C--N 1.364 1.211 0 C-N-CA 127.418 2.287 . . . . 0.0 109.859 179.559 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -103.58 45.61 0.95 Allowed 'General case' 0 C--N 1.36 1.048 0 C-N-CA 129.079 2.952 . . . . 0.0 109.565 -173.638 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.59 81.57 1.23 Allowed Glycine 0 C--N 1.364 2.105 0 C-N-CA 126.492 1.996 . . . . 0.0 116.763 -170.778 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p 175.62 -47.26 0.01 OUTLIER 'General case' 0 C--N 1.358 0.945 0 C-N-CA 127.701 2.4 . . . . 0.0 104.856 175.701 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 t -133.11 76.39 1.68 Allowed 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -177.577 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.57 119.36 39.19 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 125.273 1.429 . . . . 0.0 108.624 178.336 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.37 85.71 0.62 Allowed Glycine 0 C--N 1.368 2.313 0 N-CA-C 108.34 -1.904 . . . . 0.0 108.34 170.515 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.86 115.79 28.2 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.332 1.453 . . . . 0.0 109.956 -172.817 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.3 mttm -125.43 143.84 50.8 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 104.564 -2.384 . . . . 0.0 104.564 -172.401 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -140.04 112.23 7.68 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -177.038 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.0 mmm -112.86 124.91 53.69 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.983 2.113 . . . . 0.0 105.814 -177.811 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.17 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.38 1.928 0 C-N-CA 127.55 2.34 . . . . 0.0 110.701 176.4 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.74 50.02 0.24 Allowed Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 169.795 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.39 148.11 29.08 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 175.59 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.6 t -105.02 151.34 24.07 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.39 2.276 . . . . 0.0 110.124 -161.944 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -134.0 135.1 43.19 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.489 1.915 . . . . 0.0 106.16 178.551 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -120.36 119.74 33.97 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.441 1.096 . . . . 0.0 108.538 178.53 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -123.0 -158.64 0.8 Allowed 'General case' 0 N--CA 1.435 -1.188 0 C-N-CA 126.53 1.932 . . . . 0.0 106.219 -178.597 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -127.45 153.32 46.42 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 105.391 -2.077 . . . . 0.0 105.391 172.956 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -84.93 117.92 24.22 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.828 1.251 . . . . 0.0 107.966 175.564 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 . . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.1 mt -125.22 113.32 34.94 Favored 'Isoleucine or valine' 0 C--N 1.366 1.307 0 N-CA-C 102.492 -3.151 . . . . 0.0 102.492 174.361 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.6 pt -101.45 -179.29 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 124.721 1.208 . . . . 0.0 110.744 -175.972 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -121.77 78.45 1.46 Allowed 'General case' 0 C--N 1.362 1.15 0 C-N-CA 125.691 1.596 . . . . 0.0 107.27 -176.206 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -132.12 124.59 53.0 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 N-CA-C 103.674 -2.713 . . . . 0.0 103.674 170.888 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -87.96 140.94 28.99 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 126.18 1.792 . . . . 0.0 108.372 -175.739 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.01 -176.21 5.06 Favored 'General case' 0 C--N 1.357 0.919 0 CA-C-O 121.429 0.633 . . . . 0.0 110.059 -162.574 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.0 t -154.33 24.93 0.47 Allowed 'General case' 0 C--N 1.359 1.005 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 164.534 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.0 p -173.53 150.54 1.8 Allowed Pre-proline 0 C--N 1.365 1.271 0 C-N-CA 124.399 1.08 . . . . 0.0 108.524 -170.08 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.41 ' HA ' ' HB2' ' A' ' 29' ' ' CYS . 51.8 Cg_exo -69.01 -15.22 39.73 Favored 'Trans proline' 0 C--N 1.362 1.277 1 C-N-CA 125.559 4.173 . . . . 0.0 115.119 164.96 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -88.09 5.18 42.38 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.253 1.821 . . . . 0.0 113.819 171.596 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -113.06 28.2 8.99 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.139 2.176 . . . . 0.0 106.671 168.245 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.0 t -147.46 -21.43 0.38 Allowed 'General case' 0 C--N 1.356 0.863 0 C-N-CA 125.693 1.597 . . . . 0.0 109.95 -175.864 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.7 p -86.27 0.27 54.2 Favored 'General case' 0 C--N 1.372 1.55 0 CA-C-N 121.434 1.924 . . . . 0.0 111.308 175.81 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -79.63 -58.53 0.63 Allowed Pre-proline 0 C--N 1.357 0.922 0 C-N-CA 129.737 3.215 . . . . 0.0 111.472 170.109 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.18 -40.31 4.79 Favored 'Trans proline' 0 C--N 1.365 1.441 1 C-N-CA 125.312 4.008 . . . . 0.0 113.787 174.041 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -70.08 -30.71 68.01 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.751 2.421 . . . . 0.0 114.727 -177.901 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -88.0 -7.17 57.45 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 124.836 1.254 . . . . 0.0 113.2 171.646 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -86.98 -18.92 29.54 Favored 'General case' 0 C--N 1.36 1.022 0 C-N-CA 125.697 1.599 . . . . 0.0 111.322 165.512 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -94.22 -66.63 0.9 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.596 2.358 . . . . 0.0 111.278 178.495 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -94.62 -9.46 34.97 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.998 2.519 . . . . 0.0 112.199 -167.892 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -77.95 0.29 Allowed Glycine 0 C--N 1.364 2.138 0 C-N-CA 124.953 1.264 . . . . 0.0 113.318 165.641 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.418 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.6 t -153.56 -7.43 0.17 Allowed 'General case' 0 C--N 1.355 0.806 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 -175.082 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.418 ' H ' ' H ' ' A' ' 23' ' ' SER . 18.6 t -108.68 70.93 0.76 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 126.766 2.026 . . . . 0.0 105.596 175.354 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.7 126.12 42.97 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.642 1.577 . . . . 0.0 107.002 -178.077 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.51 83.59 0.59 Allowed Glycine 0 C--N 1.362 1.981 0 N-CA-C 107.053 -2.419 . . . . 0.0 107.053 171.096 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.85 115.04 27.72 Favored 'General case' 0 C--N 1.359 1.0 0 C-N-CA 125.623 1.569 . . . . 0.0 109.748 -171.117 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -124.62 147.12 48.69 Favored 'General case' 0 CA--C 1.485 -1.534 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 -170.487 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.41 ' HB2' ' HA ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -146.3 131.49 18.41 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -177.619 . . . . . . . . 3 3 . 1 . 037 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -109.43 84.89 2.0 Allowed 'General case' 0 C--N 1.359 1.021 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 171.992 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.271 5.4 p30 1.32 64.93 0.0 OUTLIER 'General case' 0 C--N 1.382 2.005 1 C-N-CA 134.438 5.095 . . . . 0.0 119.273 179.345 . . . . . . . . 3 2 . 1 . 037 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.0 -47.11 0.27 Allowed Glycine 0 C--N 1.354 1.54 0 N-CA-C 108.927 -1.669 . . . . 0.0 108.927 -162.63 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -154.0 154.98 34.72 Favored 'General case' 0 C--N 1.37 1.475 0 CA-C-N 119.398 1.599 . . . . 0.0 109.353 -177.036 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.4 t -107.75 152.43 24.36 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 129.45 3.1 . . . . 0.0 110.196 -166.913 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -133.61 139.84 46.75 Favored 'General case' 0 C--N 1.363 1.165 0 C-N-CA 126.808 2.043 . . . . 0.0 106.425 177.554 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.4 m -123.18 112.92 18.26 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 124.704 1.202 . . . . 0.0 108.816 178.877 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -112.11 -149.39 0.45 Allowed 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 106.539 177.084 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -135.03 156.57 48.81 Favored 'General case' 0 C--N 1.359 0.984 0 N-CA-C 105.59 -2.004 . . . . 0.0 105.59 177.37 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -87.31 122.88 31.66 Favored 'General case' 0 C--N 1.361 1.072 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 171.852 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.326 0 O-C-N 123.474 0.484 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 91.7 m . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 . . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 mt -104.92 118.5 52.41 Favored 'Isoleucine or valine' 0 C--N 1.361 1.101 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -179.376 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt -99.28 -174.84 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.212 0 C-N-CA 126.076 1.75 . . . . 0.0 110.113 -176.76 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -128.25 82.91 2.11 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -174.167 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.3 t -134.63 126.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 104.273 -2.491 . . . . 0.0 104.273 172.856 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -80.28 138.75 36.81 Favored 'General case' 0 C--N 1.366 1.315 0 C-N-CA 127.036 2.134 . . . . 0.0 110.253 -178.928 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.7 p -145.1 171.18 14.87 Favored 'General case' 0 C--N 1.356 0.883 0 CA-C-O 121.782 0.801 . . . . 0.0 109.356 -166.888 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -119.85 -22.84 6.64 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 127.04 2.136 . . . . 0.0 108.156 161.184 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.5 p -135.9 162.44 56.8 Favored Pre-proline 0 C--N 1.366 1.288 0 C-N-CA 125.951 1.7 . . . . 0.0 110.046 -169.132 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -69.62 -17.07 38.42 Favored 'Trans proline' 0 C--N 1.361 1.213 1 C-N-CA 125.364 4.043 . . . . 0.0 115.113 163.397 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.32 -11.12 59.94 Favored 'General case' 0 C--N 1.369 1.441 0 C-N-CA 127.101 2.16 . . . . 0.0 114.187 171.0 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -98.23 7.31 46.43 Favored 'General case' 0 C--N 1.372 1.564 0 C-N-CA 127.36 2.264 . . . . 0.0 109.43 172.245 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -123.79 -13.18 7.48 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 127.662 2.385 . . . . 0.0 108.602 177.767 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -85.36 -1.11 56.65 Favored 'General case' 0 C--N 1.371 1.525 0 C-N-CA 126.26 1.824 . . . . 0.0 110.905 173.679 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -81.88 -57.23 0.52 Allowed Pre-proline 0 N--CA 1.44 -0.974 0 C-N-CA 129.31 3.044 . . . . 0.0 111.112 172.827 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.76 -42.41 3.43 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 124.958 3.772 . . . . 0.0 113.962 172.568 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -70.0 -29.45 66.53 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.345 2.258 . . . . 0.0 114.845 -176.661 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -88.04 -8.62 55.31 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.784 1.234 . . . . 0.0 113.303 171.356 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -84.79 -25.88 27.9 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 125.732 1.613 . . . . 0.0 111.182 165.777 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.8 mt -89.78 -63.42 1.29 Allowed 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.516 2.326 . . . . 0.0 111.761 179.934 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -98.53 -8.98 25.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.629 2.371 . . . . 0.0 111.964 -167.645 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -80.95 0.47 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.039 1.304 . . . . 0.0 113.651 164.956 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.3 m -147.51 -9.69 0.42 Allowed 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.858 1.663 . . . . 0.0 106.965 -175.058 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -106.19 69.92 0.82 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 126.946 2.098 . . . . 0.0 105.726 176.326 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 127.15 42.55 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -175.363 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 87.19 0.51 Allowed Glycine 0 C--N 1.36 1.868 0 N-CA-C 107.211 -2.356 . . . . 0.0 107.211 172.219 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.56 117.31 28.36 Favored 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.328 1.451 . . . . 0.0 109.935 -174.089 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -122.99 140.15 53.33 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 102.986 -2.968 . . . . 0.0 102.986 -175.575 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.25 107.53 6.83 Favored 'General case' 0 CA--C 1.501 -0.935 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 -178.115 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 62.4 mtt -110.61 123.89 50.84 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 127.295 2.238 . . . . 0.0 106.042 -174.377 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 80.39 -86.29 0.02 OUTLIER 'General case' 0 C--N 1.38 1.919 0 C-N-CA 127.403 2.281 . . . . 0.0 109.908 177.854 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.77 49.51 0.24 Allowed Glycine 0 N--CA 1.435 -1.429 0 N-CA-C 106.444 -2.662 . . . . 0.0 106.444 170.03 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -151.37 150.58 30.64 Favored 'General case' 0 C--N 1.367 1.335 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 177.822 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.9 t -105.03 150.29 25.08 Favored 'General case' 0 C--N 1.362 1.127 0 C-N-CA 127.137 2.175 . . . . 0.0 110.819 -160.712 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -131.98 144.47 50.83 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 127.437 2.295 . . . . 0.0 105.948 178.092 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.6 m -127.8 127.53 43.68 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 108.168 177.859 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -125.18 -163.31 1.18 Allowed 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 178.926 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -129.19 97.76 4.7 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.419 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -139.15 97.65 3.35 Favored 'General case' 0 C--N 1.355 0.837 0 N-CA-C 105.068 -2.197 . . . . 0.0 105.068 176.11 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.422 0 CA-C-N 116.09 -0.505 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 80.5 p . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 121.913 0.863 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.9 mt -124.59 115.81 45.63 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.465 -2.791 . . . . 0.0 103.465 176.061 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.0 pt -104.32 -176.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.261 0 C-N-CA 125.78 1.632 . . . . 0.0 108.906 178.738 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -134.97 104.01 5.8 Favored 'General case' 0 C--N 1.361 1.105 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -178.101 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.3 t -114.44 -50.06 5.14 Favored 'Isoleucine or valine' 0 C--N 1.364 1.228 0 C-N-CA 125.012 1.325 . . . . 0.0 110.851 -172.491 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 82.14 121.39 0.05 OUTLIER 'General case' 0 C--N 1.364 1.211 0 C-N-CA 131.638 3.975 . . . . 0.0 110.45 -167.192 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.8 p -148.0 -177.73 5.9 Favored 'General case' 0 C--N 1.356 0.877 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -166.227 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.1 t -152.71 24.23 0.59 Allowed 'General case' 0 C--N 1.358 0.96 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 167.008 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.2 p -173.04 150.41 1.95 Allowed Pre-proline 0 C--N 1.364 1.218 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 -171.086 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -69.77 -14.28 35.84 Favored 'Trans proline' 0 C--N 1.36 1.149 1 C-N-CA 125.428 4.086 . . . . 0.0 114.949 162.106 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.8 -15.26 59.79 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 127.674 2.389 . . . . 0.0 114.19 170.489 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -97.78 8.8 44.07 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.686 2.395 . . . . 0.0 109.222 173.149 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -124.51 -14.47 6.85 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.827 2.051 . . . . 0.0 109.446 -179.827 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.9 m -86.51 -6.87 58.79 Favored 'General case' 0 C--N 1.367 1.351 0 C-N-CA 125.712 1.605 . . . . 0.0 111.237 175.72 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -82.52 -54.45 0.6 Allowed Pre-proline 0 C--N 1.356 0.866 0 C-N-CA 129.3 3.04 . . . . 0.0 111.956 171.37 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.38 -46.0 4.61 Favored 'Trans proline' 0 C--N 1.367 1.504 1 C-N-CA 125.974 4.45 . . . . 0.0 113.802 172.92 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.05 -30.87 69.3 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.589 2.356 . . . . 0.0 115.353 -178.152 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -88.01 -6.06 58.18 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 124.662 1.185 . . . . 0.0 113.444 172.979 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -88.59 -21.43 24.04 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 126.003 1.721 . . . . 0.0 111.081 165.889 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.7 mt -92.64 -66.65 0.91 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.396 2.278 . . . . 0.0 111.196 178.51 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.1 -7.29 33.04 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 128.283 2.633 . . . . 0.0 112.34 -167.565 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.56 -79.9 0.57 Allowed Glycine 0 C--N 1.364 2.123 0 C-N-CA 125.05 1.31 . . . . 0.0 113.72 164.83 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.51 -9.61 0.42 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.854 1.661 . . . . 0.0 107.198 -175.684 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 t -105.79 69.0 0.8 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 126.875 2.07 . . . . 0.0 106.031 177.37 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.49 124.83 39.28 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.736 1.614 . . . . 0.0 106.985 -174.155 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.24 89.91 0.78 Allowed Glycine 0 C--N 1.363 2.043 0 N-CA-C 107.091 -2.403 . . . . 0.0 107.091 170.065 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.42 111.88 23.82 Favored 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.303 1.441 . . . . 0.0 109.894 -169.719 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -125.54 140.26 52.91 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 104.102 -2.555 . . . . 0.0 104.102 -173.382 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.16 110.28 9.47 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 -174.78 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.7 mmm -122.34 129.57 52.28 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.592 1.957 . . . . 0.0 105.747 -172.539 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m120 76.15 -7.25 1.85 Allowed 'General case' 0 C--N 1.382 1.98 0 C-N-CA 126.793 2.037 . . . . 0.0 115.342 168.972 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.27 42.0 3.58 Favored Glycine 0 C--N 1.362 2.017 0 C-N-CA 126.63 2.062 . . . . 0.0 111.082 -174.114 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.03 156.97 38.33 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 102.968 -2.975 . . . . 0.0 102.968 169.862 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 39.0 t -105.05 155.58 18.85 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 126.305 1.842 . . . . 0.0 109.896 -166.077 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -132.56 134.51 45.04 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 176.95 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.3 m -123.02 117.34 25.25 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -115.19 -165.59 1.04 Allowed 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 126.851 2.06 . . . . 0.0 106.21 -179.524 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -127.25 91.02 3.24 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 -178.707 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.6 m120 -137.9 94.7 2.92 Favored 'General case' 0 C--N 1.356 0.879 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 177.089 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.404 0 CA-C-N 116.015 -0.539 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt . . . . . 0 N--CA 1.448 -0.562 0 N-CA-C 104.164 -2.532 . . . . 0.0 104.164 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -108.18 -174.42 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.175 1.39 . . . . 0.0 109.287 177.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -130.98 80.39 1.94 Allowed 'General case' 0 C--N 1.362 1.139 0 C-N-CA 124.984 1.314 . . . . 0.0 107.634 -176.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.411 HG11 ' HG3' ' A' ' 16' ' ' PRO . 6.9 t -131.16 129.75 63.09 Favored 'Isoleucine or valine' 0 C--N 1.361 1.093 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -79.88 135.72 36.5 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.017 1.727 . . . . 0.0 110.56 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.66 171.95 13.48 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -169.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.39 22.88 0.54 Allowed 'General case' 0 C--N 1.355 0.821 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.3 p -171.96 149.72 2.34 Favored Pre-proline 0 C--N 1.36 1.059 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -71.66 -16.88 30.04 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.197 3.264 . . . . 0.0 114.549 168.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -79.09 -10.75 59.91 Favored 'General case' 0 C--N 1.369 1.45 0 C-N-CA 127.516 2.326 . . . . 0.0 114.799 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -89.94 -11.53 41.46 Favored 'General case' 0 C--N 1.37 1.5 0 C-N-CA 127.735 2.414 . . . . 0.0 110.275 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.5 t -109.72 -13.63 14.46 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.289 2.236 . . . . 0.0 108.76 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.5 m -83.69 -1.39 53.94 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.182 1.793 . . . . 0.0 111.445 174.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -80.35 -59.06 0.54 Allowed Pre-proline 0 N--CA 1.44 -0.938 0 C-N-CA 129.545 3.138 . . . . 0.0 111.471 172.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.411 ' HG3' HG11 ' A' ' 5' ' ' VAL . 68.4 Cg_endo -70.61 -40.35 4.08 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 125.097 3.865 . . . . 0.0 113.703 174.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.5 m -69.52 -31.45 69.69 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 127.6 2.36 . . . . 0.0 114.696 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -88.14 -7.17 57.31 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 124.837 1.255 . . . . 0.0 113.296 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.1 -19.21 28.87 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.746 1.618 . . . . 0.0 111.468 165.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 mt -93.9 -67.39 0.86 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 127.608 2.363 . . . . 0.0 111.14 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -94.72 -9.54 34.42 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.09 2.556 . . . . 0.0 112.4 -167.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -78.06 0.29 Allowed Glycine 0 C--N 1.365 2.153 0 C-N-CA 124.97 1.271 . . . . 0.0 113.161 166.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -152.99 -8.52 0.17 Allowed 'General case' 0 C--N 1.355 0.836 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -105.42 71.12 0.91 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 126.992 2.117 . . . . 0.0 105.748 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.38 123.24 31.21 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 125.684 1.594 . . . . 0.0 106.776 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.19 85.19 0.73 Allowed Glycine 0 C--N 1.364 2.098 0 N-CA-C 107.488 -2.245 . . . . 0.0 107.488 171.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.46 114.39 26.4 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.602 1.561 . . . . 0.0 109.949 -169.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.3 mttp -122.95 142.02 51.28 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -171.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.8 t -122.49 112.52 18.14 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.7 mmm -121.7 123.53 42.1 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.747 -2.316 . . . . 0.0 104.747 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.72 -84.61 0.02 OUTLIER 'General case' 0 C--N 1.381 1.964 0 C-N-CA 127.623 2.369 . . . . 0.0 111.099 176.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.83 54.47 0.19 Allowed Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 105.58 -3.008 . . . . 0.0 105.58 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mttm -154.04 152.19 30.21 Favored 'General case' 0 C--N 1.362 1.149 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.4 t -105.78 144.07 33.04 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 127.518 2.327 . . . . 0.0 109.465 -164.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -124.33 139.53 53.82 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.35 1.86 . . . . 0.0 106.671 174.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 67.7 m -125.2 111.45 15.28 Favored 'General case' 0 CA--C 1.5 -0.967 0 C-N-CA 124.09 0.956 . . . . 0.0 108.498 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 . . . . . 0 N--CA 1.439 -0.99 0 C-N-CA 127.001 2.12 . . . . 0.0 106.647 178.713 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 39.7 mt . . . . . 0 N--CA 1.445 -0.705 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.0 pt -112.88 -171.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 125.578 1.551 . . . . 0.0 108.208 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -131.9 80.29 1.91 Allowed 'General case' 0 C--N 1.363 1.156 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.413 HG11 ' HG3' ' A' ' 16' ' ' PRO . 11.3 t -130.62 129.52 64.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.082 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 171.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.64 134.26 35.16 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 125.734 1.614 . . . . 0.0 110.448 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.5 p -142.51 170.44 15.7 Favored 'General case' 0 C--N 1.36 1.029 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -167.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.03 22.37 0.76 Allowed 'General case' 0 C--N 1.355 0.843 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -170.42 150.16 3.31 Favored Pre-proline 0 C--N 1.362 1.121 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -71.46 -15.79 30.92 Favored 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 124.196 3.264 . . . . 0.0 114.891 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -82.66 -2.35 53.74 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.947 2.099 . . . . 0.0 114.315 171.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -101.87 7.53 41.56 Favored 'General case' 0 C--N 1.372 1.568 0 C-N-CA 127.195 2.198 . . . . 0.0 109.233 170.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.2 t -128.25 -14.3 4.86 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 127.229 2.212 . . . . 0.0 108.253 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.9 m -84.24 -1.15 54.72 Favored 'General case' 0 C--N 1.372 1.571 0 C-N-CA 126.064 1.746 . . . . 0.0 111.756 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -79.47 -58.67 0.64 Allowed Pre-proline 0 C--N 1.358 0.965 0 C-N-CA 128.926 2.89 . . . . 0.0 111.74 170.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.413 ' HG3' HG11 ' A' ' 5' ' ' VAL . 66.7 Cg_endo -70.89 -39.66 4.16 Favored 'Trans proline' 0 C--N 1.364 1.366 0 C-N-CA 124.966 3.778 . . . . 0.0 113.522 175.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.6 m -69.42 -31.79 70.35 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.824 2.45 . . . . 0.0 114.679 -178.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -88.06 -6.38 57.97 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.853 1.261 . . . . 0.0 113.184 172.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -88.23 -19.65 26.57 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.814 1.646 . . . . 0.0 111.232 165.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.0 mt -93.38 -67.11 0.88 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 127.636 2.374 . . . . 0.0 111.059 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -94.89 -11.36 28.87 Favored 'General case' 0 C--N 1.362 1.14 0 C-N-CA 128.115 2.566 . . . . 0.0 112.277 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.86 -79.72 0.31 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 124.753 1.168 . . . . 0.0 113.284 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -146.42 -15.1 0.44 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 125.495 1.518 . . . . 0.0 107.097 -175.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.7 t -103.43 72.8 1.16 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 126.94 2.096 . . . . 0.0 106.14 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.0 122.58 30.37 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 125.792 1.637 . . . . 0.0 106.777 -174.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.9 85.25 0.75 Allowed Glycine 0 C--N 1.365 2.156 0 N-CA-C 107.647 -2.181 . . . . 0.0 107.647 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.09 115.07 27.34 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 125.567 1.547 . . . . 0.0 109.896 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -123.37 142.92 50.47 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -171.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.8 t -123.31 114.52 20.31 Favored 'General case' 0 C--N 1.351 0.645 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.45 123.0 39.67 Favored 'General case' 0 C--N 1.358 0.95 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 177.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 77.33 -84.6 0.02 OUTLIER 'General case' 0 C--N 1.381 1.949 0 C-N-CA 127.481 2.312 . . . . 0.0 111.27 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.59 54.52 0.19 Allowed Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 168.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -152.85 152.23 31.31 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.8 t -104.99 145.04 30.98 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 127.514 2.326 . . . . 0.0 109.038 -164.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -125.97 138.07 53.73 Favored 'General case' 0 CA--C 1.5 -0.968 0 C-N-CA 126.074 1.749 . . . . 0.0 106.624 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.0 m -124.36 112.69 17.26 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 124.482 1.113 . . . . 0.0 108.573 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 . . . . . 0 N--CA 1.438 -1.045 0 C-N-CA 126.985 2.114 . . . . 0.0 106.396 179.517 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 N--CA 1.447 -0.59 0 N-CA-C 104.066 -2.568 . . . . 0.0 104.066 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 pt -100.8 177.94 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.288 0 C-N-CA 125.188 1.395 . . . . 0.0 110.953 -176.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -113.38 71.4 0.74 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 126.273 1.829 . . . . 0.0 108.34 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t -133.56 143.92 37.48 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.179 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -103.25 139.97 38.01 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 126.827 2.051 . . . . 0.0 107.068 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.4 p -143.28 177.82 8.16 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 -170.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -155.02 22.99 0.44 Allowed 'General case' 0 C--N 1.355 0.815 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 174.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.2 p -174.79 148.01 1.14 Allowed Pre-proline 0 C--N 1.361 1.078 0 N-CA-C 105.235 -2.135 . . . . 0.0 105.235 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -71.81 -13.19 29.32 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.444 3.429 . . . . 0.0 114.157 167.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -73.97 -21.41 60.02 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 128.495 2.718 . . . . 0.0 114.833 170.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -87.4 -15.08 38.82 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.095 2.558 . . . . 0.0 110.743 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.45 -14.22 15.79 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 126.732 2.013 . . . . 0.0 109.955 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 p -87.97 3.33 49.09 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 120.498 -1.376 . . . . 0.0 111.371 174.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -79.16 -59.62 0.6 Allowed Pre-proline 0 C--N 1.361 1.099 0 C-N-CA 129.364 3.066 . . . . 0.0 111.221 169.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.75 -39.42 4.62 Favored 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 125.08 3.853 . . . . 0.0 113.653 174.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.99 -30.65 66.97 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.87 2.468 . . . . 0.0 114.653 -177.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -88.1 -7.37 57.05 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.766 1.226 . . . . 0.0 113.281 171.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.66 -18.98 29.95 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.702 1.601 . . . . 0.0 111.468 165.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.2 mt -94.04 -66.8 0.89 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 127.615 2.366 . . . . 0.0 111.153 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -95.25 -9.44 33.17 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 128.001 2.521 . . . . 0.0 112.329 -167.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.39 -79.79 0.32 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 124.868 1.223 . . . . 0.0 113.234 166.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.42 -14.2 0.39 Allowed 'General case' 0 C--N 1.354 0.78 0 C-N-CA 125.543 1.537 . . . . 0.0 106.949 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 t -103.51 72.46 1.14 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.022 2.129 . . . . 0.0 106.369 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.67 124.8 34.51 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 -175.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.71 84.47 0.67 Allowed Glycine 0 C--N 1.364 2.108 0 N-CA-C 107.493 -2.243 . . . . 0.0 107.493 172.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.35 116.15 28.7 Favored 'General case' 0 C--N 1.36 1.032 0 C-N-CA 125.563 1.545 . . . . 0.0 109.923 -170.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -122.99 139.73 53.76 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -171.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -121.01 111.94 18.11 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.89 -1.892 . . . . 0.0 105.89 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -119.91 123.17 42.91 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 77.58 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.382 2.004 0 C-N-CA 127.646 2.378 . . . . 0.0 111.027 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.54 55.95 0.19 Allowed Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 105.219 -3.152 . . . . 0.0 105.219 168.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -153.08 148.31 26.85 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.2 t -106.45 143.36 34.68 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 127.373 2.269 . . . . 0.0 109.529 -165.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -125.99 142.28 51.59 Favored 'General case' 0 C--N 1.357 0.926 0 C-N-CA 126.575 1.95 . . . . 0.0 107.083 175.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.09 120.56 32.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.687 1.195 . . . . 0.0 108.399 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 . . . . . 0 N--CA 1.436 -1.126 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 178.558 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.6 mt . . . . . 0 N--CA 1.444 -0.769 0 N-CA-C 103.525 -2.769 . . . . 0.0 103.525 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.9 pt -103.63 -176.38 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.279 0 C-N-CA 125.357 1.463 . . . . 0.0 109.128 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.1 m-80 -129.38 79.23 1.9 Allowed 'General case' 0 C--N 1.361 1.102 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -176.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.6 t -129.55 127.83 65.18 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.621 -2.733 . . . . 0.0 103.621 171.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -82.37 133.82 35.23 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 126.183 1.793 . . . . 0.0 109.967 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.2 p -142.65 172.51 12.6 Favored 'General case' 0 C--N 1.357 0.904 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -167.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.0 26.91 0.48 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 170.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -170.4 148.29 2.83 Favored Pre-proline 0 C--N 1.36 1.039 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 -176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -71.34 -16.08 31.25 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 124.199 3.266 . . . . 0.0 114.672 169.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -80.75 -7.28 59.33 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 127.217 2.207 . . . . 0.0 114.636 171.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -94.55 -3.25 50.13 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.195 2.198 . . . . 0.0 109.945 170.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.3 t -116.69 -13.92 10.8 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.28 2.232 . . . . 0.0 108.238 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -83.97 -1.18 54.15 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 126.196 1.799 . . . . 0.0 111.394 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.11 -59.35 0.54 Allowed Pre-proline 0 C--N 1.357 0.931 0 C-N-CA 129.556 3.142 . . . . 0.0 111.322 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -70.68 -40.87 3.5 Favored 'Trans proline' 0 C--N 1.365 1.397 0 C-N-CA 125.079 3.853 . . . . 0.0 113.48 174.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.4 m -69.93 -31.33 69.03 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 127.736 2.415 . . . . 0.0 114.824 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -88.07 -7.37 57.09 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 124.624 1.169 . . . . 0.0 113.338 172.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -87.14 -20.66 26.72 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.649 1.58 . . . . 0.0 111.447 165.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.1 mt -92.74 -66.7 0.91 Allowed 'General case' 0 C--N 1.366 1.303 0 C-N-CA 127.553 2.341 . . . . 0.0 111.086 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -96.59 -7.86 33.28 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 128.107 2.563 . . . . 0.0 112.253 -167.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.81 -80.03 0.5 Allowed Glycine 0 C--N 1.365 2.167 0 C-N-CA 124.936 1.255 . . . . 0.0 113.621 165.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.1 m -147.63 -11.38 0.4 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.74 1.616 . . . . 0.0 107.093 -175.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 t -105.13 69.17 0.84 Allowed 'General case' 0 C--N 1.366 1.298 0 C-N-CA 126.907 2.083 . . . . 0.0 106.142 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.78 126.14 42.91 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 125.741 1.616 . . . . 0.0 106.855 -175.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.56 85.8 0.57 Allowed Glycine 0 C--N 1.363 2.054 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 170.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.08 112.88 24.53 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 125.327 1.451 . . . . 0.0 109.812 -169.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -121.91 141.78 50.94 Favored 'General case' 0 C--N 1.361 1.088 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -127.96 110.62 12.71 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -118.93 128.11 54.11 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 78.75 -85.54 0.02 OUTLIER 'General case' 0 C--N 1.383 2.023 0 C-N-CA 127.537 2.335 . . . . 0.0 111.023 173.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 55.6 0.18 Allowed Glycine 0 N--CA 1.432 -1.582 0 N-CA-C 106.083 -2.807 . . . . 0.0 106.083 169.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -153.45 151.99 30.5 Favored 'General case' 0 C--N 1.362 1.148 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -106.35 144.98 32.26 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.558 2.343 . . . . 0.0 109.239 -165.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.3 mtmm -127.11 139.02 53.28 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 126.059 1.744 . . . . 0.0 106.835 173.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.7 m -120.66 119.42 32.79 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 124.523 1.129 . . . . 0.0 108.16 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 . . . . . 0 N--CA 1.438 -1.061 0 C-N-CA 126.37 1.868 . . . . 0.0 106.008 179.467 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.6 mt . . . . . 0 N--CA 1.443 -0.805 0 N-CA-C 104.311 -2.477 . . . . 0.0 104.311 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -113.56 -169.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.303 0 C-N-CA 125.631 1.572 . . . . 0.0 107.961 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.97 80.73 1.86 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 124.406 1.083 . . . . 0.0 108.431 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.35 126.97 66.7 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 103.665 -2.717 . . . . 0.0 103.665 172.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -78.56 134.19 37.26 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 126.395 1.878 . . . . 0.0 110.919 -175.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.2 p -145.95 168.82 19.93 Favored 'General case' 0 C--N 1.357 0.929 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -166.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.92 26.37 0.64 Allowed 'General case' 0 C--N 1.357 0.9 0 N-CA-C 105.445 -2.058 . . . . 0.0 105.445 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.7 p -168.85 149.77 4.31 Favored Pre-proline 0 C--N 1.361 1.074 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 -177.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -71.86 -13.46 29.27 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.257 3.304 . . . . 0.0 114.727 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -86.63 6.91 28.71 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 126.855 2.062 . . . . 0.0 113.582 170.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -113.09 22.23 14.56 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 127.38 2.272 . . . . 0.0 107.24 170.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.8 t -144.93 -19.01 0.5 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.4 m -82.58 -1.26 50.21 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 126.347 1.859 . . . . 0.0 111.798 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -82.6 -56.81 0.49 Allowed Pre-proline 0 C--N 1.357 0.919 0 C-N-CA 129.357 3.063 . . . . 0.0 111.424 172.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.34 -40.47 5.94 Favored 'Trans proline' 0 C--N 1.365 1.441 0 C-N-CA 124.939 3.759 . . . . 0.0 113.881 172.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.41 -31.8 70.39 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.698 2.399 . . . . 0.0 114.74 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -88.06 -6.73 57.78 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 124.992 1.317 . . . . 0.0 113.252 172.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -87.44 -19.51 27.92 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.749 1.619 . . . . 0.0 111.392 165.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -93.77 -67.38 0.86 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 127.598 2.359 . . . . 0.0 111.089 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -94.75 -10.61 31.07 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 128.089 2.555 . . . . 0.0 112.269 -167.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.22 -79.97 0.31 Allowed Glycine 0 C--N 1.365 2.142 0 C-N-CA 124.882 1.23 . . . . 0.0 113.106 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.37 -15.39 0.44 Allowed 'General case' 0 C--N 1.355 0.824 0 C-N-CA 125.569 1.548 . . . . 0.0 107.092 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.1 t -102.85 74.74 1.35 Allowed 'General case' 0 C--N 1.364 1.228 0 C-N-CA 127.005 2.122 . . . . 0.0 106.134 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.87 122.95 26.52 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 -174.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.59 86.51 0.76 Allowed Glycine 0 C--N 1.363 2.071 0 N-CA-C 107.565 -2.214 . . . . 0.0 107.565 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.72 116.0 28.21 Favored 'General case' 0 C--N 1.359 1.013 0 C-N-CA 125.504 1.521 . . . . 0.0 109.957 -169.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -123.93 143.41 50.4 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -171.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.3 t -122.83 114.87 21.09 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -125.62 124.15 40.55 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 104.429 -2.434 . . . . 0.0 104.429 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.43 -84.13 0.02 OUTLIER 'General case' 0 C--N 1.383 2.03 0 C-N-CA 127.579 2.352 . . . . 0.0 110.88 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.08 53.14 0.19 Allowed Glycine 0 N--CA 1.433 -1.538 0 N-CA-C 106.059 -2.816 . . . . 0.0 106.059 168.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -152.75 153.92 34.17 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 105.982 -1.858 . . . . 0.0 105.982 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.1 t -105.08 145.33 30.65 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 127.384 2.274 . . . . 0.0 108.73 -164.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -126.37 138.67 53.58 Favored 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 126.225 1.81 . . . . 0.0 106.447 175.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.5 m -125.33 112.51 16.43 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 124.473 1.109 . . . . 0.0 108.51 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 . . . . . 0 N--CA 1.438 -1.035 0 C-N-CA 126.931 2.092 . . . . 0.0 106.546 179.732 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.0 mt . . . . . 0 N--CA 1.444 -0.768 0 N-CA-C 102.955 -2.98 . . . . 0.0 102.955 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.0 pt -102.0 -177.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.32 0 C-N-CA 125.435 1.494 . . . . 0.0 109.831 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -126.87 76.8 1.67 Allowed 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.815 1.246 . . . . 0.0 108.196 -173.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.2 t -132.11 130.59 60.99 Favored 'Isoleucine or valine' 0 C--N 1.36 1.058 0 N-CA-C 103.957 -2.608 . . . . 0.0 103.957 173.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -80.56 137.11 36.37 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.202 1.801 . . . . 0.0 110.605 -178.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.82 172.51 12.92 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.83 27.85 0.43 Allowed 'General case' 0 C--N 1.355 0.82 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.4 p -171.23 149.14 2.55 Favored Pre-proline 0 C--N 1.36 1.037 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -71.35 -16.78 31.11 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 124.278 3.319 . . . . 0.0 114.775 169.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.62 -6.84 59.38 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.139 2.176 . . . . 0.0 114.647 172.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -94.49 -4.11 48.72 Favored 'General case' 0 C--N 1.37 1.48 0 C-N-CA 127.173 2.189 . . . . 0.0 110.1 170.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.6 t -116.19 -13.45 11.13 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 127.402 2.281 . . . . 0.0 108.048 -178.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.4 m -84.04 0.09 49.6 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 126.367 1.867 . . . . 0.0 111.304 173.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.27 -59.37 0.53 Allowed Pre-proline 0 C--N 1.358 0.94 0 C-N-CA 129.365 3.066 . . . . 0.0 111.14 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.22 -40.49 3.16 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 124.902 3.735 . . . . 0.0 113.509 174.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.79 -31.13 68.88 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 127.535 2.334 . . . . 0.0 114.747 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.09 -7.87 56.32 Favored 'General case' 0 C--N 1.371 1.516 0 C-N-CA 124.59 1.156 . . . . 0.0 113.289 172.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -86.92 -21.16 26.45 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 125.798 1.639 . . . . 0.0 111.528 165.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.7 mt -92.16 -66.46 0.92 Allowed 'General case' 0 C--N 1.366 1.301 0 C-N-CA 127.601 2.36 . . . . 0.0 111.04 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -95.72 -12.14 25.93 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 128.022 2.529 . . . . 0.0 112.106 -167.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.74 -74.59 0.4 Allowed Glycine 0 C--N 1.364 2.133 0 C-N-CA 124.915 1.245 . . . . 0.0 113.836 164.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -141.72 -36.59 0.43 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.584 1.553 . . . . 0.0 107.218 -170.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.6 t -90.5 75.07 6.78 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.86 2.464 . . . . 0.0 108.346 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.32 124.8 35.24 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -176.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.52 87.06 0.63 Allowed Glycine 0 C--N 1.362 1.992 0 N-CA-C 107.545 -2.222 . . . . 0.0 107.545 172.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.26 115.21 27.12 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.286 1.434 . . . . 0.0 109.721 -171.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -123.33 142.27 51.13 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.9 t -123.56 113.87 19.29 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 105.885 -1.894 . . . . 0.0 105.885 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 79.0 mtp -120.38 123.4 42.98 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 175.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 78.58 -84.78 0.02 OUTLIER 'General case' 0 C--N 1.383 2.039 0 C-N-CA 127.512 2.325 . . . . 0.0 110.936 174.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.8 55.28 0.2 Allowed Glycine 0 N--CA 1.434 -1.499 0 N-CA-C 105.806 -2.917 . . . . 0.0 105.806 168.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -154.04 152.5 30.57 Favored 'General case' 0 C--N 1.363 1.18 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.91 146.44 29.98 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 127.438 2.295 . . . . 0.0 109.568 -163.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -126.13 141.82 51.78 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.294 1.838 . . . . 0.0 106.793 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -124.79 122.89 38.73 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.255 1.022 . . . . 0.0 108.261 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 . . . . . 0 N--CA 1.435 -1.178 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 179.691 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.9 mt . . . . . 0 N--CA 1.444 -0.767 0 N-CA-C 103.51 -2.774 . . . . 0.0 103.51 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.4 pt -104.16 -176.72 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.279 1.431 . . . . 0.0 109.299 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -127.73 77.19 1.73 Allowed 'General case' 0 C--N 1.362 1.115 0 C-N-CA 124.699 1.2 . . . . 0.0 107.8 -175.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.433 HG11 ' HG3' ' A' ' 16' ' ' PRO . 12.3 t -129.98 129.69 65.87 Favored 'Isoleucine or valine' 0 C--N 1.361 1.087 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 172.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -79.72 137.02 36.92 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 126.451 1.901 . . . . 0.0 110.447 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -145.86 173.43 12.14 Favored 'General case' 0 C--N 1.358 0.965 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.96 27.27 0.42 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 p -172.06 147.32 1.87 Allowed Pre-proline 0 C--N 1.359 1.017 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -71.07 -13.71 31.52 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.609 3.539 . . . . 0.0 114.28 167.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -72.18 -23.27 61.24 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 128.879 2.872 . . . . 0.0 114.438 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -89.42 -8.74 52.4 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 127.555 2.342 . . . . 0.0 110.931 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -110.45 -15.24 13.96 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 126.984 2.114 . . . . 0.0 109.417 -178.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.3 p -87.89 3.01 50.07 Favored 'General case' 0 C--N 1.369 1.422 0 O-C-N 120.179 -1.576 . . . . 0.0 111.156 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -79.87 -58.25 0.63 Allowed Pre-proline 0 C--N 1.359 1.002 0 C-N-CA 129.846 3.258 . . . . 0.0 111.347 170.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.433 ' HG3' HG11 ' A' ' 5' ' ' VAL . 67.0 Cg_endo -70.15 -40.22 4.95 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 125.119 3.879 . . . . 0.0 113.756 173.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -69.78 -31.68 69.75 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.647 2.379 . . . . 0.0 114.796 -176.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -88.1 -8.0 56.11 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 124.952 1.301 . . . . 0.0 113.16 172.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -86.85 -20.16 27.89 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 125.81 1.644 . . . . 0.0 111.434 165.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.5 mt -92.02 -66.66 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.692 2.397 . . . . 0.0 111.097 177.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -96.9 -11.21 25.02 Favored 'General case' 0 C--N 1.362 1.129 0 C-N-CA 127.914 2.486 . . . . 0.0 112.288 -166.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -78.55 0.43 Allowed Glycine 0 C--N 1.363 2.08 0 C-N-CA 124.933 1.254 . . . . 0.0 113.097 166.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.7 m -148.47 -6.96 0.4 Allowed 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.764 1.625 . . . . 0.0 107.201 -175.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.7 t -107.39 64.46 0.63 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 126.77 2.028 . . . . 0.0 106.156 178.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -124.6 127.0 46.71 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 125.944 1.697 . . . . 0.0 107.227 -174.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.92 87.74 0.58 Allowed Glycine 0 C--N 1.362 1.983 0 N-CA-C 107.023 -2.431 . . . . 0.0 107.023 169.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.04 114.75 26.59 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 125.227 1.411 . . . . 0.0 109.868 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -124.42 140.53 52.86 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 -171.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.3 t -124.33 119.2 28.59 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.5 mtt -127.42 126.98 43.37 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.05 -84.24 0.02 OUTLIER 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.553 2.341 . . . . 0.0 110.82 173.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.3 55.94 0.17 Allowed Glycine 0 N--CA 1.432 -1.586 0 N-CA-C 106.088 -2.805 . . . . 0.0 106.088 167.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -154.0 151.54 29.49 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.5 t -106.81 146.69 30.6 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.543 2.337 . . . . 0.0 109.367 -163.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -127.29 139.12 53.11 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 106.701 174.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.8 m -123.81 116.15 22.51 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 124.458 1.103 . . . . 0.0 108.043 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 . . . . . 0 N--CA 1.439 -1.016 0 C-N-CA 126.51 1.924 . . . . 0.0 106.883 -179.776 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 45.5 mt . . . . . 0 N--CA 1.443 -0.787 0 N-CA-C 103.728 -2.693 . . . . 0.0 103.728 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 33.6 pt -103.21 -173.11 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.39 1.476 . . . . 0.0 109.015 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -134.95 78.16 1.72 Allowed 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.244 1.018 . . . . 0.0 108.379 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.3 t -128.31 128.1 68.05 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.725 -2.694 . . . . 0.0 103.725 172.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -79.2 134.62 36.68 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.354 1.861 . . . . 0.0 110.472 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -144.39 169.47 17.86 Favored 'General case' 0 C--N 1.358 0.961 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -167.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -148.8 18.86 1.01 Allowed 'General case' 0 C--N 1.353 0.733 0 C-N-CA 125.874 1.67 . . . . 0.0 106.515 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.7 p -169.6 151.19 4.25 Favored Pre-proline 0 C--N 1.36 1.033 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 -175.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -71.26 -15.15 31.68 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 124.597 3.531 . . . . 0.0 114.326 166.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -73.63 -19.61 60.81 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.306 2.642 . . . . 0.0 114.744 170.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.0 tp60 -88.96 -13.76 38.2 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.415 2.686 . . . . 0.0 110.883 175.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.7 t -106.29 -13.79 15.29 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.11 2.164 . . . . 0.0 109.407 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.2 p -87.82 4.41 44.61 Favored 'General case' 0 C--N 1.368 1.398 0 O-C-N 120.303 -1.498 . . . . 0.0 111.251 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.04 -59.33 0.63 Allowed Pre-proline 0 C--N 1.361 1.107 0 C-N-CA 129.279 3.032 . . . . 0.0 111.139 169.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.72 -39.41 4.68 Favored 'Trans proline' 0 C--N 1.366 1.484 0 C-N-CA 125.089 3.859 . . . . 0.0 113.651 174.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.7 m -70.78 -30.32 66.77 Favored 'General case' 0 C--N 1.368 1.398 0 C-N-CA 127.57 2.348 . . . . 0.0 114.818 -176.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -88.08 -8.85 54.89 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 124.787 1.235 . . . . 0.0 112.682 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -86.43 -19.93 28.91 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 125.731 1.612 . . . . 0.0 111.696 166.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.1 mt -94.01 -67.9 0.83 Allowed 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.521 2.328 . . . . 0.0 110.873 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -93.99 -10.47 33.51 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 128.169 2.587 . . . . 0.0 112.2 -168.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.1 -79.71 0.42 Allowed Glycine 0 C--N 1.364 2.136 0 C-N-CA 124.897 1.237 . . . . 0.0 113.69 164.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.3 m -145.2 -15.39 0.51 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.681 1.592 . . . . 0.0 107.284 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.0 t -105.6 72.66 0.98 Allowed 'General case' 0 C--N 1.364 1.239 0 C-N-CA 126.835 2.054 . . . . 0.0 105.89 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.43 121.9 30.08 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 125.687 1.595 . . . . 0.0 106.864 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.97 84.27 0.64 Allowed Glycine 0 C--N 1.365 2.178 0 N-CA-C 107.672 -2.171 . . . . 0.0 107.672 171.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.04 117.08 29.66 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.532 1.533 . . . . 0.0 110.141 -170.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -124.64 140.33 53.04 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 -171.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.2 t -124.62 119.4 28.92 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 -178.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -129.39 126.3 38.51 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 103.857 -2.646 . . . . 0.0 103.857 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.2 m120 78.6 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.008 0 C-N-CA 127.564 2.346 . . . . 0.0 110.968 174.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.34 55.64 0.18 Allowed Glycine 0 N--CA 1.432 -1.567 0 N-CA-C 106.069 -2.812 . . . . 0.0 106.069 168.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -154.01 153.16 31.46 Favored 'General case' 0 C--N 1.362 1.141 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -107.54 146.07 32.33 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 127.596 2.358 . . . . 0.0 109.092 -164.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -127.65 139.47 52.7 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.391 1.876 . . . . 0.0 106.451 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -121.58 118.72 29.94 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 124.563 1.145 . . . . 0.0 108.149 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 . . . . . 0 N--CA 1.436 -1.146 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 179.214 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.414 HG23 ' HG2' ' A' ' 35' ' ' LYS . 85.4 mt . . . . . 0 CA--C 1.511 -0.558 0 N-CA-C 105.82 -1.918 . . . . 0.0 105.82 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.6 pt -102.47 179.22 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.082 0 C-N-CA 125.272 1.429 . . . . 0.0 111.113 -171.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -120.41 67.96 0.85 Allowed 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.741 1.616 . . . . 0.0 108.42 -172.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.2 t -125.91 129.64 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -87.68 133.73 33.78 Favored 'General case' 0 C--N 1.363 1.185 0 C-N-CA 125.98 1.712 . . . . 0.0 108.991 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -138.5 175.26 9.72 Favored 'General case' 0 C--N 1.358 0.947 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -168.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -154.54 23.12 0.47 Allowed 'General case' 0 C--N 1.356 0.855 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.3 p -173.68 149.39 1.58 Allowed Pre-proline 0 C--N 1.361 1.1 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -173.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -71.4 -16.34 31.01 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.189 3.259 . . . . 0.0 114.617 168.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -78.31 -13.75 59.71 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 127.624 2.37 . . . . 0.0 114.897 173.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -88.2 -11.26 47.23 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 127.962 2.505 . . . . 0.0 110.324 171.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -110.13 -12.34 14.5 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 127.322 2.249 . . . . 0.0 108.758 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.6 m -85.68 -1.65 57.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.535 1.934 . . . . 0.0 111.12 173.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -79.08 -59.27 0.63 Allowed Pre-proline 0 C--N 1.359 0.979 0 C-N-CA 129.203 3.001 . . . . 0.0 111.319 171.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.22 -41.9 2.3 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 125.004 3.803 . . . . 0.0 113.551 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.32 -29.05 65.66 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.656 2.383 . . . . 0.0 114.813 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -88.0 -8.39 55.7 Favored 'General case' 0 C--N 1.37 1.476 0 CA-C-N 120.069 1.304 . . . . 0.0 113.545 170.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -86.55 -20.74 27.53 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.694 1.598 . . . . 0.0 111.536 166.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.9 mt -93.96 -66.21 0.93 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.549 2.339 . . . . 0.0 111.141 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -95.4 -7.76 37.5 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.812 2.445 . . . . 0.0 112.212 -167.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.8 -78.77 0.37 Allowed Glycine 0 C--N 1.366 2.196 0 C-N-CA 125.124 1.345 . . . . 0.0 113.334 165.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.413 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -153.12 -7.92 0.17 Allowed 'General case' 0 C--N 1.354 0.787 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.413 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.3 t -104.93 69.7 0.88 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.103 2.161 . . . . 0.0 105.687 175.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.99 127.49 41.76 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 125.709 1.604 . . . . 0.0 106.691 -175.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.56 89.57 0.66 Allowed Glycine 0 C--N 1.36 1.91 0 N-CA-C 107.084 -2.406 . . . . 0.0 107.084 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.11 116.52 29.11 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 125.144 1.378 . . . . 0.0 109.736 -171.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -123.44 141.73 51.7 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 -173.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -123.03 110.29 15.16 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 -178.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 49.9 mtt -117.38 122.8 44.83 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 79.12 -85.34 0.02 OUTLIER 'General case' 0 C--N 1.383 2.022 0 C-N-CA 127.561 2.345 . . . . 0.0 110.204 175.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.28 56.49 0.18 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 105.218 -3.153 . . . . 0.0 105.218 169.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -152.37 149.88 29.09 Favored 'General case' 0 C--N 1.362 1.135 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.0 t -105.83 142.33 35.74 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.238 2.215 . . . . 0.0 109.086 -165.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.414 ' HG2' HG23 ' A' ' 2' ' ' ILE . 51.6 mtmt -120.82 146.14 46.86 Favored 'General case' 0 CA--C 1.5 -0.96 0 C-N-CA 126.219 1.807 . . . . 0.0 107.168 172.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.88 142.84 48.31 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 . . . . . 0 N--CA 1.431 -1.381 0 N-CA-C 103.631 -2.729 . . . . 0.0 103.631 177.151 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 38.1 mt . . . . . 0 N--CA 1.446 -0.666 0 N-CA-C 104.377 -2.453 . . . . 0.0 104.377 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -107.65 -174.88 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.295 0 C-N-CA 125.143 1.377 . . . . 0.0 109.189 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 -131.63 80.05 1.91 Allowed 'General case' 0 C--N 1.361 1.101 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.8 t -129.16 126.46 64.2 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -85.75 138.19 32.27 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.902 1.681 . . . . 0.0 108.872 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 p -146.74 171.07 15.71 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -162.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.63 21.73 0.71 Allowed 'General case' 0 C--N 1.355 0.817 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 174.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.8 p -170.15 149.96 3.44 Favored Pre-proline 0 C--N 1.36 1.036 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -70.98 -17.37 32.09 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.443 3.429 . . . . 0.0 114.55 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -79.8 -10.86 59.83 Favored 'General case' 0 C--N 1.369 1.455 0 C-N-CA 127.353 2.261 . . . . 0.0 114.923 173.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -89.03 -10.64 46.77 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 127.685 2.394 . . . . 0.0 110.248 170.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.5 t -108.83 -14.6 14.55 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.193 2.197 . . . . 0.0 108.646 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.6 m -83.97 -0.68 52.52 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 126.208 1.803 . . . . 0.0 111.358 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -79.15 -59.65 0.6 Allowed Pre-proline 0 C--N 1.358 0.969 0 C-N-CA 128.85 2.86 . . . . 0.0 111.277 170.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.04 -42.51 3.05 Favored 'Trans proline' 0 C--N 1.366 1.451 0 C-N-CA 125.017 3.812 . . . . 0.0 113.423 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.5 -32.59 72.67 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 127.442 2.297 . . . . 0.0 115.135 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -88.06 -7.41 57.04 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 124.429 1.092 . . . . 0.0 112.605 173.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -87.82 -22.57 24.41 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 125.795 1.638 . . . . 0.0 111.73 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.06 -66.68 0.91 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 127.527 2.331 . . . . 0.0 110.964 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -91.95 -18.65 23.4 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 128.21 2.604 . . . . 0.0 111.685 -169.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.96 -75.21 0.46 Allowed Glycine 0 C--N 1.365 2.192 0 C-N-CA 125.081 1.324 . . . . 0.0 113.211 165.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.3 m -144.95 -9.48 0.6 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.227 1.811 . . . . 0.0 107.694 -171.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.6 t -111.31 61.99 0.61 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 126.353 1.861 . . . . 0.0 106.216 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.8 124.09 45.27 Favored 'General case' 0 C--N 1.358 0.959 0 C-N-CA 126.063 1.745 . . . . 0.0 107.458 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.11 85.77 0.47 Allowed Glycine 0 C--N 1.362 2.012 0 N-CA-C 106.652 -2.579 . . . . 0.0 106.652 168.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.84 111.96 23.72 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 125.224 1.409 . . . . 0.0 110.094 -168.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -119.68 146.23 45.77 Favored 'General case' 0 CA--C 1.497 -1.089 0 C-N-CA 125.194 1.397 . . . . 0.0 107.268 -171.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.5 t -129.97 114.87 16.37 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.1 mmt -126.78 127.02 44.39 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 176.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 80.11 -83.65 0.02 OUTLIER 'General case' 0 C--N 1.383 2.048 0 C-N-CA 127.469 2.308 . . . . 0.0 109.946 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.26 56.83 0.12 Allowed Glycine 0 N--CA 1.431 -1.675 0 N-CA-C 105.42 -3.072 . . . . 0.0 105.42 168.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -153.68 152.08 30.4 Favored 'General case' 0 C--N 1.364 1.198 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -106.19 142.72 35.41 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 127.713 2.405 . . . . 0.0 109.314 -164.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -124.87 138.01 54.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 126.045 1.738 . . . . 0.0 106.887 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.1 m -121.27 110.71 16.47 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 124.428 1.091 . . . . 0.0 108.103 178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 . . . . . 0 N--CA 1.44 -0.945 0 C-N-CA 126.744 2.018 . . . . 0.0 107.858 -179.84 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.3 mt . . . . . 0 CA--C 1.513 -0.448 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.9 pt -101.67 -178.41 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.221 0 C-N-CA 125.819 1.648 . . . . 0.0 109.852 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.71 76.63 1.69 Allowed 'General case' 0 C--N 1.362 1.132 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.404 HG11 ' HG3' ' A' ' 16' ' ' PRO . 18.4 t -127.23 126.08 67.23 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 172.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -83.49 132.54 34.94 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.962 1.705 . . . . 0.0 110.151 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -141.66 171.56 13.89 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -165.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.43 26.93 0.51 Allowed 'General case' 0 C--N 1.356 0.87 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 170.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -170.13 148.76 3.11 Favored Pre-proline 0 C--N 1.359 1.006 0 N-CA-C 105.196 -2.15 . . . . 0.0 105.196 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -71.58 -15.93 30.51 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.216 3.278 . . . . 0.0 114.764 169.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -79.43 -11.04 59.92 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.493 2.317 . . . . 0.0 114.356 171.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -92.23 -2.23 56.62 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 127.216 2.207 . . . . 0.0 110.238 171.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.81 -13.55 9.53 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.254 2.221 . . . . 0.0 108.243 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -85.1 -0.84 55.83 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 126.077 1.751 . . . . 0.0 111.251 174.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.9 mmmm -81.45 -57.31 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.927 0 C-N-CA 128.915 2.886 . . . . 0.0 111.282 171.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.404 ' HG3' HG11 ' A' ' 5' ' ' VAL . 61.9 Cg_endo -70.04 -41.36 3.98 Favored 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 124.796 3.664 . . . . 0.0 113.832 173.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.75 -30.59 68.22 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.522 2.329 . . . . 0.0 114.824 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.05 -7.62 56.74 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 124.747 1.219 . . . . 0.0 113.071 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.69 -20.26 26.51 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 125.656 1.582 . . . . 0.0 111.706 165.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.0 mt -94.9 -67.86 0.83 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.499 2.32 . . . . 0.0 110.967 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -91.65 -13.22 32.18 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 128.373 2.669 . . . . 0.0 111.789 -169.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.95 -75.63 0.29 Allowed Glycine 0 C--N 1.365 2.148 0 C-N-CA 124.916 1.246 . . . . 0.0 113.942 162.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.41 -34.76 0.48 Allowed 'General case' 0 C--N 1.354 0.795 0 C-N-CA 125.543 1.537 . . . . 0.0 107.071 -170.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 t -92.61 78.93 4.86 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.877 2.471 . . . . 0.0 107.778 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -132.82 120.13 21.17 Favored 'General case' 0 C--N 1.361 1.077 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.32 85.53 0.73 Allowed Glycine 0 C--N 1.363 2.076 0 N-CA-C 107.638 -2.185 . . . . 0.0 107.638 172.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.18 117.6 30.26 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.65 1.58 . . . . 0.0 110.095 -169.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -123.99 141.39 52.09 Favored 'General case' 0 C--N 1.362 1.146 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -171.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.5 t -122.68 111.0 16.22 Favored 'General case' 0 C--N 1.351 0.671 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.3 mtp -117.81 123.67 46.52 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 105.109 -2.182 . . . . 0.0 105.109 175.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.58 -84.3 0.02 OUTLIER 'General case' 0 C--N 1.383 2.026 0 C-N-CA 127.641 2.376 . . . . 0.0 110.826 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.04 56.07 0.18 Allowed Glycine 0 N--CA 1.432 -1.571 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -154.0 152.36 30.44 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 175.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.9 t -105.58 145.5 30.88 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 127.262 2.225 . . . . 0.0 109.574 -164.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -126.04 143.62 51.04 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 126.225 1.81 . . . . 0.0 106.964 173.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -127.59 116.6 20.58 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 124.949 1.3 . . . . 0.0 108.298 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 . . . . . 0 N--CA 1.438 -1.053 0 C-N-CA 126.429 1.892 . . . . 0.0 105.935 178.728 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.4 mt . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 pt -103.42 -171.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.273 0 C-N-CA 125.442 1.497 . . . . 0.0 109.335 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -133.48 77.71 1.74 Allowed 'General case' 0 C--N 1.361 1.077 0 C-N-CA 124.464 1.106 . . . . 0.0 108.685 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -129.49 127.7 65.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 171.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -82.43 132.78 35.2 Favored 'General case' 0 C--N 1.366 1.289 0 C-N-CA 125.964 1.706 . . . . 0.0 109.9 -176.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.0 p -141.38 166.62 24.25 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 123.821 1.772 . . . . 0.0 110.079 -165.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 83.3 m -128.91 -49.11 1.23 Allowed 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 129.634 3.174 . . . . 0.0 104.699 -174.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.9 p -114.23 163.24 19.64 Favored Pre-proline 0 C--N 1.36 1.058 0 C-N-CA 127.443 2.297 . . . . 0.0 109.011 -177.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -72.6 -17.31 26.51 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.546 3.497 . . . . 0.0 114.409 164.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.68 -14.98 60.36 Favored 'General case' 0 C--N 1.372 1.57 0 C-N-CA 127.681 2.392 . . . . 0.0 114.469 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -84.81 -14.63 47.46 Favored 'General case' 0 C--N 1.37 1.491 0 C-N-CA 128.399 2.679 . . . . 0.0 110.62 172.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -107.46 -14.08 14.94 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 127.343 2.257 . . . . 0.0 109.077 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.7 m -84.52 -2.06 56.75 Favored 'General case' 0 C--N 1.369 1.413 0 C-N-CA 126.067 1.747 . . . . 0.0 111.386 174.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -80.43 -57.29 0.63 Allowed Pre-proline 0 N--CA 1.442 -0.866 0 C-N-CA 129.042 2.937 . . . . 0.0 111.5 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.63 -41.52 4.37 Favored 'Trans proline' 0 C--N 1.365 1.434 0 C-N-CA 124.984 3.789 . . . . 0.0 114.049 173.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.75 -30.9 68.59 Favored 'General case' 0 C--N 1.368 1.379 0 C-N-CA 127.579 2.352 . . . . 0.0 114.815 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -88.08 -7.7 56.58 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 124.921 1.288 . . . . 0.0 113.33 172.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -86.99 -20.12 27.71 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 125.654 1.582 . . . . 0.0 111.436 165.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.4 mt -92.39 -66.51 0.92 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 127.51 2.324 . . . . 0.0 111.168 177.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.2 -8.83 29.04 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 128.032 2.533 . . . . 0.0 112.245 -166.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.64 0.46 Allowed Glycine 0 C--N 1.364 2.109 0 C-N-CA 125.042 1.306 . . . . 0.0 113.377 165.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.42 -8.65 0.38 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 125.843 1.657 . . . . 0.0 107.143 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.1 t -106.56 67.78 0.73 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 126.822 2.049 . . . . 0.0 105.933 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.74 126.26 43.16 Favored 'General case' 0 CA--C 1.5 -0.969 0 C-N-CA 125.748 1.619 . . . . 0.0 106.946 -174.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.79 88.07 0.63 Allowed Glycine 0 C--N 1.361 1.97 0 N-CA-C 107.372 -2.291 . . . . 0.0 107.372 170.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.97 114.17 25.86 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 125.048 1.339 . . . . 0.0 109.84 -171.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.65 141.95 48.88 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -173.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.0 t -122.2 110.37 15.64 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -120.9 123.42 42.47 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.02 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.591 2.356 . . . . 0.0 110.901 177.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.91 54.62 0.17 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.631 -2.988 . . . . 0.0 105.631 168.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -152.55 152.3 31.71 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.6 t -105.15 144.29 32.16 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.16 2.184 . . . . 0.0 109.417 -165.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -125.28 139.69 53.49 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 126.463 1.905 . . . . 0.0 107.181 173.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.9 m -123.76 118.97 28.39 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.361 1.064 . . . . 0.0 108.319 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 . . . . . 0 N--CA 1.438 -1.074 0 C-N-CA 126.569 1.948 . . . . 0.0 106.381 179.961 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt -103.54 -170.77 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.337 0 C-N-CA 125.601 1.56 . . . . 0.0 109.142 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -135.01 78.43 1.73 Allowed 'General case' 0 C--N 1.361 1.07 0 C-N-CA 124.33 1.052 . . . . 0.0 108.555 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.0 t -128.87 127.21 66.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.7 133.13 34.82 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 125.613 1.565 . . . . 0.0 110.201 -174.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -142.12 171.71 13.68 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -165.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -153.28 27.33 0.51 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 169.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.3 p -170.53 149.22 2.97 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -71.31 -14.25 31.14 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 124.228 3.286 . . . . 0.0 114.822 168.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -87.75 9.43 21.7 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 126.71 2.004 . . . . 0.0 113.464 171.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -113.1 19.55 17.08 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.189 2.196 . . . . 0.0 107.614 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.3 t -142.58 -16.06 0.72 Allowed 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.36 1.864 . . . . 0.0 109.001 -175.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.8 m -83.83 -0.7 52.2 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 126.333 1.853 . . . . 0.0 111.717 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.1 mptp? -83.13 -57.3 0.44 Allowed Pre-proline 0 C--N 1.358 0.959 0 C-N-CA 129.069 2.947 . . . . 0.0 110.885 173.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.83 -40.01 5.71 Favored 'Trans proline' 0 C--N 1.367 1.521 0 C-N-CA 124.877 3.718 . . . . 0.0 113.714 174.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -70.07 -31.44 69.05 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 127.805 2.442 . . . . 0.0 114.782 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -88.07 -5.02 58.69 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 124.78 1.232 . . . . 0.0 113.463 171.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -87.05 -24.92 24.45 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 125.98 1.712 . . . . 0.0 110.655 164.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.9 mt -89.78 -63.38 1.29 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.473 2.309 . . . . 0.0 111.913 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -98.21 -9.05 26.24 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 127.797 2.439 . . . . 0.0 111.893 -167.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.56 -80.12 0.36 Allowed Glycine 0 C--N 1.365 2.176 0 C-N-CA 124.898 1.237 . . . . 0.0 113.407 165.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 24' ' ' SER . 74.8 m -146.31 -15.79 0.44 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.458 1.503 . . . . 0.0 107.006 -176.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.5 t -102.71 74.3 1.34 Allowed 'General case' 0 C--N 1.365 1.265 0 C-N-CA 126.948 2.099 . . . . 0.0 106.435 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -130.27 125.45 34.83 Favored 'General case' 0 C--N 1.36 1.025 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 -176.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.99 85.91 0.65 Allowed Glycine 0 C--N 1.362 2.016 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 171.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.05 117.74 30.53 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.49 1.516 . . . . 0.0 109.964 -170.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -124.51 144.32 50.18 Favored 'General case' 0 C--N 1.362 1.138 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -170.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -122.96 113.46 19.11 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -126.01 125.85 43.32 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 104.438 -2.43 . . . . 0.0 104.438 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 81.04 -86.25 0.02 OUTLIER 'General case' 0 C--N 1.384 2.068 0 C-N-CA 127.592 2.357 . . . . 0.0 109.158 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -173.23 54.51 0.16 Allowed Glycine 0 N--CA 1.432 -1.593 0 N-CA-C 104.923 -3.271 . . . . 0.0 104.923 166.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -150.23 152.95 35.39 Favored 'General case' 0 C--N 1.365 1.27 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.9 t -105.05 144.12 32.3 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 126.771 2.029 . . . . 0.0 109.297 -164.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -124.32 142.31 51.37 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 126.179 1.792 . . . . 0.0 106.774 174.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.8 m -125.97 119.01 26.58 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 124.342 1.057 . . . . 0.0 108.198 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 . . . . . 0 N--CA 1.436 -1.146 0 N-CA-C 105.769 -1.938 . . . . 0.0 105.769 178.997 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.6 mt . . . . . 0 N--CA 1.443 -0.793 0 N-CA-C 102.897 -3.001 . . . . 0.0 102.897 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.0 pt -99.5 -177.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.314 0 C-N-CA 125.556 1.543 . . . . 0.0 110.235 -178.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.39 74.47 1.52 Allowed 'General case' 0 C--N 1.362 1.146 0 C-N-CA 124.813 1.245 . . . . 0.0 107.957 -174.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.4 t -126.81 122.6 60.95 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 N-CA-C 103.36 -2.83 . . . . 0.0 103.36 171.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -85.62 136.45 33.37 Favored 'General case' 0 C--N 1.364 1.226 0 C-N-CA 125.771 1.628 . . . . 0.0 109.029 -173.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 p -145.61 170.47 16.39 Favored 'General case' 0 C--N 1.356 0.891 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 -160.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.43 22.63 0.72 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.789 -1.93 . . . . 0.0 105.789 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 p -170.62 148.36 2.71 Favored Pre-proline 0 C--N 1.36 1.054 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -174.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -71.52 -13.36 30.13 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 124.632 3.554 . . . . 0.0 114.291 165.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -75.57 -15.22 60.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 128.156 2.582 . . . . 0.0 114.786 170.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -91.85 -9.8 42.05 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 128.052 2.541 . . . . 0.0 110.332 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.7 t -112.64 -12.86 13.35 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.857 2.063 . . . . 0.0 109.456 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.2 p -87.96 0.43 55.9 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 125.71 1.604 . . . . 0.0 111.345 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -78.96 -58.05 0.73 Allowed Pre-proline 0 C--N 1.36 1.053 0 C-N-CA 128.42 2.688 . . . . 0.0 111.775 169.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.98 -41.41 2.74 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.945 3.763 . . . . 0.0 113.204 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -69.89 -31.66 69.58 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.831 2.452 . . . . 0.0 114.971 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -88.01 -6.64 57.88 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 124.659 1.184 . . . . 0.0 113.304 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.09 -22.32 22.96 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 126.255 1.822 . . . . 0.0 111.638 165.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.2 mt -91.3 -68.17 0.81 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.287 2.235 . . . . 0.0 110.966 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.24 -30.07 15.37 Favored 'General case' 0 C--N 1.36 1.055 0 C-N-CA 128.001 2.52 . . . . 0.0 111.672 -167.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.48 -169.64 14.88 Favored Glycine 0 C--N 1.36 1.883 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 34.2 m -69.23 -4.92 19.73 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 128.496 2.719 . . . . 0.0 116.302 -174.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 t -109.57 67.1 0.64 Allowed 'General case' 0 C--N 1.363 1.159 0 C-N-CA 126.717 2.007 . . . . 0.0 106.196 167.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.47 140.73 49.04 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.055 1.742 . . . . 0.0 106.6 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.82 87.11 0.62 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.476 -2.25 . . . . 0.0 107.476 173.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.94 112.59 24.29 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.357 1.463 . . . . 0.0 109.425 -171.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -123.23 139.0 54.5 Favored 'General case' 0 C--N 1.362 1.111 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -171.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.9 t -119.88 112.45 19.23 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -121.97 123.52 41.86 Favored 'General case' 0 C--N 1.358 0.957 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 37.7 t30 79.23 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.381 1.963 0 C-N-CA 127.285 2.234 . . . . 0.0 110.217 175.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.48 55.35 0.17 Allowed Glycine 0 N--CA 1.432 -1.599 0 N-CA-C 105.495 -3.042 . . . . 0.0 105.495 168.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -154.05 153.95 32.81 Favored 'General case' 0 C--N 1.363 1.175 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -105.03 148.47 26.72 Favored 'General case' 0 C--N 1.359 0.983 0 C-N-CA 127.23 2.212 . . . . 0.0 109.454 -165.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -128.15 142.66 51.12 Favored 'General case' 0 CA--C 1.501 -0.921 0 C-N-CA 126.238 1.815 . . . . 0.0 106.89 174.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.8 m -123.67 123.72 41.17 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 . . . . . 0 N--CA 1.437 -1.12 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.665 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt . . . . . 0 N--CA 1.444 -0.766 0 N-CA-C 102.995 -2.965 . . . . 0.0 102.995 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.1 pt -99.8 -178.93 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.287 0 C-N-CA 125.576 1.55 . . . . 0.0 109.858 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -127.21 75.66 1.6 Allowed 'General case' 0 C--N 1.363 1.183 0 C-N-CA 124.541 1.137 . . . . 0.0 107.935 -174.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.413 HG11 ' HG3' ' A' ' 16' ' ' PRO . 15.6 t -129.38 129.22 67.08 Favored 'Isoleucine or valine' 0 C--N 1.36 1.055 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 172.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -82.59 140.88 32.98 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 125.914 1.686 . . . . 0.0 109.613 -175.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.9 p -147.67 167.35 24.83 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -167.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -148.83 22.12 1.0 Allowed 'General case' 0 C--N 1.355 0.81 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 171.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.0 p -169.01 150.73 4.53 Favored Pre-proline 0 C--N 1.361 1.067 0 N-CA-C 105.304 -2.109 . . . . 0.0 105.304 -175.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -71.62 -16.32 30.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.114 3.21 . . . . 0.0 114.815 169.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.51 -4.82 57.02 Favored 'General case' 0 C--N 1.369 1.437 0 C-N-CA 127.009 2.123 . . . . 0.0 114.569 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -99.14 3.01 46.42 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 127.161 2.184 . . . . 0.0 109.648 171.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -122.99 -14.04 7.68 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 127.465 2.306 . . . . 0.0 108.007 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 m -85.66 0.66 52.06 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 126.195 1.798 . . . . 0.0 110.81 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.45 -57.21 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.965 0 C-N-CA 129.297 3.039 . . . . 0.0 110.92 172.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.413 ' HG3' HG11 ' A' ' 5' ' ' VAL . 62.2 Cg_endo -70.05 -42.04 3.43 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 124.867 3.711 . . . . 0.0 113.919 171.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.3 -28.98 65.61 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.293 2.237 . . . . 0.0 114.941 -175.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -88.09 -11.08 48.12 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.589 1.156 . . . . 0.0 113.026 171.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -84.78 -20.37 31.13 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 125.527 1.531 . . . . 0.0 111.872 166.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.5 mt -93.42 -67.01 0.88 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.626 2.37 . . . . 0.0 111.03 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -96.78 -6.61 35.75 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 127.866 2.466 . . . . 0.0 112.518 -166.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.22 -78.73 0.52 Allowed Glycine 0 C--N 1.366 2.203 0 C-N-CA 125.074 1.321 . . . . 0.0 113.672 164.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.405 ' H ' ' H ' ' A' ' 24' ' ' SER . 10.1 t -153.2 -7.96 0.17 Allowed 'General case' 0 C--N 1.354 0.776 0 N-CA-C 106.528 -1.656 . . . . 0.0 106.528 -174.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.405 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.5 t -106.21 68.71 0.77 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.001 2.12 . . . . 0.0 105.66 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.86 128.88 48.32 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.013 1.725 . . . . 0.0 106.892 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.46 87.53 0.54 Allowed Glycine 0 C--N 1.362 2.005 0 N-CA-C 106.965 -2.454 . . . . 0.0 106.965 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.42 113.45 25.11 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.235 1.414 . . . . 0.0 109.704 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -124.03 140.36 53.04 Favored 'General case' 0 C--N 1.36 1.054 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -171.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 45.3 t -121.24 113.62 20.21 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.6 mmm -124.23 123.62 40.66 Favored 'General case' 0 C--N 1.359 1.003 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 79.23 -85.73 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.463 2.305 . . . . 0.0 110.266 175.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.76 54.12 0.19 Allowed Glycine 0 N--CA 1.433 -1.522 0 N-CA-C 105.453 -3.059 . . . . 0.0 105.453 169.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -154.02 154.35 33.57 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.2 t -106.1 147.15 29.28 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.368 2.267 . . . . 0.0 109.407 -164.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -126.81 141.06 51.93 Favored 'General case' 0 CA--C 1.501 -0.916 0 C-N-CA 126.165 1.786 . . . . 0.0 106.794 173.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.4 m -123.56 124.42 42.77 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 . . . . . 0 N--CA 1.436 -1.164 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.29 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.434 HG23 ' HG2' ' A' ' 35' ' ' LYS . 88.1 mt . . . . . 0 CA--C 1.511 -0.544 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -105.38 -177.56 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.117 0 C-N-CA 125.938 1.695 . . . . 0.0 109.933 -172.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -127.26 75.93 1.62 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 124.918 1.287 . . . . 0.0 107.686 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 t -126.76 125.66 67.28 Favored 'Isoleucine or valine' 0 C--N 1.362 1.126 0 N-CA-C 103.909 -2.626 . . . . 0.0 103.909 173.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -80.58 133.13 35.73 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.13 1.772 . . . . 0.0 110.067 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.0 169.94 16.66 Favored 'General case' 0 C--N 1.357 0.934 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -166.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.49 22.07 0.72 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.918 -1.882 . . . . 0.0 105.918 174.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 p -170.06 149.51 3.37 Favored Pre-proline 0 C--N 1.36 1.044 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 -175.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -71.64 -16.64 30.16 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.317 3.345 . . . . 0.0 114.601 168.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -82.27 -3.43 55.19 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.931 2.093 . . . . 0.0 114.628 171.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -94.23 -5.81 46.05 Favored 'General case' 0 C--N 1.37 1.499 0 C-N-CA 127.319 2.248 . . . . 0.0 109.827 169.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.0 t -116.35 -13.05 11.03 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 126.921 2.089 . . . . 0.0 108.795 -177.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -86.25 -2.38 58.33 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 126.655 1.982 . . . . 0.0 110.604 172.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -79.15 -57.97 0.72 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.099 2.959 . . . . 0.0 111.389 171.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.18 -45.01 0.96 Allowed 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 124.984 3.789 . . . . 0.0 113.577 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.2 m -69.43 -28.93 66.55 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 127.296 2.238 . . . . 0.0 115.048 -177.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -88.05 -9.3 53.79 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.73 170.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -86.04 -23.28 26.84 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 125.651 1.58 . . . . 0.0 111.319 167.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.8 mt -87.99 -61.16 1.78 Allowed 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.785 2.434 . . . . 0.0 111.389 176.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -107.34 1.71 23.94 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.664 1.986 . . . . 0.0 112.323 -162.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.84 -82.79 0.75 Allowed Glycine 0 C--N 1.365 2.163 0 C-N-CA 125.163 1.363 . . . . 0.0 113.711 165.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.5 m -148.2 -6.75 0.42 Allowed 'General case' 0 C--N 1.355 0.81 0 C-N-CA 125.909 1.684 . . . . 0.0 106.797 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 23' ' ' SER . 22.0 t -102.65 77.89 1.65 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.392 2.277 . . . . 0.0 106.316 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -145.36 125.9 14.12 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.21 87.35 0.66 Allowed Glycine 0 C--N 1.366 2.208 0 N-CA-C 107.535 -2.226 . . . . 0.0 107.535 171.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.1 113.18 25.36 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 125.171 1.388 . . . . 0.0 110.71 -168.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -117.91 145.62 44.52 Favored 'General case' 0 C--N 1.363 1.177 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -125.09 112.95 17.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 105.469 -2.048 . . . . 0.0 105.469 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.85 123.91 41.49 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 104.4 -2.445 . . . . 0.0 104.4 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.0 m120 77.65 -84.03 0.03 OUTLIER 'General case' 0 C--N 1.383 2.027 0 C-N-CA 127.617 2.367 . . . . 0.0 111.09 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.64 55.44 0.16 Allowed Glycine 0 N--CA 1.433 -1.505 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 169.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -152.51 153.02 32.62 Favored 'General case' 0 C--N 1.364 1.197 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.0 t -104.99 142.98 33.82 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.347 2.259 . . . . 0.0 109.238 -165.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HG2' HG23 ' A' ' 2' ' ' ILE . 57.3 mtmt -125.63 145.53 50.11 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 126.031 1.732 . . . . 0.0 108.107 174.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 16.6 m -117.43 135.44 53.89 Favored 'General case' 0 C--N 1.36 1.049 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 . . . . . 0 C--N 1.359 1.009 0 C-N-CA 124.801 1.24 . . . . 0.0 109.097 -174.846 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.8 mt . . . . . 0 N--CA 1.447 -0.616 0 N-CA-C 104.318 -2.475 . . . . 0.0 104.318 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.3 pt -106.68 -172.58 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.249 0 C-N-CA 125.385 1.474 . . . . 0.0 108.949 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -133.33 85.74 2.24 Favored 'General case' 0 C--N 1.361 1.085 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.0 t -131.42 129.45 62.15 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 N-CA-C 103.473 -2.788 . . . . 0.0 103.473 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -79.29 135.38 36.73 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 126.283 1.833 . . . . 0.0 110.187 -178.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.72 173.06 12.17 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -168.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.01 27.34 0.42 Allowed 'General case' 0 C--N 1.355 0.844 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 169.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.3 p -171.32 148.54 2.38 Favored Pre-proline 0 C--N 1.361 1.075 0 N-CA-C 105.1 -2.185 . . . . 0.0 105.1 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -70.7 -17.46 33.28 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 124.286 3.324 . . . . 0.0 114.857 169.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.63 -8.77 59.41 Favored 'General case' 0 C--N 1.368 1.392 0 C-N-CA 127.556 2.342 . . . . 0.0 114.204 172.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -93.96 -1.84 54.03 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 126.954 2.102 . . . . 0.0 110.193 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.8 t -118.51 -12.97 9.74 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 127.157 2.183 . . . . 0.0 108.209 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.3 m -83.47 -1.94 54.75 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 125.987 1.715 . . . . 0.0 112.099 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -80.99 -56.96 0.6 Allowed Pre-proline 0 C--N 1.361 1.067 0 C-N-CA 128.304 2.642 . . . . 0.0 111.358 171.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.26 -40.81 4.16 Favored 'Trans proline' 0 C--N 1.366 1.456 0 C-N-CA 124.78 3.653 . . . . 0.0 113.59 175.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.7 m -69.19 -31.87 70.78 Favored 'General case' 0 C--N 1.368 1.391 0 C-N-CA 127.787 2.435 . . . . 0.0 114.888 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -88.07 -6.01 58.16 Favored 'General case' 0 C--N 1.369 1.436 0 C-N-CA 124.852 1.261 . . . . 0.0 113.267 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -88.59 -20.31 25.16 Favored 'General case' 0 C--N 1.36 1.053 0 C-N-CA 125.906 1.682 . . . . 0.0 111.243 165.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.7 mt -93.1 -67.09 0.88 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.571 2.348 . . . . 0.0 111.119 178.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -95.56 -10.07 30.58 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 128.163 2.585 . . . . 0.0 112.121 -167.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.62 -79.55 0.39 Allowed Glycine 0 C--N 1.365 2.139 0 C-N-CA 125.01 1.29 . . . . 0.0 113.404 165.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.69 -13.38 0.44 Allowed 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.65 1.58 . . . . 0.0 107.071 -175.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 t -104.43 70.18 0.94 Allowed 'General case' 0 C--N 1.366 1.321 0 C-N-CA 126.862 2.065 . . . . 0.0 106.1 177.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.45 126.25 43.47 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.738 1.615 . . . . 0.0 106.826 -175.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.25 86.54 0.57 Allowed Glycine 0 C--N 1.361 1.95 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 171.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.36 114.73 26.83 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 125.185 1.394 . . . . 0.0 109.822 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -121.34 145.54 47.78 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -173.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.1 t -127.93 112.08 14.29 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 65.9 mtt -131.92 130.85 42.11 Favored 'General case' 0 C--N 1.359 1.009 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 79.36 -14.36 0.87 Allowed 'General case' 0 C--N 1.384 2.072 0 C-N-CA 126.869 2.068 . . . . 0.0 114.516 172.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.22 41.18 4.06 Favored Glycine 0 C--N 1.361 1.952 0 C-N-CA 127.36 2.41 . . . . 0.0 110.451 -171.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -148.54 151.33 34.92 Favored 'General case' 0 C--N 1.365 1.246 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.5 t -104.94 140.09 38.69 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.583 1.953 . . . . 0.0 109.462 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -121.76 140.53 52.23 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 126.128 1.771 . . . . 0.0 107.066 173.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.2 m -125.72 113.2 17.01 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 . . . . . 0 N--CA 1.439 -1.013 0 C-N-CA 127.243 2.217 . . . . 0.0 106.767 -179.891 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 103.9 -2.63 . . . . 0.0 103.9 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -102.52 -179.73 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.318 0 C-N-CA 125.715 1.606 . . . . 0.0 110.013 -178.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -123.77 71.9 1.12 Allowed 'General case' 0 C--N 1.363 1.157 0 C-N-CA 125.075 1.35 . . . . 0.0 108.323 -173.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.469 HG11 ' HG3' ' A' ' 16' ' ' PRO . 14.1 t -128.94 131.18 68.44 Favored 'Isoleucine or valine' 0 C--N 1.362 1.111 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 173.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.73 140.18 30.71 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 125.868 1.667 . . . . 0.0 109.308 -173.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 p -146.3 168.56 20.78 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -168.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -153.38 26.02 0.52 Allowed 'General case' 0 C--N 1.355 0.848 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 167.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.4 p -167.46 148.22 4.88 Favored Pre-proline 0 C--N 1.361 1.068 0 N-CA-C 105.19 -2.152 . . . . 0.0 105.19 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -72.59 -14.74 27.52 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 123.966 3.111 . . . . 0.0 114.844 171.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -76.88 -15.97 59.54 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 127.234 2.214 . . . . 0.0 114.28 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -88.65 -3.76 58.71 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 127.262 2.225 . . . . 0.0 110.636 173.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.2 t -117.41 -13.84 10.36 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 127.556 2.342 . . . . 0.0 108.433 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -85.99 -1.85 57.73 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 126.184 1.793 . . . . 0.0 111.075 174.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -77.4 -59.01 0.9 Allowed Pre-proline 0 C--N 1.357 0.895 0 C-N-CA 129.006 2.923 . . . . 0.0 111.813 170.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.469 ' HG3' HG11 ' A' ' 5' ' ' VAL . 71.1 Cg_endo -71.32 -41.04 2.7 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 124.961 3.774 . . . . 0.0 113.676 174.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.47 -29.31 65.83 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 127.509 2.324 . . . . 0.0 114.566 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -88.06 -9.91 51.89 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 124.732 1.213 . . . . 0.0 113.103 171.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -85.5 -20.08 30.22 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 125.613 1.565 . . . . 0.0 111.706 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.1 mt -93.81 -66.53 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.681 2.393 . . . . 0.0 111.092 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -96.12 -7.63 35.44 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.875 2.47 . . . . 0.0 112.346 -167.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.14 -78.91 0.4 Allowed Glycine 0 C--N 1.364 2.125 0 C-N-CA 124.982 1.277 . . . . 0.0 113.445 165.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.7 t -153.06 -8.43 0.17 Allowed 'General case' 0 C--N 1.354 0.775 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 t -106.3 68.78 0.77 Allowed 'General case' 0 C--N 1.365 1.272 0 C-N-CA 126.947 2.099 . . . . 0.0 105.649 175.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.57 126.57 45.01 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 125.956 1.702 . . . . 0.0 106.725 -174.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.29 86.32 0.56 Allowed Glycine 0 C--N 1.361 1.962 0 N-CA-C 107.326 -2.31 . . . . 0.0 107.326 171.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.07 113.09 24.99 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.356 1.462 . . . . 0.0 109.534 -172.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -121.61 137.7 54.63 Favored 'General case' 0 C--N 1.36 1.032 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 -171.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.5 t -115.0 126.62 54.97 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 -177.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 95.9 mmm -110.42 69.14 0.68 Allowed 'General case' 0 C--N 1.359 1.02 0 N-CA-C 104.349 -2.463 . . . . 0.0 104.349 172.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -2.9 71.32 0.0 OUTLIER 'General case' 0 C--N 1.38 1.927 1 C-N-CA 134.678 5.191 . . . . 0.0 118.433 -172.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.48 -39.38 0.58 Allowed Glycine 0 C--N 1.354 1.545 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -164.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -154.06 158.27 40.26 Favored 'General case' 0 C--N 1.37 1.474 0 CA-C-N 119.443 1.622 . . . . 0.0 108.666 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -107.46 153.81 22.27 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 128.661 2.784 . . . . 0.0 109.688 -166.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -131.46 142.77 50.06 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.04 2.136 . . . . 0.0 106.896 175.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.1 m -125.6 122.58 36.87 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.301 1.04 . . . . 0.0 108.748 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 . . . . . 0 N--CA 1.437 -1.082 0 C-N-CA 126.443 1.897 . . . . 0.0 105.911 179.169 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.408 HG23 ' HG2' ' A' ' 35' ' ' LYS . 72.1 mt . . . . . 0 CA--C 1.511 -0.544 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.8 pt -103.72 -176.55 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.597 1.559 . . . . 0.0 110.354 -173.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -127.41 79.86 1.92 Allowed 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -128.37 123.07 59.2 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.038 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 170.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -81.82 130.28 35.01 Favored 'General case' 0 C--N 1.366 1.285 0 C-N-CA 125.954 1.702 . . . . 0.0 109.651 -175.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.1 p -139.01 171.48 14.26 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -164.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.87 22.85 0.68 Allowed 'General case' 0 C--N 1.355 0.847 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 174.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.4 p -171.52 148.01 2.2 Favored Pre-proline 0 C--N 1.36 1.043 0 N-CA-C 105.526 -2.028 . . . . 0.0 105.526 -174.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -71.56 -13.63 30.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.632 3.554 . . . . 0.0 114.173 165.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -75.28 -16.15 60.46 Favored 'General case' 0 C--N 1.369 1.447 0 C-N-CA 128.35 2.66 . . . . 0.0 114.76 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -89.8 -12.05 40.35 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 128.225 2.61 . . . . 0.0 110.441 174.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.8 t -111.82 -12.92 13.75 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 126.797 2.039 . . . . 0.0 109.636 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.2 p -88.04 -1.22 57.86 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 125.613 1.565 . . . . 0.0 111.61 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -78.03 -58.49 0.85 Allowed Pre-proline 0 C--N 1.36 1.03 0 C-N-CA 128.586 2.754 . . . . 0.0 111.668 169.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.9 -43.92 2.27 Favored 'Trans proline' 0 C--N 1.365 1.438 0 C-N-CA 124.98 3.787 . . . . 0.0 113.198 177.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 66.0 m -67.58 -33.58 75.3 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 128.26 2.624 . . . . 0.0 115.411 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -88.06 -5.04 58.69 Favored 'General case' 0 C--N 1.37 1.465 0 CA-C-N 119.628 1.103 . . . . 0.0 113.337 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -88.97 -23.44 22.65 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.97 1.708 . . . . 0.0 111.628 164.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.6 mt -90.77 -64.14 1.17 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 127.41 2.284 . . . . 0.0 111.611 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -90.05 -32.82 16.56 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.154 2.581 . . . . 0.0 110.797 -168.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.66 92.6 1.37 Allowed Glycine 0 C--N 1.364 2.116 0 C-N-CA 124.966 1.27 . . . . 0.0 114.299 163.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . 0.259 20.1 m 83.57 -53.01 0.15 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 128.439 2.696 . . . . 0.0 114.554 169.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.1 t -109.31 71.74 0.78 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 126.652 1.981 . . . . 0.0 107.103 -177.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.96 146.84 34.55 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 125.559 1.544 . . . . 0.0 107.572 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.5 89.44 0.78 Allowed Glycine 0 C--N 1.359 1.854 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.46 115.94 28.12 Favored 'General case' 0 C--N 1.355 0.827 0 C-N-CA 125.283 1.433 . . . . 0.0 109.438 -172.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.6 mtpt -122.81 140.29 53.09 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.1 t -119.44 110.45 16.94 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -120.05 122.91 42.14 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 178.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.44 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.635 2.374 . . . . 0.0 111.195 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.15 55.27 0.18 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 105.38 -3.088 . . . . 0.0 105.38 169.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -153.67 152.2 30.55 Favored 'General case' 0 C--N 1.364 1.203 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 176.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.2 t -105.22 143.15 33.8 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 127.119 2.167 . . . . 0.0 109.214 -166.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG2' HG23 ' A' ' 2' ' ' ILE . 54.0 mtmt -122.06 148.15 45.22 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 126.045 1.738 . . . . 0.0 107.232 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 m -126.02 133.69 51.67 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.434 -1.261 0 N-CA-C 104.561 -2.385 . . . . 0.0 104.561 179.25 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.9 mt . . . . . 0 N--CA 1.445 -0.719 0 N-CA-C 104.398 -2.445 . . . . 0.0 104.398 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -111.53 -171.65 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.631 1.572 . . . . 0.0 108.305 174.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -131.45 82.01 2.01 Favored 'General case' 0 C--N 1.364 1.22 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.448 HG11 ' HG3' ' A' ' 16' ' ' PRO . 9.0 t -132.89 130.0 58.37 Favored 'Isoleucine or valine' 0 C--N 1.361 1.092 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 171.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.68 135.05 35.53 Favored 'General case' 0 C--N 1.366 1.297 0 C-N-CA 125.866 1.666 . . . . 0.0 110.357 -177.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.2 p -143.72 171.8 13.7 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -168.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -153.72 27.28 0.49 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 105.307 -2.109 . . . . 0.0 105.307 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 76.1 p -170.71 149.16 2.84 Favored Pre-proline 0 C--N 1.36 1.04 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -71.69 -13.1 29.58 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 124.46 3.44 . . . . 0.0 114.081 167.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.05 -13.72 59.92 Favored 'General case' 0 C--N 1.371 1.501 0 C-N-CA 128.793 2.837 . . . . 0.0 113.915 172.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -98.17 0.71 46.42 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 127.719 2.408 . . . . 0.0 109.913 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.5 t -122.51 -17.5 6.97 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 126.504 1.922 . . . . 0.0 108.669 -175.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 p -87.04 1.58 52.41 Favored 'General case' 0 C--N 1.369 1.416 0 O-C-N 120.155 -1.591 . . . . 0.0 111.095 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.86 -56.81 0.54 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 129.67 3.188 . . . . 0.0 110.942 170.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.448 ' HG3' HG11 ' A' ' 5' ' ' VAL . 55.6 Cg_endo -67.35 -46.8 2.59 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 124.863 3.709 . . . . 0.0 113.646 171.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -62.87 -37.79 88.28 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.984 2.514 . . . . 0.0 115.517 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.1 -3.25 58.91 Favored 'General case' 0 C--N 1.368 1.4 0 C-N-CA 125.012 1.325 . . . . 0.0 113.447 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -89.02 -25.85 21.76 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 125.401 1.48 . . . . 0.0 111.911 162.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.5 mt -94.58 -61.85 1.43 Allowed 'General case' 0 C--N 1.367 1.332 0 C-N-CA 127.044 2.137 . . . . 0.0 112.844 -173.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -91.41 -33.59 15.19 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 127.092 2.157 . . . . 0.0 112.416 -161.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 173.88 -113.39 0.46 Allowed Glycine 0 C--N 1.356 1.661 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 176.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -148.52 -10.5 0.36 Allowed 'General case' 0 C--N 1.356 0.877 0 C-N-CA 126.258 1.823 . . . . 0.0 106.51 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -128.54 73.87 1.52 Allowed 'General case' 0 C--N 1.362 1.116 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.88 153.37 19.91 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.908 1.683 . . . . 0.0 108.687 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.55 87.35 0.94 Allowed Glycine 0 C--N 1.364 2.124 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.75 115.82 28.09 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 125.239 1.416 . . . . 0.0 109.459 -171.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -124.91 140.6 52.77 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 -172.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -121.33 114.7 21.71 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 -178.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -124.94 124.14 41.4 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 78.41 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.007 0 C-N-CA 127.592 2.357 . . . . 0.0 110.916 176.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.6 54.34 0.18 Allowed Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 105.48 -3.048 . . . . 0.0 105.48 168.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -153.99 151.74 29.73 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 105.631 -1.989 . . . . 0.0 105.631 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.5 t -104.96 145.92 29.76 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 127.44 2.296 . . . . 0.0 109.067 -164.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -125.77 138.86 53.87 Favored 'General case' 0 CA--C 1.499 -1.003 0 C-N-CA 126.34 1.856 . . . . 0.0 106.441 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 66.5 m -125.5 116.11 21.28 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.286 1.034 . . . . 0.0 108.717 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 . . . . . 0 N--CA 1.436 -1.127 0 C-N-CA 127.197 2.199 . . . . 0.0 106.536 179.647 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.9 mt . . . . . 0 N--CA 1.445 -0.712 0 N-CA-C 103.106 -2.924 . . . . 0.0 103.106 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.0 pt -105.8 -175.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.269 0 C-N-CA 125.307 1.443 . . . . 0.0 109.445 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -129.63 78.42 1.85 Allowed 'General case' 0 C--N 1.362 1.114 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.66 127.62 66.9 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 N-CA-C 103.772 -2.677 . . . . 0.0 103.772 172.557 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -80.35 132.84 35.85 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.218 1.807 . . . . 0.0 110.409 -176.116 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.8 p -142.85 173.13 11.82 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 123.219 1.485 . . . . 0.0 109.009 -165.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 96.3 m -142.05 -52.73 0.42 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 102.625 -3.102 . . . . 0.0 102.625 -168.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.7 p -107.98 162.74 18.82 Favored Pre-proline 0 C--N 1.362 1.127 0 C-N-CA 127.635 2.374 . . . . 0.0 109.351 179.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -72.12 -18.35 27.32 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.685 3.59 . . . . 0.0 114.417 164.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.43 -2.29 48.96 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.735 2.014 . . . . 0.0 114.505 171.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -93.13 -10.27 36.52 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.162 2.585 . . . . 0.0 109.773 169.762 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.6 t -112.74 -14.67 13.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 127.511 2.324 . . . . 0.0 108.159 -177.031 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -82.91 -0.69 49.6 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 126.749 2.019 . . . . 0.0 111.25 173.426 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -82.09 -57.65 0.49 Allowed Pre-proline 0 N--CA 1.439 -1.01 0 C-N-CA 129.272 3.029 . . . . 0.0 110.881 172.78 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.07 -43.69 3.07 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 124.911 3.741 . . . . 0.0 113.796 171.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -68.1 -30.39 69.54 Favored 'General case' 0 C--N 1.367 1.36 0 C-N-CA 127.138 2.175 . . . . 0.0 115.215 -176.01 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -88.05 -9.31 53.78 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.946 1.298 . . . . 0.0 113.076 173.108 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -87.5 -22.13 25.07 Favored 'General case' 0 C--N 1.362 1.114 0 C-N-CA 125.917 1.687 . . . . 0.0 112.219 165.735 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.8 mt -96.54 -71.13 0.69 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.214 2.206 . . . . 0.0 110.756 -177.336 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -89.45 -25.89 21.25 Favored 'General case' 0 C--N 1.361 1.102 0 C-N-CA 128.568 2.747 . . . . 0.0 111.531 -169.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.73 -155.86 20.14 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 125.669 1.604 . . . . 0.0 109.826 177.333 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.4 m -72.46 -4.51 30.72 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 128.337 2.655 . . . . 0.0 114.911 179.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.7 t -104.52 71.78 1.01 Allowed 'General case' 0 C--N 1.365 1.245 0 C-N-CA 127.261 2.224 . . . . 0.0 105.73 165.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.46 127.07 36.63 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.6 87.45 0.65 Allowed Glycine 0 C--N 1.361 1.96 0 N-CA-C 107.085 -2.406 . . . . 0.0 107.085 170.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.81 111.37 23.16 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.473 1.509 . . . . 0.0 109.754 -170.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -120.81 141.63 50.36 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -170.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.2 t -122.59 111.77 17.18 Favored 'General case' 0 C--N 1.352 0.675 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 -178.194 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.8 mmm -120.59 124.79 46.15 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 104.415 -2.439 . . . . 0.0 104.415 178.55 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.47 12.5 p30 70.41 -79.07 0.04 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 128.647 2.779 . . . . 0.0 113.596 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.23 54.0 0.14 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.854 -2.898 . . . . 0.0 105.854 169.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -153.23 151.49 30.13 Favored 'General case' 0 C--N 1.361 1.095 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 176.428 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.11 144.37 32.0 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.212 2.205 . . . . 0.0 109.295 -163.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -124.99 140.63 52.75 Favored 'General case' 0 CA--C 1.501 -0.912 0 C-N-CA 126.01 1.724 . . . . 0.0 107.027 174.219 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -125.31 110.79 14.42 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.307 1.043 . . . . 0.0 108.492 179.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 . . . . . 0 C--N 1.357 0.928 0 C-N-CA 127.23 2.212 . . . . 0.0 106.829 177.462 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt . . . . . 0 N--CA 1.443 -0.8 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.7 pt -101.01 -172.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.286 0 C-N-CA 125.422 1.489 . . . . 0.0 109.644 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -133.38 73.15 1.5 Allowed 'General case' 0 C--N 1.36 1.049 0 C-N-CA 124.424 1.09 . . . . 0.0 108.669 -173.1 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.8 t -125.32 125.48 69.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -88.77 125.0 34.68 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 125.264 1.426 . . . . 0.0 108.813 -171.107 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 p -131.37 176.09 8.58 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.177 0.991 . . . . 0.0 109.314 -162.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.84 23.27 0.45 Allowed 'General case' 0 C--N 1.356 0.88 0 N-CA-C 105.734 -1.951 . . . . 0.0 105.734 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -173.47 149.56 1.67 Allowed Pre-proline 0 C--N 1.359 1.002 0 N-CA-C 105.118 -2.179 . . . . 0.0 105.118 -173.59 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -70.58 -17.33 33.9 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.538 3.492 . . . . 0.0 114.36 167.847 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -78.02 -14.28 59.57 Favored 'General case' 0 C--N 1.37 1.473 0 C-N-CA 128.584 2.754 . . . . 0.0 114.001 174.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -88.66 -11.44 45.29 Favored 'General case' 0 C--N 1.372 1.574 0 C-N-CA 127.852 2.461 . . . . 0.0 110.263 172.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.5 t -109.08 -13.41 14.7 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.04 2.136 . . . . 0.0 109.135 -179.144 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -84.8 -0.41 53.77 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.021 1.728 . . . . 0.0 111.202 173.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -80.09 -59.06 0.56 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.108 2.963 . . . . 0.0 111.266 171.21 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -70.88 -41.77 2.65 Favored 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 125.023 3.815 . . . . 0.0 113.509 174.663 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.59 -30.06 66.65 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 127.482 2.313 . . . . 0.0 114.941 -176.621 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -88.07 -8.94 54.79 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.823 1.192 . . . . 0.0 112.792 171.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -86.27 -21.37 27.39 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.836 1.654 . . . . 0.0 111.586 166.471 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.9 mt -91.92 -66.27 0.94 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 127.563 2.345 . . . . 0.0 111.023 178.006 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.16 -8.57 29.75 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.863 2.465 . . . . 0.0 112.263 -167.179 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.38 -79.64 0.58 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 125.099 1.333 . . . . 0.0 113.655 164.92 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.8 m -147.97 -7.13 0.43 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.005 1.722 . . . . 0.0 107.225 -174.683 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.3 t -108.73 66.6 0.64 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 126.733 2.013 . . . . 0.0 105.886 177.372 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.58 125.31 42.98 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.715 1.606 . . . . 0.0 106.838 -175.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.16 83.59 0.43 Allowed Glycine 0 C--N 1.362 2.018 0 N-CA-C 106.897 -2.481 . . . . 0.0 106.897 170.177 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.89 113.59 25.34 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.291 1.437 . . . . 0.0 110.172 -168.427 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -119.78 149.28 42.3 Favored 'General case' 0 CA--C 1.495 -1.148 0 C-N-CA 125.197 1.399 . . . . 0.0 108.026 -171.165 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -131.33 115.34 16.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 -179.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 94.7 mtp -124.34 127.37 47.49 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 173.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.44 -83.31 0.02 OUTLIER 'General case' 0 C--N 1.384 2.104 0 C-N-CA 127.562 2.345 . . . . 0.0 110.533 174.518 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.54 57.14 0.11 Allowed Glycine 0 N--CA 1.43 -1.756 0 N-CA-C 105.558 -3.017 . . . . 0.0 105.558 167.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -152.09 150.21 29.66 Favored 'General case' 0 C--N 1.365 1.25 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 175.758 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -105.04 142.88 34.04 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.28 2.232 . . . . 0.0 109.555 -164.747 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -123.58 140.6 52.83 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.83 1.652 . . . . 0.0 107.315 173.008 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -120.62 119.26 32.35 Favored 'General case' 0 C--N 1.361 1.082 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.385 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 . . . . . 0 N--CA 1.438 -1.061 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 178.039 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.0 mt . . . . . 0 N--CA 1.445 -0.687 0 N-CA-C 103.064 -2.939 . . . . 0.0 103.064 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.1 pt -103.78 -175.85 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.248 0 C-N-CA 125.12 1.368 . . . . 0.0 109.679 -179.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -128.73 78.69 1.86 Allowed 'General case' 0 C--N 1.362 1.12 0 C-N-CA 124.913 1.285 . . . . 0.0 107.589 -175.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.26 124.37 62.11 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -80.87 134.94 35.84 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 126.904 2.082 . . . . 0.0 110.125 -177.87 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.3 p -142.33 -179.18 6.12 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.726 0.774 . . . . 0.0 110.079 -164.253 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.5 t -148.94 18.64 0.99 Allowed 'General case' 0 C--N 1.355 0.839 0 C-N-CA 126.064 1.746 . . . . 0.0 106.772 168.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.2 p -172.96 155.96 3.03 Favored Pre-proline 0 C--N 1.363 1.189 0 C-N-CA 124.651 1.181 . . . . 0.0 108.196 -172.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -69.75 -18.22 37.17 Favored 'Trans proline' 0 C--N 1.361 1.198 1 C-N-CA 125.395 4.064 . . . . 0.0 114.804 163.224 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -76.09 -17.11 59.76 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 128.161 2.584 . . . . 0.0 113.744 174.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.5 tp60 -91.6 -7.86 48.94 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 128.499 2.72 . . . . 0.0 110.179 174.293 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 t -109.06 -13.54 14.69 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.522 2.329 . . . . 0.0 109.144 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.1 m -84.39 -1.88 56.24 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 126.332 1.853 . . . . 0.0 111.295 174.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -79.95 -59.37 0.55 Allowed Pre-proline 0 C--N 1.357 0.907 0 C-N-CA 129.331 3.053 . . . . 0.0 111.314 171.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -70.61 -41.02 3.47 Favored 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 125.114 3.876 . . . . 0.0 113.584 175.332 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.12 -31.44 70.13 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 127.684 2.394 . . . . 0.0 114.735 -177.85 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.08 -6.4 57.95 Favored 'General case' 0 C--N 1.37 1.486 0 C-N-CA 124.651 1.18 . . . . 0.0 113.2 172.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -88.65 -20.44 24.91 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.68 1.592 . . . . 0.0 111.471 165.632 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -93.36 -66.88 0.89 Allowed 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.506 2.322 . . . . 0.0 111.111 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -92.68 -14.92 27.4 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 128.181 2.592 . . . . 0.0 111.705 -169.416 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.0 -74.29 0.29 Allowed Glycine 0 C--N 1.365 2.154 0 C-N-CA 124.9 1.238 . . . . 0.0 113.746 163.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.39 -35.22 0.47 Allowed 'General case' 0 C--N 1.354 0.766 0 C-N-CA 125.588 1.555 . . . . 0.0 107.13 -169.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.8 t -93.14 75.64 4.66 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.823 2.449 . . . . 0.0 108.034 176.466 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.53 121.15 28.16 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 -177.24 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.36 85.08 0.78 Allowed Glycine 0 C--N 1.364 2.104 0 N-CA-C 107.783 -2.127 . . . . 0.0 107.783 172.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.65 114.55 27.14 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 125.556 1.542 . . . . 0.0 109.843 -170.841 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -123.99 143.21 50.55 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 -172.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.8 113.38 8.54 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -176.696 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.5 mmt -115.0 122.32 45.85 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 -175.003 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 77.92 -83.91 0.03 OUTLIER 'General case' 0 C--N 1.38 1.895 0 C-N-CA 127.491 2.316 . . . . 0.0 111.152 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.76 49.44 0.25 Allowed Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 107.194 -2.362 . . . . 0.0 107.194 170.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.9 mttm -151.28 149.25 29.15 Favored 'General case' 0 C--N 1.367 1.343 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.173 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -104.97 150.11 25.19 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.91 2.484 . . . . 0.0 110.076 -161.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -132.31 138.39 47.8 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.559 1.943 . . . . 0.0 106.035 177.743 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.4 m -124.41 113.43 18.16 Favored 'General case' 0 C--N 1.359 1.001 0 C-N-CA 124.336 1.054 . . . . 0.0 108.685 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 . . . . . 0 N--CA 1.44 -0.964 0 C-N-CA 127.112 2.165 . . . . 0.0 106.311 178.312 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.9 mt . . . . . 0 N--CA 1.445 -0.717 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.6 pt -99.88 -177.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.382 0 C-N-CA 125.367 1.467 . . . . 0.0 109.777 -179.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -127.36 77.58 1.75 Allowed 'General case' 0 C--N 1.362 1.123 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -173.853 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.7 t -128.63 125.44 63.51 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.535 -2.395 . . . . 0.0 104.535 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -78.27 138.78 38.78 Favored 'General case' 0 C--N 1.367 1.338 0 C-N-CA 127.091 2.156 . . . . 0.0 110.914 -177.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 p -147.96 -176.35 5.24 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-O 121.421 0.629 . . . . 0.0 109.606 -166.865 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.11 27.3 0.42 Allowed 'General case' 0 C--N 1.359 0.984 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 163.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.9 p -174.44 151.25 1.57 Allowed Pre-proline 0 C--N 1.364 1.213 0 C-N-CA 124.669 1.188 . . . . 0.0 108.137 -170.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -69.12 -17.15 40.62 Favored 'Trans proline' 0 C--N 1.361 1.185 1 C-N-CA 125.333 4.022 . . . . 0.0 115.305 165.059 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.02 6.89 33.83 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 126.093 1.757 . . . . 0.0 113.746 172.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -113.0 25.42 11.41 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 126.917 2.087 . . . . 0.0 107.366 167.129 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.9 t -145.2 -18.26 0.49 Allowed 'General case' 0 C--N 1.356 0.857 0 C-N-CA 126.329 1.852 . . . . 0.0 109.549 -175.547 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -88.02 1.26 54.62 Favored 'General case' 0 C--N 1.37 1.496 0 CA-C-N 121.147 1.794 . . . . 0.0 110.464 177.26 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -82.79 -55.34 0.53 Allowed Pre-proline 0 C--N 1.359 1.011 0 C-N-CA 129.346 3.058 . . . . 0.0 110.955 171.155 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.83 -39.09 6.77 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 124.99 3.793 . . . . 0.0 113.79 172.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.8 m -70.18 -29.42 66.29 Favored 'General case' 0 C--N 1.367 1.347 0 C-N-CA 127.601 2.36 . . . . 0.0 114.828 -179.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -88.08 -8.27 55.75 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.922 1.289 . . . . 0.0 113.204 170.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -87.71 -20.42 26.25 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 125.797 1.639 . . . . 0.0 111.157 167.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.3 mt -92.91 -66.47 0.92 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.663 2.385 . . . . 0.0 111.016 177.578 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.42 -7.48 31.6 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.682 2.393 . . . . 0.0 112.447 -167.055 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.56 -80.75 0.52 Allowed Glycine 0 C--N 1.364 2.1 0 C-N-CA 124.953 1.263 . . . . 0.0 113.738 165.318 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.29 -11.2 0.42 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.762 1.625 . . . . 0.0 107.167 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t -105.78 70.59 0.87 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 126.811 2.045 . . . . 0.0 105.842 176.694 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.81 129.39 48.21 Favored 'General case' 0 C--N 1.36 1.033 0 C-N-CA 125.718 1.607 . . . . 0.0 107.042 -174.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 89.37 0.61 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.208 -2.357 . . . . 0.0 107.208 171.39 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.48 115.66 27.87 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 125.253 1.421 . . . . 0.0 109.653 -173.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -128.89 142.97 50.78 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 -171.501 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.7 115.37 9.07 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -174.236 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 92.1 mtp -113.29 121.92 45.86 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 126.28 1.832 . . . . 0.0 106.183 -177.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 78.58 -84.34 0.02 OUTLIER 'General case' 0 C--N 1.38 1.899 0 C-N-CA 127.385 2.274 . . . . 0.0 111.332 173.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -165.11 48.95 0.28 Allowed Glycine 0 N--CA 1.434 -1.471 0 N-CA-C 107.54 -2.224 . . . . 0.0 107.54 171.71 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -151.75 150.86 30.66 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 171.078 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.01 154.05 20.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.016 2.526 . . . . 0.0 110.472 -162.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -134.74 140.81 46.22 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 126.623 1.969 . . . . 0.0 105.945 177.502 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -125.86 128.02 46.96 Favored 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.417 1.087 . . . . 0.0 108.067 178.247 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 . . . . . 0 N--CA 1.436 -1.141 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -177.841 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.3 mt . . . . . 0 N--CA 1.443 -0.783 0 N-CA-C 102.832 -3.025 . . . . 0.0 102.832 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.6 pt -100.64 -179.05 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.17 -177.849 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -124.52 73.94 1.29 Allowed 'General case' 0 C--N 1.363 1.156 0 C-N-CA 124.952 1.301 . . . . 0.0 108.397 -173.071 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.41 HG11 ' HG3' ' A' ' 16' ' ' PRO . 12.6 t -128.96 126.51 64.76 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 174.009 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -84.26 140.96 31.31 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 126.424 1.89 . . . . 0.0 109.146 -175.944 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.96 -178.79 6.38 Favored 'General case' 0 C--N 1.357 0.909 0 CA-C-O 121.552 0.692 . . . . 0.0 110.41 -164.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -154.94 25.19 0.43 Allowed 'General case' 0 C--N 1.358 0.959 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 167.233 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.5 p -173.81 152.07 1.93 Allowed Pre-proline 0 C--N 1.365 1.274 0 C-N-CA 124.653 1.181 . . . . 0.0 107.975 -172.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -69.79 -17.89 37.18 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 125.269 3.98 . . . . 0.0 115.288 164.512 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.2 tptt -78.89 -13.74 59.63 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.676 1.99 . . . . 0.0 114.374 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -90.37 -3.71 57.54 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 127.239 2.215 . . . . 0.0 110.077 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.19 -14.15 12.33 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.285 2.234 . . . . 0.0 109.138 179.725 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -85.14 -3.77 58.92 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 126.071 1.748 . . . . 0.0 111.013 174.874 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -77.83 -59.33 0.8 Allowed Pre-proline 0 N--CA 1.441 -0.906 0 C-N-CA 129.408 3.083 . . . . 0.0 111.907 170.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.41 ' HG3' HG11 ' A' ' 5' ' ' VAL . 66.6 Cg_endo -71.14 -39.96 3.62 Favored 'Trans proline' 0 C--N 1.364 1.344 0 C-N-CA 125.138 3.892 . . . . 0.0 113.841 175.111 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.72 -29.7 66.04 Favored 'General case' 0 C--N 1.367 1.369 0 C-N-CA 127.487 2.315 . . . . 0.0 114.294 -177.115 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -88.04 -8.19 55.92 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 124.889 1.276 . . . . 0.0 113.143 171.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -87.07 -19.94 27.87 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 125.608 1.563 . . . . 0.0 111.443 165.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.4 mt -92.83 -66.51 0.92 Allowed 'General case' 0 C--N 1.364 1.227 0 C-N-CA 127.666 2.386 . . . . 0.0 111.122 178.211 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -95.53 -10.4 29.77 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.991 2.516 . . . . 0.0 112.247 -167.769 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.35 -79.97 0.37 Allowed Glycine 0 C--N 1.366 2.198 0 C-N-CA 124.863 1.221 . . . . 0.0 113.351 165.517 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.76 -14.01 0.43 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.661 1.584 . . . . 0.0 107.072 -174.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.7 t -104.56 70.1 0.93 Allowed 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.866 2.066 . . . . 0.0 106.146 176.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.1 122.89 38.47 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.134 1.774 . . . . 0.0 106.813 -176.276 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.23 84.01 0.68 Allowed Glycine 0 C--N 1.364 2.097 0 N-CA-C 107.597 -2.201 . . . . 0.0 107.597 171.718 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.86 115.8 28.45 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.298 1.439 . . . . 0.0 109.689 -171.932 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -122.57 145.55 48.24 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 102.984 -2.969 . . . . 0.0 102.984 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.89 132.05 28.09 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.747 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 96.8 mtp -105.46 73.39 1.02 Allowed 'General case' 0 C--N 1.359 1.009 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 175.259 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -0.76 68.28 0.0 OUTLIER 'General case' 0 C--N 1.378 1.813 1 C-N-CA 135.193 5.397 . . . . 0.0 118.537 -175.354 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 160.61 -42.24 0.43 Allowed Glycine 0 C--N 1.355 1.624 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -161.799 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -153.96 155.4 35.53 Favored 'General case' 0 C--N 1.37 1.482 0 CA-C-N 119.264 1.532 . . . . 0.0 109.369 179.74 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.8 t -107.02 153.63 22.31 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 129.275 3.03 . . . . 0.0 110.519 -165.266 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -133.37 137.18 45.75 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 126.79 2.036 . . . . 0.0 106.557 176.148 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 63.4 m -121.11 122.7 40.6 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 124.369 1.067 . . . . 0.0 108.721 177.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 . . . . . 0 N--CA 1.436 -1.165 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 178.758 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.8 mt . . . . . 0 N--CA 1.445 -0.7 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.5 pt -103.15 -171.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.289 0 C-N-CA 125.538 1.535 . . . . 0.0 108.936 177.554 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -134.99 91.62 2.77 Favored 'General case' 0 C--N 1.36 1.046 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.941 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.46 124.37 48.37 Favored 'Isoleucine or valine' 0 C--N 1.359 1.007 0 N-CA-C 103.251 -2.87 . . . . 0.0 103.251 169.746 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -79.32 134.63 36.61 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 126.689 1.996 . . . . 0.0 109.814 -178.485 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.5 p -143.32 -177.87 5.59 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-O 121.505 0.669 . . . . 0.0 110.052 -163.453 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.3 t -152.42 22.29 0.63 Allowed 'General case' 0 C--N 1.358 0.948 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 168.556 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.2 p -173.49 151.84 2.03 Favored Pre-proline 0 C--N 1.364 1.237 0 C-N-CA 124.455 1.102 . . . . 0.0 108.28 -171.102 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -69.45 -17.79 38.79 Favored 'Trans proline' 0 C--N 1.36 1.177 1 C-N-CA 125.377 4.051 . . . . 0.0 115.153 164.139 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -77.91 -15.28 59.13 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.02 2.128 . . . . 0.0 114.455 172.483 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -89.67 -4.49 57.73 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 127.256 2.222 . . . . 0.0 110.005 171.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.5 t -113.18 -13.49 12.99 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 127.236 2.214 . . . . 0.0 109.245 178.923 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.4 m -85.29 -4.03 59.02 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 126.128 1.771 . . . . 0.0 111.057 174.6 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -78.61 -58.85 0.73 Allowed Pre-proline 0 C--N 1.356 0.882 0 C-N-CA 129.499 3.119 . . . . 0.0 111.7 171.05 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.21 -42.23 3.11 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 125.253 3.969 . . . . 0.0 113.725 174.833 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -69.43 -30.77 68.78 Favored 'General case' 0 C--N 1.367 1.367 0 C-N-CA 127.451 2.3 . . . . 0.0 114.888 -177.458 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -87.97 -7.02 57.7 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 124.817 1.247 . . . . 0.0 113.495 171.915 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -85.79 -25.74 26.16 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 125.913 1.685 . . . . 0.0 110.956 165.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.7 mt -89.36 -63.3 1.31 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.553 2.341 . . . . 0.0 111.781 179.706 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.77 -8.84 25.31 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.786 2.434 . . . . 0.0 111.898 -167.495 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.14 -79.94 0.48 Allowed Glycine 0 C--N 1.365 2.189 0 C-N-CA 125.048 1.309 . . . . 0.0 113.551 165.237 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -147.31 -11.45 0.42 Allowed 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.711 1.604 . . . . 0.0 106.98 -175.43 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -105.26 69.51 0.85 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 126.887 2.075 . . . . 0.0 106.132 177.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.22 128.13 46.73 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 125.842 1.657 . . . . 0.0 106.723 -175.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.18 86.03 0.5 Allowed Glycine 0 C--N 1.362 1.975 0 N-CA-C 107.017 -2.433 . . . . 0.0 107.017 170.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.84 113.8 25.91 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 125.14 1.376 . . . . 0.0 109.832 -171.483 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -121.52 144.13 48.89 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 -173.595 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.82 110.76 6.23 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 -178.491 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.7 mtt -115.26 126.06 54.06 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.751 2.02 . . . . 0.0 105.695 -175.797 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 t30 81.67 -85.64 0.02 OUTLIER 'General case' 0 C--N 1.382 1.991 0 C-N-CA 127.32 2.248 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -168.86 50.84 0.22 Allowed Glycine 0 N--CA 1.433 -1.525 0 N-CA-C 106.527 -2.629 . . . . 0.0 106.527 169.363 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -151.41 149.98 29.91 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 174.595 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.4 t -104.94 150.06 25.21 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 127.686 2.395 . . . . 0.0 110.368 -162.785 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -132.36 138.88 47.9 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 126.812 2.045 . . . . 0.0 106.395 177.111 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -123.16 121.99 37.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 124.334 1.053 . . . . 0.0 108.546 178.087 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 . . . . . 0 N--CA 1.437 -1.103 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.156 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 57.1 mt . . . . . 0 N--CA 1.45 -0.431 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.7 pt -100.87 -171.62 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 126.098 1.759 . . . . 0.0 110.111 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -130.99 82.46 2.05 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -176.309 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 t -132.84 128.05 56.44 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.56 -2.755 . . . . 0.0 103.56 172.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -83.03 132.0 35.15 Favored 'General case' 0 C--N 1.364 1.234 0 C-N-CA 126.084 1.754 . . . . 0.0 109.551 -177.328 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -140.83 170.03 16.51 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -166.018 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -152.14 25.91 0.62 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 170.577 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -168.73 149.31 4.23 Favored Pre-proline 0 C--N 1.36 1.032 0 N-CA-C 105.175 -2.158 . . . . 0.0 105.175 -177.686 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -71.43 -15.48 31.06 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.469 3.446 . . . . 0.0 114.394 168.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.43 -11.65 59.96 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.047 2.539 . . . . 0.0 113.736 172.24 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -94.24 -3.93 49.8 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.509 2.324 . . . . 0.0 110.138 173.478 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.5 t -118.12 -13.41 9.95 Favored 'General case' 0 C--N 1.36 1.061 0 C-N-CA 126.886 2.074 . . . . 0.0 108.895 -177.383 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -88.03 1.0 55.26 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 125.897 1.679 . . . . 0.0 110.949 172.651 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -79.69 -58.8 0.61 Allowed Pre-proline 0 C--N 1.359 1.003 0 C-N-CA 129.165 2.986 . . . . 0.0 111.592 170.871 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.23 -40.02 3.49 Favored 'Trans proline' 0 C--N 1.365 1.404 0 C-N-CA 125.024 3.816 . . . . 0.0 113.668 175.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -74.3 -25.67 59.72 Favored 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.591 2.356 . . . . 0.0 114.669 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.13 -8.16 55.84 Favored 'General case' 0 C--N 1.371 1.531 0 CA-C-N 120.15 1.341 . . . . 0.0 113.248 168.122 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -86.91 -19.71 28.45 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 125.565 1.546 . . . . 0.0 111.398 166.56 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.9 mt -93.54 -65.92 0.96 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.575 2.35 . . . . 0.0 111.133 177.606 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -95.41 -6.73 40.23 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 127.797 2.439 . . . . 0.0 112.35 -167.407 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.64 -80.11 0.45 Allowed Glycine 0 C--N 1.365 2.188 0 C-N-CA 125.103 1.335 . . . . 0.0 113.392 165.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.7 m -146.68 -5.87 0.54 Allowed 'General case' 0 C--N 1.353 0.745 0 C-N-CA 125.722 1.609 . . . . 0.0 106.903 -177.164 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -102.22 73.24 1.34 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.092 2.157 . . . . 0.0 106.907 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -152.02 116.55 5.06 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.253 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -108.97 72.61 0.2 Allowed Glycine 0 C--N 1.36 1.862 0 N-CA-C 106.481 -2.648 . . . . 0.0 106.481 169.035 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.11 140.54 34.98 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 128.366 2.666 . . . . 0.0 111.484 -167.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -122.13 142.97 49.83 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.787 1.235 . . . . 0.0 107.79 -163.41 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.5 t -117.91 103.73 10.23 Favored 'General case' 0 C--N 1.353 0.732 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 178.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.7 mtp -111.83 121.94 46.43 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 176.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 78.32 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.383 2.051 0 C-N-CA 127.781 2.432 . . . . 0.0 110.706 178.618 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 53.56 0.18 Allowed Glycine 0 N--CA 1.433 -1.5 0 N-CA-C 105.299 -3.121 . . . . 0.0 105.299 168.574 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -151.88 151.82 31.78 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 179.031 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.98 141.2 36.99 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 126.497 1.919 . . . . 0.0 109.907 -163.296 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -120.08 146.64 45.73 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.669 1.988 . . . . 0.0 106.746 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.1 m -117.13 137.7 52.13 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.114 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 . . . . . 0 N--CA 1.434 -1.229 0 N-CA-C 105.112 -2.181 . . . . 0.0 105.112 -178.554 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . 0.438 HG23 ' HG2' ' A' ' 35' ' ' LYS . 98.3 mt . . . . . 0 CA--C 1.512 -0.498 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.3 pt -106.13 -174.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.037 0 C-N-CA 125.751 1.62 . . . . 0.0 110.093 -172.622 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -130.1 82.34 2.06 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -177.206 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 t -130.79 126.17 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.123 0 N-CA-C 103.101 -2.926 . . . . 0.0 103.101 171.457 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -83.23 131.59 35.09 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 125.673 1.589 . . . . 0.0 109.519 -175.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.8 p -138.72 171.84 13.75 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -165.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -152.88 26.73 0.55 Allowed 'General case' 0 C--N 1.356 0.886 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 170.202 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.8 p -170.18 148.39 2.98 Favored Pre-proline 0 C--N 1.36 1.056 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -177.443 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -71.14 -16.29 31.91 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 124.293 3.329 . . . . 0.0 114.801 168.965 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -84.08 -0.36 51.51 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.564 1.946 . . . . 0.0 114.449 171.525 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -97.17 -0.64 46.54 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 127.115 2.166 . . . . 0.0 109.619 168.118 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.6 t -122.69 -12.52 8.08 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 127.013 2.125 . . . . 0.0 108.866 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -87.68 1.11 54.64 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 126.797 2.039 . . . . 0.0 110.16 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -81.4 -58.73 0.48 Allowed Pre-proline 0 N--CA 1.44 -0.957 0 C-N-CA 129.347 3.059 . . . . 0.0 111.096 171.342 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -71.52 -40.33 3.04 Favored 'Trans proline' 0 C--N 1.364 1.393 0 C-N-CA 124.972 3.782 . . . . 0.0 113.534 173.762 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.0 m -71.88 -23.96 61.58 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 127.353 2.261 . . . . 0.0 114.764 -179.325 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -88.09 -9.06 54.46 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.471 1.487 . . . . 0.0 114.117 166.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -88.08 -20.07 26.22 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 125.525 1.53 . . . . 0.0 111.445 167.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.7 mt -98.8 -71.79 0.68 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.437 2.295 . . . . 0.0 110.292 179.368 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.82 40.48 1.56 Allowed 'General case' 0 C--N 1.359 1.004 0 C-N-CA 128.643 2.777 . . . . 0.0 109.963 -169.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.84 83.97 1.5 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 126.212 1.863 . . . . 0.0 116.051 -167.59 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.3 m -154.95 -61.48 0.12 Allowed 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 103.508 -2.775 . . . . 0.0 103.508 171.237 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.7 t -137.35 71.78 1.41 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 104.184 -2.525 . . . . 0.0 104.184 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.45 135.85 34.52 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 125.311 1.444 . . . . 0.0 111.899 177.079 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.51 148.62 18.38 Favored Glycine 0 C--N 1.362 2.002 0 N-CA-C 106.686 -2.566 . . . . 0.0 106.686 164.558 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.98 118.5 4.51 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 -170.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -122.28 147.15 46.58 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.5 t -123.05 107.93 12.33 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 177.763 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.2 mmm -119.54 123.69 44.57 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.755 -2.313 . . . . 0.0 104.755 177.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.08 -84.35 0.02 OUTLIER 'General case' 0 C--N 1.382 1.983 0 C-N-CA 127.645 2.378 . . . . 0.0 110.904 177.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.67 55.92 0.16 Allowed Glycine 0 N--CA 1.433 -1.51 0 N-CA-C 104.808 -3.317 . . . . 0.0 104.808 168.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -152.91 152.18 31.2 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -104.93 138.36 41.29 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.122 2.169 . . . . 0.0 108.882 -166.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HG2' HG23 ' A' ' 2' ' ' ILE . 52.3 mtmt -115.56 145.85 42.28 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 125.814 1.646 . . . . 0.0 107.227 169.769 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.7 m -114.42 148.51 37.61 Favored 'General case' 0 C--N 1.357 0.905 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 169.747 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 . . . . . 0 N--CA 1.433 -1.312 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -174.71 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.8 mt . . . . . 0 N--CA 1.443 -0.797 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.8 pt -101.9 -174.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.345 0 C-N-CA 125.435 1.494 . . . . 0.0 108.773 177.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -135.01 86.6 2.27 Favored 'General case' 0 C--N 1.361 1.1 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -179.198 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.2 t -127.69 124.72 63.88 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 N-CA-C 103.573 -2.751 . . . . 0.0 103.573 170.687 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -85.69 129.76 34.74 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 126.191 1.796 . . . . 0.0 109.521 -171.824 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.4 p -138.36 -175.72 4.21 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.36 0.664 . . . . 0.0 109.607 -160.561 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -153.79 26.02 0.5 Allowed 'General case' 0 C--N 1.359 0.982 0 N-CA-C 105.585 -2.005 . . . . 0.0 105.585 164.938 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.5 p -173.87 150.55 1.69 Allowed Pre-proline 0 C--N 1.363 1.162 0 C-N-CA 124.604 1.162 . . . . 0.0 108.241 -171.525 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -68.54 -17.84 43.27 Favored 'Trans proline' 0 C--N 1.36 1.16 1 C-N-CA 125.331 4.021 . . . . 0.0 115.444 164.217 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -75.26 -20.74 59.02 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.015 2.126 . . . . 0.0 114.148 171.713 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.95 1.55 55.28 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.239 2.216 . . . . 0.0 110.541 173.878 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.5 t -117.44 -12.27 10.44 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 127.616 2.366 . . . . 0.0 108.785 177.264 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.4 m -86.02 -4.75 59.24 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 125.934 1.694 . . . . 0.0 111.831 174.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -56.79 1.19 Allowed Pre-proline 0 C--N 1.359 1.016 0 C-N-CA 127.382 2.273 . . . . 0.0 112.634 167.797 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.86 -41.62 2.77 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 124.88 3.72 . . . . 0.0 113.587 176.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.6 m -70.71 -29.66 66.0 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.757 2.423 . . . . 0.0 114.593 -178.059 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -88.12 -6.64 57.79 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.623 1.169 . . . . 0.0 113.332 171.591 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -88.68 -21.11 24.08 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 125.723 1.609 . . . . 0.0 111.068 166.347 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.3 mt -92.39 -65.65 0.99 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 127.525 2.33 . . . . 0.0 111.26 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -97.69 -5.62 34.83 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.964 2.506 . . . . 0.0 112.26 -167.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.26 -79.33 0.52 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.027 1.298 . . . . 0.0 113.891 164.331 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 t -152.93 -7.53 0.18 Allowed 'General case' 0 C--N 1.353 0.75 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 -175.345 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.2 68.02 0.71 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.014 2.126 . . . . 0.0 105.528 174.769 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.1 126.62 47.41 Favored 'General case' 0 C--N 1.359 1.016 0 C-N-CA 125.806 1.642 . . . . 0.0 106.87 -176.599 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.24 85.37 0.56 Allowed Glycine 0 C--N 1.361 1.969 0 N-CA-C 107.265 -2.334 . . . . 0.0 107.265 170.411 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.9 113.02 24.95 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 125.253 1.421 . . . . 0.0 109.539 -171.963 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.08 143.15 49.69 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 -171.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -143.7 115.63 8.31 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -177.028 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -121.0 127.41 51.74 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 -176.164 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 79.72 -85.17 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.544 2.337 . . . . 0.0 110.571 175.386 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.44 51.91 0.21 Allowed Glycine 0 N--CA 1.434 -1.464 0 N-CA-C 106.635 -2.586 . . . . 0.0 106.635 169.717 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -151.61 148.83 28.44 Favored 'General case' 0 C--N 1.369 1.426 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.009 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -105.1 154.05 20.68 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 128.022 2.529 . . . . 0.0 109.963 -163.44 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -138.21 137.06 37.2 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 57.7 m -120.65 124.42 45.18 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 124.355 1.062 . . . . 0.0 108.179 178.353 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 . . . . . 0 N--CA 1.436 -1.15 0 N-CA-C 105.702 -1.962 . . . . 0.0 105.702 -179.329 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.9 mt . . . . . 0 N--CA 1.445 -0.68 0 N-CA-C 104.199 -2.519 . . . . 0.0 104.199 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.3 pt -101.12 179.52 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.335 0 C-N-CA 125.419 1.488 . . . . 0.0 110.236 -178.757 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -119.81 73.89 0.99 Allowed 'General case' 0 C--N 1.361 1.088 0 C-N-CA 125.412 1.485 . . . . 0.0 108.546 -172.379 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -130.57 126.39 60.59 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 N-CA-C 105.521 -2.029 . . . . 0.0 105.521 175.289 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -83.58 138.18 33.5 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 127.131 2.172 . . . . 0.0 109.611 179.847 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -143.26 -177.75 5.52 Favored 'General case' 0 C--N 1.359 1.006 0 CA-C-O 121.735 0.779 . . . . 0.0 109.844 -165.957 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.9 t -149.08 18.73 0.97 Allowed 'General case' 0 C--N 1.356 0.876 0 C-N-CA 126.06 1.744 . . . . 0.0 106.495 168.566 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 51.9 p -173.67 155.52 2.57 Favored Pre-proline 0 C--N 1.364 1.236 0 C-N-CA 124.673 1.189 . . . . 0.0 108.292 -171.933 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -69.68 -18.59 37.29 Favored 'Trans proline' 0 C--N 1.362 1.24 1 C-N-CA 125.41 4.073 . . . . 0.0 115.025 163.767 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -79.26 -11.22 59.95 Favored 'General case' 0 C--N 1.369 1.431 0 C-N-CA 126.999 2.12 . . . . 0.0 114.768 173.416 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -94.02 -4.79 48.9 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 127.902 2.481 . . . . 0.0 109.974 171.791 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.3 t -111.69 -14.45 13.61 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.468 2.307 . . . . 0.0 108.65 179.605 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -84.79 -1.19 56.04 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 126.655 1.982 . . . . 0.0 110.753 173.038 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -81.77 -57.47 0.52 Allowed Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 129.056 2.942 . . . . 0.0 110.928 172.17 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.33 -45.37 1.85 Allowed 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 124.876 3.717 . . . . 0.0 113.68 172.011 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.88 -29.42 67.71 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 127.416 2.286 . . . . 0.0 115.081 -175.158 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -88.04 -10.83 49.05 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 124.436 1.094 . . . . 0.0 113.429 172.641 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -85.98 -21.22 27.96 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 125.858 1.663 . . . . 0.0 112.086 166.375 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 mt -94.97 -69.05 0.77 Allowed 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.307 2.243 . . . . 0.0 110.942 -178.882 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -91.4 -27.83 18.07 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 128.035 2.534 . . . . 0.0 111.856 -167.97 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.75 -171.02 15.83 Favored Glycine 0 C--N 1.362 1.997 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.417 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.1 m -71.8 -4.88 30.32 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 128.003 2.521 . . . . 0.0 115.571 -174.897 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.3 t -108.65 64.08 0.61 Allowed 'General case' 0 C--N 1.363 1.193 0 C-N-CA 127.059 2.144 . . . . 0.0 106.411 168.359 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.62 143.35 43.95 Favored 'General case' 0 C--N 1.364 1.205 0 C-N-CA 126.399 1.879 . . . . 0.0 106.924 176.557 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.71 85.49 0.52 Allowed Glycine 0 C--N 1.361 1.927 0 N-CA-C 107.559 -2.216 . . . . 0.0 107.559 171.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.55 111.07 23.06 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 125.246 1.418 . . . . 0.0 109.037 -173.368 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -123.14 141.92 51.45 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 104.181 -2.525 . . . . 0.0 104.181 -171.111 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.82 109.25 6.19 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 -175.662 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -110.15 123.54 49.93 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 127.071 2.148 . . . . 0.0 106.122 -176.862 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.7 m120 78.54 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.554 2.342 . . . . 0.0 111.05 177.076 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.03 49.77 0.25 Allowed Glycine 0 N--CA 1.435 -1.407 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 170.352 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -150.52 147.99 28.16 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.308 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.94 151.74 23.53 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 127.842 2.457 . . . . 0.0 110.506 -161.97 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -134.34 139.43 45.64 Favored 'General case' 0 C--N 1.361 1.083 0 C-N-CA 126.726 2.01 . . . . 0.0 106.241 177.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.8 m -121.78 125.77 47.3 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 124.375 1.07 . . . . 0.0 108.576 176.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.435 -1.224 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.282 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.444 -0.743 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -99.87 -179.99 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 125.945 1.698 . . . . 0.0 110.38 -176.071 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -123.36 70.9 1.05 Allowed 'General case' 0 C--N 1.363 1.165 0 C-N-CA 125.021 1.328 . . . . 0.0 108.422 -173.17 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.437 HG11 ' HG3' ' A' ' 16' ' ' PRO . 11.7 t -128.63 132.71 67.57 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.154 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 173.682 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -84.66 140.99 30.93 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 125.869 1.668 . . . . 0.0 109.425 -174.999 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.5 p -147.07 160.76 42.02 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 121.656 0.741 . . . . 0.0 109.289 -169.379 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.3 t -133.13 -0.29 3.36 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 126.589 1.956 . . . . 0.0 108.171 169.994 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -152.55 157.36 33.59 Favored Pre-proline 0 C--N 1.364 1.205 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -176.087 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -71.99 -16.16 29.1 Favored 'Trans proline' 0 C--N 1.359 1.095 0 C-N-CA 124.418 3.412 . . . . 0.0 114.702 169.446 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -83.0 -1.71 53.35 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 126.595 1.958 . . . . 0.0 114.579 170.788 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -99.71 -0.77 39.42 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.773 2.429 . . . . 0.0 109.627 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.9 t -124.34 -14.71 6.89 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.89 2.076 . . . . 0.0 108.439 -173.079 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 78.4 p -87.92 3.13 49.71 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 125.44 1.496 . . . . 0.0 110.927 173.278 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -77.49 -59.2 0.86 Allowed Pre-proline 0 C--N 1.359 1.001 0 C-N-CA 129.757 3.223 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.437 ' HG3' HG11 ' A' ' 5' ' ' VAL . 74.2 Cg_endo -71.23 -38.42 4.85 Favored 'Trans proline' 0 C--N 1.364 1.357 0 C-N-CA 125.121 3.881 . . . . 0.0 113.878 174.156 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -71.68 -29.07 64.19 Favored 'General case' 0 C--N 1.366 1.326 0 C-N-CA 127.647 2.379 . . . . 0.0 114.46 -176.938 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -88.04 -9.0 54.77 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 125.148 1.379 . . . . 0.0 113.135 170.339 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -86.51 -20.53 27.9 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.632 1.573 . . . . 0.0 111.489 166.498 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.4 mt -92.78 -66.63 0.91 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.704 2.402 . . . . 0.0 110.962 177.962 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -95.84 -8.91 32.87 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.972 2.509 . . . . 0.0 112.175 -167.383 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.99 -79.83 0.54 Allowed Glycine 0 C--N 1.364 2.087 0 C-N-CA 125.289 1.423 . . . . 0.0 113.46 165.125 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.1 -6.29 0.44 Allowed 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.064 1.746 . . . . 0.0 106.929 -175.568 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 t -107.02 63.81 0.63 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 126.948 2.099 . . . . 0.0 106.212 177.552 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.73 140.23 52.55 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 125.973 1.709 . . . . 0.0 106.732 -176.875 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.79 -76.07 1.17 Allowed Glycine 0 C--N 1.361 1.962 0 C-N-CA 126.316 1.913 . . . . 0.0 110.943 172.373 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 84.97 98.9 0.04 OUTLIER 'General case' 0 C--N 1.367 1.336 0 C-N-CA 126.823 2.049 . . . . 0.0 110.984 169.024 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -125.44 141.37 52.09 Favored 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -171.552 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.4 t -116.24 124.8 51.12 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -176.171 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.2 mtp -109.34 72.17 0.8 Allowed 'General case' 0 C--N 1.36 1.058 0 N-CA-C 104.43 -2.433 . . . . 0.0 104.43 170.302 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -5.39 72.33 0.0 OUTLIER 'General case' 0 C--N 1.377 1.782 1 C-N-CA 134.63 5.172 . . . . 0.0 118.749 -171.8 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.76 -38.05 0.61 Allowed Glycine 0 C--N 1.354 1.536 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -166.185 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -154.05 157.68 39.38 Favored 'General case' 0 C--N 1.37 1.472 0 CA-C-N 119.45 1.625 . . . . 0.0 108.419 -175.833 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.26 154.62 20.98 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 128.66 2.784 . . . . 0.0 109.56 -166.156 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -129.82 147.49 51.6 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.733 2.013 . . . . 0.0 106.444 173.902 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.5 m -123.14 122.34 38.21 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 175.207 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 . . . . . 0 N--CA 1.44 -0.934 0 C-N-CA 126.541 1.936 . . . . 0.0 106.141 177.383 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 53.2 mt . . . . . 0 N--CA 1.445 -0.722 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.4 pt -106.06 -172.63 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.276 0 C-N-CA 125.129 1.372 . . . . 0.0 109.25 178.873 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -135.04 77.49 1.68 Allowed 'General case' 0 C--N 1.361 1.093 0 C-N-CA 124.325 1.05 . . . . 0.0 108.207 -177.23 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.4 t -121.06 122.52 67.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 172.205 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -80.9 133.98 35.65 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 126.757 2.023 . . . . 0.0 110.185 -172.733 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.16 -176.64 5.18 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 121.399 0.618 . . . . 0.0 110.252 -162.634 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -155.0 26.25 0.43 Allowed 'General case' 0 C--N 1.358 0.971 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 165.428 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.7 p -173.63 149.87 1.67 Allowed Pre-proline 0 C--N 1.364 1.23 0 C-N-CA 124.498 1.119 . . . . 0.0 108.369 -170.751 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -68.69 -16.62 42.3 Favored 'Trans proline' 0 C--N 1.362 1.245 1 C-N-CA 125.505 4.137 . . . . 0.0 115.29 165.479 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.01 7.98 28.7 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 126.128 1.771 . . . . 0.0 113.824 171.006 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -113.06 27.75 9.36 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.09 2.156 . . . . 0.0 107.127 166.417 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.6 t -148.12 -19.63 0.34 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.688 1.595 . . . . 0.0 110.189 -175.111 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -85.99 0.85 52.25 Favored 'General case' 0 C--N 1.369 1.424 0 CA-C-N 121.527 1.967 . . . . 0.0 111.476 175.968 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -81.31 -56.49 0.6 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.124 2.97 . . . . 0.0 110.807 170.438 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.1 -42.13 4.4 Favored 'Trans proline' 0 C--N 1.368 1.596 0 C-N-CA 124.964 3.776 . . . . 0.0 113.725 173.08 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.0 m -68.08 -31.61 71.35 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.81 2.444 . . . . 0.0 115.188 -177.873 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -88.06 -8.03 56.13 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 124.986 1.314 . . . . 0.0 112.92 172.928 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -87.84 -20.48 25.99 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 125.679 1.592 . . . . 0.0 111.374 166.508 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -92.85 -66.48 0.92 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.54 2.336 . . . . 0.0 111.116 178.706 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.15 -10.26 28.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 127.908 2.483 . . . . 0.0 111.999 -168.197 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.94 0.46 Allowed Glycine 0 C--N 1.364 2.086 0 C-N-CA 125.011 1.291 . . . . 0.0 113.672 164.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.52 -10.63 0.47 Allowed 'General case' 0 C--N 1.355 0.806 0 C-N-CA 125.851 1.661 . . . . 0.0 107.266 -174.14 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.07 69.49 0.76 Allowed 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.88 2.072 . . . . 0.0 105.681 176.509 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.89 125.44 41.6 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 125.695 1.598 . . . . 0.0 106.826 -174.768 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.64 87.42 0.57 Allowed Glycine 0 C--N 1.362 2.0 0 N-CA-C 107.276 -2.33 . . . . 0.0 107.276 170.698 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.79 113.54 25.84 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.238 1.415 . . . . 0.0 109.667 -172.236 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -124.43 146.39 48.94 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 103.963 -2.606 . . . . 0.0 103.963 -172.577 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.45 116.1 7.19 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 -175.912 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 68.9 mtt -121.11 126.39 49.65 Favored 'General case' 0 C--N 1.361 1.074 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 -176.04 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.33 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.505 2.322 . . . . 0.0 110.906 173.946 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.88 50.65 0.25 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 107.388 -2.285 . . . . 0.0 107.388 171.105 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -151.99 150.61 30.19 Favored 'General case' 0 C--N 1.368 1.39 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.846 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.0 151.96 23.3 Favored 'General case' 0 C--N 1.36 1.029 0 C-N-CA 128.499 2.72 . . . . 0.0 109.644 -165.305 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -135.4 137.63 42.48 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 179.013 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.68 110.65 14.64 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 124.465 1.106 . . . . 0.0 108.437 -179.321 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.44 -0.929 0 C-N-CA 127.431 2.292 . . . . 0.0 107.189 179.713 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 56.0 mt . . . . . 0 CA--C 1.513 -0.474 0 N-CA-C 107.019 -1.474 . . . . 0.0 107.019 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 pt -106.28 -173.21 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 126.229 1.811 . . . . 0.0 109.74 -175.478 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -130.96 79.95 1.92 Allowed 'General case' 0 C--N 1.362 1.112 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -175.971 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.8 127.07 63.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 173.615 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -80.83 131.8 35.42 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 126.133 1.773 . . . . 0.0 110.155 -176.515 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -141.28 171.08 14.56 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -166.316 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.77 22.37 0.69 Allowed 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 174.194 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 p -171.09 149.23 2.63 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -174.781 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -71.84 -15.37 29.8 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 124.22 3.28 . . . . 0.0 114.747 168.685 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -79.3 -11.75 59.94 Favored 'General case' 0 C--N 1.371 1.508 0 C-N-CA 127.231 2.212 . . . . 0.0 114.323 171.525 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -89.77 -5.17 57.22 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 127.335 2.254 . . . . 0.0 110.178 171.357 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.0 t -118.19 -11.78 10.07 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.162 2.185 . . . . 0.0 108.592 -176.685 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -88.0 1.26 54.58 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 126.497 1.919 . . . . 0.0 110.38 171.569 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -80.93 -58.03 0.54 Allowed Pre-proline 0 C--N 1.356 0.89 0 C-N-CA 129.121 2.969 . . . . 0.0 111.301 170.998 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -72.04 -39.44 3.15 Favored 'Trans proline' 0 C--N 1.364 1.377 0 C-N-CA 125.072 3.848 . . . . 0.0 113.582 173.883 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -73.16 -22.69 60.45 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 127.185 2.194 . . . . 0.0 114.571 -179.427 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -88.14 -9.73 52.26 Favored 'General case' 0 C--N 1.374 1.633 0 CA-C-N 120.455 1.48 . . . . 0.0 114.068 166.141 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.39 -19.36 28.21 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.663 1.585 . . . . 0.0 111.334 168.337 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.6 mt -98.69 -71.33 0.69 Allowed 'General case' 0 C--N 1.365 1.25 0 C-N-CA 127.539 2.336 . . . . 0.0 110.221 178.27 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -106.42 42.43 1.28 Allowed 'General case' 0 C--N 1.361 1.072 0 C-N-CA 128.655 2.782 . . . . 0.0 109.955 -169.781 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -79.47 89.04 1.22 Allowed Glycine 0 C--N 1.365 2.171 0 C-N-CA 126.488 1.994 . . . . 0.0 115.939 -169.078 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.0 t -168.06 -61.37 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 103.275 -2.861 . . . . 0.0 103.275 174.308 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -137.28 70.33 1.4 Allowed 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 179.352 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.61 138.93 31.83 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.532 1.533 . . . . 0.0 111.606 177.261 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -106.31 152.66 17.04 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 105.893 -2.883 . . . . 0.0 105.893 165.568 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.31 121.96 4.86 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -171.407 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -124.73 141.27 52.22 Favored 'General case' 0 C--N 1.361 1.071 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 -179.128 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.2 t -117.56 103.37 10.0 Favored 'General case' 0 C--N 1.352 0.71 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.913 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.6 mmt -108.84 121.61 45.46 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 178.857 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.466 3.6 p-10 68.66 -78.06 0.05 OUTLIER 'General case' 0 C--N 1.38 1.905 0 C-N-CA 128.718 2.807 . . . . 0.0 113.95 -177.842 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.28 54.46 0.14 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 105.407 -3.077 . . . . 0.0 105.407 170.664 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -153.92 152.12 30.24 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.2 t -104.99 141.32 36.78 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.637 1.975 . . . . 0.0 109.435 -164.016 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -119.86 147.04 45.17 Favored 'General case' 0 CA--C 1.499 -0.989 0 C-N-CA 126.571 1.948 . . . . 0.0 106.27 172.486 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -116.33 143.47 45.5 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 172.01 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 . . . . . 0 N--CA 1.434 -1.233 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 -174.617 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 26.3 mt . . . . . 0 N--CA 1.444 -0.745 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.2 pt -102.41 -170.53 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 125.966 1.707 . . . . 0.0 109.429 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.98 76.6 1.63 Allowed 'General case' 0 C--N 1.36 1.056 0 C-N-CA 124.333 1.053 . . . . 0.0 108.378 -175.48 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.435 HG11 ' HG3' ' A' ' 16' ' ' PRO . 7.0 t -129.59 133.26 65.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.132 0 N-CA-C 103.938 -2.615 . . . . 0.0 103.938 173.301 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.75 134.75 35.48 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 125.847 1.659 . . . . 0.0 110.447 -177.041 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.7 p -140.25 -178.98 5.73 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 -169.227 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 55.4 m -154.93 -53.36 0.09 Allowed 'General case' 0 N--CA 1.432 -1.366 0 N-CA-C 100.969 -3.715 . . . . 0.0 100.969 -163.057 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.6 p -111.25 161.91 23.17 Favored Pre-proline 0 C--N 1.362 1.112 0 C-N-CA 127.647 2.379 . . . . 0.0 108.661 177.893 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -71.88 -16.2 29.45 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.468 3.446 . . . . 0.0 114.535 165.803 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -74.73 -17.05 60.71 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 127.759 2.424 . . . . 0.0 114.146 168.941 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -88.85 -2.93 58.83 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 127.649 2.38 . . . . 0.0 110.485 174.864 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.5 t -118.93 -12.45 9.56 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 128.068 2.547 . . . . 0.0 108.207 179.697 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.3 m -86.2 -0.78 56.52 Favored 'General case' 0 C--N 1.371 1.536 0 C-N-CA 126.317 1.847 . . . . 0.0 111.06 172.867 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -77.87 -58.06 0.92 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.193 2.997 . . . . 0.0 111.795 170.817 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.435 ' HG3' HG11 ' A' ' 5' ' ' VAL . 74.5 Cg_endo -72.08 -37.7 4.53 Favored 'Trans proline' 0 C--N 1.363 1.309 0 C-N-CA 125.111 3.874 . . . . 0.0 113.886 174.496 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.54 -27.6 64.28 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.309 2.244 . . . . 0.0 114.298 -179.531 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -88.04 -8.94 54.85 Favored 'General case' 0 C--N 1.371 1.534 0 C-N-CA 125.341 1.456 . . . . 0.0 113.141 170.236 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -87.44 -19.58 27.84 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.791 1.636 . . . . 0.0 111.357 167.182 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 mt -95.11 -67.35 0.86 Allowed 'General case' 0 C--N 1.365 1.252 0 C-N-CA 127.696 2.398 . . . . 0.0 110.94 178.694 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -93.37 -11.21 32.84 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 128.198 2.599 . . . . 0.0 112.032 -168.542 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.19 -81.09 0.44 Allowed Glycine 0 C--N 1.364 2.131 0 C-N-CA 125.067 1.318 . . . . 0.0 113.573 164.224 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.6 m -148.46 -8.59 0.38 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 125.952 1.701 . . . . 0.0 106.927 -173.81 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 t -108.25 63.59 0.61 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.969 2.107 . . . . 0.0 105.386 175.391 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.16 130.73 53.15 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 125.959 1.703 . . . . 0.0 107.878 -172.916 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.74 153.16 18.76 Favored Glycine 0 C--N 1.359 1.829 0 N-CA-C 105.837 -2.905 . . . . 0.0 105.837 161.175 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.21 120.39 5.36 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 105.024 -2.213 . . . . 0.0 105.024 -171.457 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -124.7 137.65 54.34 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 -177.181 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -117.94 106.81 13.34 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.443 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.7 mtp -111.34 121.97 46.62 Favored 'General case' 0 C--N 1.361 1.089 0 N-CA-C 105.312 -2.107 . . . . 0.0 105.312 176.69 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.467 12.0 p30 69.99 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.382 1.981 0 C-N-CA 128.627 2.771 . . . . 0.0 113.704 -179.617 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 53.5 0.17 Allowed Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 105.591 -3.003 . . . . 0.0 105.591 170.686 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -152.47 150.77 29.98 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 105.369 -2.085 . . . . 0.0 105.369 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.99 144.58 31.61 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 126.746 2.018 . . . . 0.0 109.788 -162.73 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -122.63 145.45 48.35 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 127.145 2.178 . . . . 0.0 106.119 173.544 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 85.8 m -123.84 127.64 48.34 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 122.25 1.024 . . . . 0.0 109.411 177.202 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 . . . . . 0 N--CA 1.435 -1.217 0 C-N-CA 127.762 2.425 . . . . 0.0 105.383 -178.962 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 mt . . . . . 0 N--CA 1.443 -0.779 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.0 pt -104.47 -171.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 126.009 1.723 . . . . 0.0 108.936 177.686 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -132.5 84.0 2.12 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.5 t -132.15 125.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 N-CA-C 104.111 -2.552 . . . . 0.0 104.111 173.519 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -76.65 137.53 39.5 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.061 2.144 . . . . 0.0 111.007 -179.238 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.7 p -145.39 178.6 7.98 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.83 0.824 . . . . 0.0 110.492 -165.506 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -149.64 19.5 0.92 Allowed 'General case' 0 C--N 1.355 0.846 0 C-N-CA 126.2 1.8 . . . . 0.0 106.65 169.526 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.1 p -172.92 155.7 3.01 Favored Pre-proline 0 C--N 1.363 1.182 0 C-N-CA 124.853 1.261 . . . . 0.0 107.975 -172.935 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -70.56 -18.44 33.22 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 125.143 3.895 . . . . 0.0 115.181 164.273 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.6 -16.13 59.66 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 127.013 2.125 . . . . 0.0 114.374 172.474 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.5 tp60 -89.53 -4.01 58.09 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.614 2.366 . . . . 0.0 110.186 172.996 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -114.09 -13.1 12.47 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 127.737 2.415 . . . . 0.0 108.982 178.762 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.2 m -85.73 -4.12 59.08 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.173 1.789 . . . . 0.0 111.026 174.997 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -78.02 -57.29 0.96 Allowed Pre-proline 0 N--CA 1.441 -0.892 0 C-N-CA 129.393 3.077 . . . . 0.0 112.092 170.795 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.59 -41.31 3.31 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 125.248 3.965 . . . . 0.0 113.943 173.711 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.16 -27.83 64.84 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 127.313 2.245 . . . . 0.0 114.838 -177.86 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -87.99 -10.5 50.2 Favored 'General case' 0 C--N 1.371 1.519 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 170.781 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.96 -19.75 29.97 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 125.639 1.576 . . . . 0.0 111.539 167.365 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.2 mt -93.7 -66.65 0.91 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 127.645 2.378 . . . . 0.0 111.013 177.758 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -96.91 -8.21 31.37 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.643 2.377 . . . . 0.0 112.326 -167.126 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.84 -80.99 0.51 Allowed Glycine 0 C--N 1.364 2.11 0 C-N-CA 125.015 1.293 . . . . 0.0 113.529 165.308 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.66 -8.67 0.42 Allowed 'General case' 0 C--N 1.354 0.782 0 C-N-CA 125.927 1.691 . . . . 0.0 107.153 -174.81 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -107.13 68.0 0.71 Allowed 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.934 2.093 . . . . 0.0 105.683 176.479 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.27 125.82 42.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 C-N-CA 125.815 1.646 . . . . 0.0 107.078 -173.849 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.28 88.51 0.58 Allowed Glycine 0 C--N 1.359 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.0 107.463 172.025 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.39 116.38 28.92 Favored 'General case' 0 C--N 1.358 0.935 0 C-N-CA 125.043 1.337 . . . . 0.0 109.7 -174.144 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -123.17 141.43 51.98 Favored 'General case' 0 C--N 1.36 1.053 0 N-CA-C 102.317 -3.216 . . . . 0.0 102.317 -174.464 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.92 112.63 10.8 Favored 'General case' 0 CA--C 1.505 -0.787 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.456 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.9 mmt -110.52 119.62 39.76 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 126.806 2.042 . . . . 0.0 106.449 -174.515 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.5 m120 77.26 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.378 1.825 0 C-N-CA 127.452 2.301 . . . . 0.0 111.558 177.492 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -164.55 48.68 0.29 Allowed Glycine 0 C--N 1.352 1.462 0 N-CA-C 106.984 -2.446 . . . . 0.0 106.984 171.47 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -151.22 153.06 34.18 Favored 'General case' 0 C--N 1.366 1.308 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 173.387 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -105.03 152.55 22.6 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 127.458 2.303 . . . . 0.0 110.417 -161.592 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -133.92 141.43 47.33 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 127.411 2.285 . . . . 0.0 105.801 178.971 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.2 m -126.95 124.93 40.61 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.595 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 . . . . . 0 N--CA 1.435 -1.185 0 C-N-CA 126.879 2.072 . . . . 0.0 105.922 179.901 . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.5 mt . . . . . 0 N--CA 1.444 -0.734 0 N-CA-C 103.521 -2.77 . . . . 0.0 103.521 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.7 pt -104.53 -171.8 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.242 0 C-N-CA 125.497 1.519 . . . . 0.0 108.681 177.045 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -135.04 78.63 1.74 Allowed 'General case' 0 C--N 1.36 1.032 0 C-N-CA 123.995 0.918 . . . . 0.0 108.542 -175.774 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 t -126.6 126.38 68.78 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 N-CA-C 104.392 -2.448 . . . . 0.0 104.392 172.677 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -88.61 129.7 35.44 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 125.971 1.708 . . . . 0.0 109.132 -171.529 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.9 p -133.85 -174.59 3.57 Favored 'General case' 0 C--N 1.358 0.975 0 C-N-CA 123.797 0.839 . . . . 0.0 109.265 -162.373 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -151.8 22.6 0.69 Allowed 'General case' 0 C--N 1.358 0.949 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 166.609 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 p -175.5 153.39 1.46 Allowed Pre-proline 0 C--N 1.365 1.269 0 C-N-CA 124.59 1.156 . . . . 0.0 108.242 -169.115 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -69.4 -17.89 38.99 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 125.286 3.99 . . . . 0.0 115.113 163.425 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -82.14 -7.33 59.62 Favored 'General case' 0 C--N 1.368 1.41 0 C-N-CA 126.682 1.993 . . . . 0.0 114.658 173.59 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -100.51 6.03 44.21 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.941 2.096 . . . . 0.0 109.156 170.699 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.6 t -120.3 -14.76 8.72 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 127.603 2.361 . . . . 0.0 108.447 177.846 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -84.61 1.09 47.67 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 126.406 1.882 . . . . 0.0 110.876 173.365 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.77 -59.79 0.43 Allowed Pre-proline 0 N--CA 1.44 -0.972 0 C-N-CA 129.454 3.101 . . . . 0.0 110.91 171.682 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.55 -38.91 4.01 Favored 'Trans proline' 0 C--N 1.365 1.415 0 C-N-CA 125.066 3.844 . . . . 0.0 113.561 173.987 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -71.6 -27.68 63.29 Favored 'General case' 0 C--N 1.368 1.397 0 C-N-CA 127.3 2.24 . . . . 0.0 114.378 -178.531 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.17 -6.54 57.8 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.92 1.236 . . . . 0.0 113.936 169.202 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -88.94 -18.8 26.74 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 125.833 1.653 . . . . 0.0 111.403 166.187 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.1 mt -99.46 -73.64 0.62 Allowed 'General case' 0 C--N 1.364 1.211 0 C-N-CA 127.418 2.287 . . . . 0.0 109.859 179.559 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -103.58 45.61 0.95 Allowed 'General case' 0 C--N 1.36 1.048 0 C-N-CA 129.079 2.952 . . . . 0.0 109.565 -173.638 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.59 81.57 1.23 Allowed Glycine 0 C--N 1.364 2.105 0 C-N-CA 126.492 1.996 . . . . 0.0 116.763 -170.778 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p 175.62 -47.26 0.01 OUTLIER 'General case' 0 C--N 1.358 0.945 0 C-N-CA 127.701 2.4 . . . . 0.0 104.856 175.701 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 t -133.11 76.39 1.68 Allowed 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -177.577 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.57 119.36 39.19 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 125.273 1.429 . . . . 0.0 108.624 178.336 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.37 85.71 0.62 Allowed Glycine 0 C--N 1.368 2.313 0 N-CA-C 108.34 -1.904 . . . . 0.0 108.34 170.515 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.86 115.79 28.2 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.332 1.453 . . . . 0.0 109.956 -172.817 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.3 mttm -125.43 143.84 50.8 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 104.564 -2.384 . . . . 0.0 104.564 -172.401 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -140.04 112.23 7.68 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -177.038 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.0 mmm -112.86 124.91 53.69 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.983 2.113 . . . . 0.0 105.814 -177.811 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.17 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.38 1.928 0 C-N-CA 127.55 2.34 . . . . 0.0 110.701 176.4 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.74 50.02 0.24 Allowed Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 169.795 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.39 148.11 29.08 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 175.59 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.6 t -105.02 151.34 24.07 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.39 2.276 . . . . 0.0 110.124 -161.944 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -134.0 135.1 43.19 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.489 1.915 . . . . 0.0 106.16 178.551 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -120.36 119.74 33.97 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.441 1.096 . . . . 0.0 108.538 178.53 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 . . . . . 0 N--CA 1.435 -1.188 0 C-N-CA 126.53 1.932 . . . . 0.0 106.219 -178.597 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.1 mt . . . . . 0 N--CA 1.445 -0.713 0 N-CA-C 102.492 -3.151 . . . . 0.0 102.492 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.6 pt -101.45 -179.29 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 124.721 1.208 . . . . 0.0 110.744 -175.972 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -121.77 78.45 1.46 Allowed 'General case' 0 C--N 1.362 1.15 0 C-N-CA 125.691 1.596 . . . . 0.0 107.27 -176.206 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -132.12 124.59 53.0 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 N-CA-C 103.674 -2.713 . . . . 0.0 103.674 170.888 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -87.96 140.94 28.99 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 126.18 1.792 . . . . 0.0 108.372 -175.739 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.01 -176.21 5.06 Favored 'General case' 0 C--N 1.357 0.919 0 CA-C-O 121.429 0.633 . . . . 0.0 110.059 -162.574 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.0 t -154.33 24.93 0.47 Allowed 'General case' 0 C--N 1.359 1.005 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 164.534 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.0 p -173.53 150.54 1.8 Allowed Pre-proline 0 C--N 1.365 1.271 0 C-N-CA 124.399 1.08 . . . . 0.0 108.524 -170.08 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.41 ' HA ' ' HB2' ' A' ' 29' ' ' CYS . 51.8 Cg_exo -69.01 -15.22 39.73 Favored 'Trans proline' 0 C--N 1.362 1.277 1 C-N-CA 125.559 4.173 . . . . 0.0 115.119 164.96 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -88.09 5.18 42.38 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.253 1.821 . . . . 0.0 113.819 171.596 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -113.06 28.2 8.99 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.139 2.176 . . . . 0.0 106.671 168.245 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.0 t -147.46 -21.43 0.38 Allowed 'General case' 0 C--N 1.356 0.863 0 C-N-CA 125.693 1.597 . . . . 0.0 109.95 -175.864 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.7 p -86.27 0.27 54.2 Favored 'General case' 0 C--N 1.372 1.55 0 CA-C-N 121.434 1.924 . . . . 0.0 111.308 175.81 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -79.63 -58.53 0.63 Allowed Pre-proline 0 C--N 1.357 0.922 0 C-N-CA 129.737 3.215 . . . . 0.0 111.472 170.109 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.18 -40.31 4.79 Favored 'Trans proline' 0 C--N 1.365 1.441 1 C-N-CA 125.312 4.008 . . . . 0.0 113.787 174.041 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -70.08 -30.71 68.01 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.751 2.421 . . . . 0.0 114.727 -177.901 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -88.0 -7.17 57.45 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 124.836 1.254 . . . . 0.0 113.2 171.646 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -86.98 -18.92 29.54 Favored 'General case' 0 C--N 1.36 1.022 0 C-N-CA 125.697 1.599 . . . . 0.0 111.322 165.512 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -94.22 -66.63 0.9 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.596 2.358 . . . . 0.0 111.278 178.495 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -94.62 -9.46 34.97 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.998 2.519 . . . . 0.0 112.199 -167.892 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -77.95 0.29 Allowed Glycine 0 C--N 1.364 2.138 0 C-N-CA 124.953 1.264 . . . . 0.0 113.318 165.641 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.418 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.6 t -153.56 -7.43 0.17 Allowed 'General case' 0 C--N 1.355 0.806 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 -175.082 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.418 ' H ' ' H ' ' A' ' 23' ' ' SER . 18.6 t -108.68 70.93 0.76 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 126.766 2.026 . . . . 0.0 105.596 175.354 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.7 126.12 42.97 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.642 1.577 . . . . 0.0 107.002 -178.077 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.51 83.59 0.59 Allowed Glycine 0 C--N 1.362 1.981 0 N-CA-C 107.053 -2.419 . . . . 0.0 107.053 171.096 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.85 115.04 27.72 Favored 'General case' 0 C--N 1.359 1.0 0 C-N-CA 125.623 1.569 . . . . 0.0 109.748 -171.117 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -124.62 147.12 48.69 Favored 'General case' 0 CA--C 1.485 -1.534 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 -170.487 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.41 ' HB2' ' HA ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -146.3 131.49 18.41 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -177.619 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -109.43 84.89 2.0 Allowed 'General case' 0 C--N 1.359 1.021 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 171.992 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.271 5.4 p30 1.32 64.93 0.0 OUTLIER 'General case' 0 C--N 1.382 2.005 1 C-N-CA 134.438 5.095 . . . . 0.0 119.273 179.345 . . . . . . . . 3 2 . 1 . 037 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.0 -47.11 0.27 Allowed Glycine 0 C--N 1.354 1.54 0 N-CA-C 108.927 -1.669 . . . . 0.0 108.927 -162.63 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -154.0 154.98 34.72 Favored 'General case' 0 C--N 1.37 1.475 0 CA-C-N 119.398 1.599 . . . . 0.0 109.353 -177.036 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.4 t -107.75 152.43 24.36 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 129.45 3.1 . . . . 0.0 110.196 -166.913 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -133.61 139.84 46.75 Favored 'General case' 0 C--N 1.363 1.165 0 C-N-CA 126.808 2.043 . . . . 0.0 106.425 177.554 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.4 m -123.18 112.92 18.26 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 124.704 1.202 . . . . 0.0 108.816 178.877 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 . . . . . 0 N--CA 1.439 -0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 106.539 177.084 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 mt . . . . . 0 N--CA 1.449 -0.486 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt -99.28 -174.84 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.212 0 C-N-CA 126.076 1.75 . . . . 0.0 110.113 -176.76 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -128.25 82.91 2.11 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -174.167 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.3 t -134.63 126.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 104.273 -2.491 . . . . 0.0 104.273 172.856 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -80.28 138.75 36.81 Favored 'General case' 0 C--N 1.366 1.315 0 C-N-CA 127.036 2.134 . . . . 0.0 110.253 -178.928 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.7 p -145.1 171.18 14.87 Favored 'General case' 0 C--N 1.356 0.883 0 CA-C-O 121.782 0.801 . . . . 0.0 109.356 -166.888 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -119.85 -22.84 6.64 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 127.04 2.136 . . . . 0.0 108.156 161.184 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.5 p -135.9 162.44 56.8 Favored Pre-proline 0 C--N 1.366 1.288 0 C-N-CA 125.951 1.7 . . . . 0.0 110.046 -169.132 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -69.62 -17.07 38.42 Favored 'Trans proline' 0 C--N 1.361 1.213 1 C-N-CA 125.364 4.043 . . . . 0.0 115.113 163.397 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.32 -11.12 59.94 Favored 'General case' 0 C--N 1.369 1.441 0 C-N-CA 127.101 2.16 . . . . 0.0 114.187 171.0 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -98.23 7.31 46.43 Favored 'General case' 0 C--N 1.372 1.564 0 C-N-CA 127.36 2.264 . . . . 0.0 109.43 172.245 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -123.79 -13.18 7.48 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 127.662 2.385 . . . . 0.0 108.602 177.767 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -85.36 -1.11 56.65 Favored 'General case' 0 C--N 1.371 1.525 0 C-N-CA 126.26 1.824 . . . . 0.0 110.905 173.679 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -81.88 -57.23 0.52 Allowed Pre-proline 0 N--CA 1.44 -0.974 0 C-N-CA 129.31 3.044 . . . . 0.0 111.112 172.827 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.76 -42.41 3.43 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 124.958 3.772 . . . . 0.0 113.962 172.568 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -70.0 -29.45 66.53 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.345 2.258 . . . . 0.0 114.845 -176.661 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -88.04 -8.62 55.31 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.784 1.234 . . . . 0.0 113.303 171.356 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -84.79 -25.88 27.9 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 125.732 1.613 . . . . 0.0 111.182 165.777 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.8 mt -89.78 -63.42 1.29 Allowed 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.516 2.326 . . . . 0.0 111.761 179.934 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -98.53 -8.98 25.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.629 2.371 . . . . 0.0 111.964 -167.645 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -80.95 0.47 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.039 1.304 . . . . 0.0 113.651 164.956 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.3 m -147.51 -9.69 0.42 Allowed 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.858 1.663 . . . . 0.0 106.965 -175.058 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -106.19 69.92 0.82 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 126.946 2.098 . . . . 0.0 105.726 176.326 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 127.15 42.55 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -175.363 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 87.19 0.51 Allowed Glycine 0 C--N 1.36 1.868 0 N-CA-C 107.211 -2.356 . . . . 0.0 107.211 172.219 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.56 117.31 28.36 Favored 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.328 1.451 . . . . 0.0 109.935 -174.089 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -122.99 140.15 53.33 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 102.986 -2.968 . . . . 0.0 102.986 -175.575 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.25 107.53 6.83 Favored 'General case' 0 CA--C 1.501 -0.935 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 -178.115 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 62.4 mtt -110.61 123.89 50.84 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 127.295 2.238 . . . . 0.0 106.042 -174.377 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 80.39 -86.29 0.02 OUTLIER 'General case' 0 C--N 1.38 1.919 0 C-N-CA 127.403 2.281 . . . . 0.0 109.908 177.854 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.77 49.51 0.24 Allowed Glycine 0 N--CA 1.435 -1.429 0 N-CA-C 106.444 -2.662 . . . . 0.0 106.444 170.03 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -151.37 150.58 30.64 Favored 'General case' 0 C--N 1.367 1.335 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 177.822 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.9 t -105.03 150.29 25.08 Favored 'General case' 0 C--N 1.362 1.127 0 C-N-CA 127.137 2.175 . . . . 0.0 110.819 -160.712 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -131.98 144.47 50.83 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 127.437 2.295 . . . . 0.0 105.948 178.092 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.6 m -127.8 127.53 43.68 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 108.168 177.859 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 . . . . . 0 N--CA 1.437 -1.11 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 178.926 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.9 mt . . . . . 0 N--CA 1.443 -0.786 0 N-CA-C 103.465 -2.791 . . . . 0.0 103.465 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild core ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.0 pt -104.32 -176.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.261 0 C-N-CA 125.78 1.632 . . . . 0.0 108.906 178.738 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -134.97 104.01 5.8 Favored 'General case' 0 C--N 1.361 1.105 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -178.101 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.3 t -114.44 -50.06 5.14 Favored 'Isoleucine or valine' 0 C--N 1.364 1.228 0 C-N-CA 125.012 1.325 . . . . 0.0 110.851 -172.491 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 82.14 121.39 0.05 OUTLIER 'General case' 0 C--N 1.364 1.211 0 C-N-CA 131.638 3.975 . . . . 0.0 110.45 -167.192 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.8 p -148.0 -177.73 5.9 Favored 'General case' 0 C--N 1.356 0.877 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -166.227 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.1 t -152.71 24.23 0.59 Allowed 'General case' 0 C--N 1.358 0.96 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 167.008 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.2 p -173.04 150.41 1.95 Allowed Pre-proline 0 C--N 1.364 1.218 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 -171.086 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -69.77 -14.28 35.84 Favored 'Trans proline' 0 C--N 1.36 1.149 1 C-N-CA 125.428 4.086 . . . . 0.0 114.949 162.106 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.8 -15.26 59.79 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 127.674 2.389 . . . . 0.0 114.19 170.489 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -97.78 8.8 44.07 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.686 2.395 . . . . 0.0 109.222 173.149 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -124.51 -14.47 6.85 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.827 2.051 . . . . 0.0 109.446 -179.827 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.9 m -86.51 -6.87 58.79 Favored 'General case' 0 C--N 1.367 1.351 0 C-N-CA 125.712 1.605 . . . . 0.0 111.237 175.72 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -82.52 -54.45 0.6 Allowed Pre-proline 0 C--N 1.356 0.866 0 C-N-CA 129.3 3.04 . . . . 0.0 111.956 171.37 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.38 -46.0 4.61 Favored 'Trans proline' 0 C--N 1.367 1.504 1 C-N-CA 125.974 4.45 . . . . 0.0 113.802 172.92 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.05 -30.87 69.3 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.589 2.356 . . . . 0.0 115.353 -178.152 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -88.01 -6.06 58.18 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 124.662 1.185 . . . . 0.0 113.444 172.979 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -88.59 -21.43 24.04 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 126.003 1.721 . . . . 0.0 111.081 165.889 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.7 mt -92.64 -66.65 0.91 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.396 2.278 . . . . 0.0 111.196 178.51 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.1 -7.29 33.04 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 128.283 2.633 . . . . 0.0 112.34 -167.565 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.56 -79.9 0.57 Allowed Glycine 0 C--N 1.364 2.123 0 C-N-CA 125.05 1.31 . . . . 0.0 113.72 164.83 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.51 -9.61 0.42 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.854 1.661 . . . . 0.0 107.198 -175.684 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 t -105.79 69.0 0.8 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 126.875 2.07 . . . . 0.0 106.031 177.37 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.49 124.83 39.28 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.736 1.614 . . . . 0.0 106.985 -174.155 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.24 89.91 0.78 Allowed Glycine 0 C--N 1.363 2.043 0 N-CA-C 107.091 -2.403 . . . . 0.0 107.091 170.065 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.42 111.88 23.82 Favored 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.303 1.441 . . . . 0.0 109.894 -169.719 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -125.54 140.26 52.91 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 104.102 -2.555 . . . . 0.0 104.102 -173.382 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.16 110.28 9.47 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 -174.78 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.7 mmm -122.34 129.57 52.28 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.592 1.957 . . . . 0.0 105.747 -172.539 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m120 76.15 -7.25 1.85 Allowed 'General case' 0 C--N 1.382 1.98 0 C-N-CA 126.793 2.037 . . . . 0.0 115.342 168.972 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.27 42.0 3.58 Favored Glycine 0 C--N 1.362 2.017 0 C-N-CA 126.63 2.062 . . . . 0.0 111.082 -174.114 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.03 156.97 38.33 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 102.968 -2.975 . . . . 0.0 102.968 169.862 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 39.0 t -105.05 155.58 18.85 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 126.305 1.842 . . . . 0.0 109.896 -166.077 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -132.56 134.51 45.04 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 176.95 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.3 m -123.02 117.34 25.25 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 . . . . . 0 N--CA 1.437 -1.084 0 C-N-CA 126.851 2.06 . . . . 0.0 106.21 -179.524 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 38.4 p . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt -127.27 130.56 70.91 Favored 'Isoleucine or valine' 0 C--N 1.363 1.157 0 N-CA-C 104.164 -2.532 . . . . 0.0 104.164 -176.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -108.18 -174.42 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.175 1.39 . . . . 0.0 109.287 177.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -130.98 80.39 1.94 Allowed 'General case' 0 C--N 1.362 1.139 0 C-N-CA 124.984 1.314 . . . . 0.0 107.634 -176.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.411 HG11 ' HG3' ' A' ' 16' ' ' PRO . 6.9 t -131.16 129.75 63.09 Favored 'Isoleucine or valine' 0 C--N 1.361 1.093 0 N-CA-C 103.702 -2.703 . . . . 0.0 103.702 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -79.88 135.72 36.5 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.017 1.727 . . . . 0.0 110.56 -177.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.0 p -143.66 171.95 13.48 Favored 'General case' 0 C--N 1.359 1.008 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -169.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.39 22.88 0.54 Allowed 'General case' 0 C--N 1.355 0.821 0 N-CA-C 105.747 -1.946 . . . . 0.0 105.747 174.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.3 p -171.96 149.72 2.34 Favored Pre-proline 0 C--N 1.36 1.059 0 N-CA-C 105.116 -2.179 . . . . 0.0 105.116 -174.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -71.66 -16.88 30.04 Favored 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 124.197 3.264 . . . . 0.0 114.549 168.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -79.09 -10.75 59.91 Favored 'General case' 0 C--N 1.369 1.45 0 C-N-CA 127.516 2.326 . . . . 0.0 114.799 172.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 -89.94 -11.53 41.46 Favored 'General case' 0 C--N 1.37 1.5 0 C-N-CA 127.735 2.414 . . . . 0.0 110.275 171.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.5 t -109.72 -13.63 14.46 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 127.289 2.236 . . . . 0.0 108.76 -178.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 67.5 m -83.69 -1.39 53.94 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.182 1.793 . . . . 0.0 111.445 174.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 95.2 mttt -80.35 -59.06 0.54 Allowed Pre-proline 0 N--CA 1.44 -0.938 0 C-N-CA 129.545 3.138 . . . . 0.0 111.471 172.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.411 ' HG3' HG11 ' A' ' 5' ' ' VAL . 68.4 Cg_endo -70.61 -40.35 4.08 Favored 'Trans proline' 0 C--N 1.364 1.39 0 C-N-CA 125.097 3.865 . . . . 0.0 113.703 174.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.5 m -69.52 -31.45 69.69 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 127.6 2.36 . . . . 0.0 114.696 -177.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.3 mttp -88.14 -7.17 57.31 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 124.837 1.255 . . . . 0.0 113.296 172.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -87.1 -19.21 28.87 Favored 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.746 1.618 . . . . 0.0 111.468 165.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.8 mt -93.9 -67.39 0.86 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 127.608 2.363 . . . . 0.0 111.14 178.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -94.72 -9.54 34.42 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.09 2.556 . . . . 0.0 112.4 -167.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -78.06 0.29 Allowed Glycine 0 C--N 1.365 2.153 0 C-N-CA 124.97 1.271 . . . . 0.0 113.161 166.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -152.99 -8.52 0.17 Allowed 'General case' 0 C--N 1.355 0.836 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 -176.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.408 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -105.42 71.12 0.91 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 126.992 2.117 . . . . 0.0 105.748 175.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.38 123.24 31.21 Favored 'General case' 0 C--N 1.359 0.997 0 C-N-CA 125.684 1.594 . . . . 0.0 106.776 -174.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.19 85.19 0.73 Allowed Glycine 0 C--N 1.364 2.098 0 N-CA-C 107.488 -2.245 . . . . 0.0 107.488 171.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.46 114.39 26.4 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.602 1.561 . . . . 0.0 109.949 -169.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.3 mttp -122.95 142.02 51.28 Favored 'General case' 0 C--N 1.362 1.118 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 -171.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.8 t -122.49 112.52 18.14 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 -178.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.7 mmm -121.7 123.53 42.1 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.747 -2.316 . . . . 0.0 104.747 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.72 -84.61 0.02 OUTLIER 'General case' 0 C--N 1.381 1.964 0 C-N-CA 127.623 2.369 . . . . 0.0 111.099 176.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.83 54.47 0.19 Allowed Glycine 0 N--CA 1.434 -1.487 0 N-CA-C 105.58 -3.008 . . . . 0.0 105.58 169.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.5 mttm -154.04 152.19 30.21 Favored 'General case' 0 C--N 1.362 1.149 0 N-CA-C 106.035 -1.839 . . . . 0.0 106.035 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.4 t -105.78 144.07 33.04 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 127.518 2.327 . . . . 0.0 109.465 -164.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -124.33 139.53 53.82 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 126.35 1.86 . . . . 0.0 106.671 174.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 67.7 m -125.2 111.45 15.28 Favored 'General case' 0 CA--C 1.5 -0.967 0 C-N-CA 124.09 0.956 . . . . 0.0 108.498 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -111.61 -148.23 0.43 Allowed 'General case' 0 N--CA 1.439 -0.99 0 C-N-CA 127.001 2.12 . . . . 0.0 106.647 178.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -134.62 156.12 49.28 Favored 'General case' 0 C--N 1.358 0.976 0 N-CA-C 105.791 -1.929 . . . . 0.0 105.791 176.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -90.01 125.27 35.34 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 171.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.329 0 O-C-N 123.399 0.437 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 44.4 p . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 110.568 -0.16 . . . . 0.0 110.568 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 39.7 mt -129.61 124.99 60.52 Favored 'Isoleucine or valine' 0 C--N 1.364 1.223 0 N-CA-C 104.212 -2.514 . . . . 0.0 104.212 -178.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.0 pt -112.88 -171.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.291 0 C-N-CA 125.578 1.551 . . . . 0.0 108.208 174.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.9 m-80 -131.9 80.29 1.91 Allowed 'General case' 0 C--N 1.363 1.156 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -177.501 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.413 HG11 ' HG3' ' A' ' 16' ' ' PRO . 11.3 t -130.62 129.52 64.3 Favored 'Isoleucine or valine' 0 C--N 1.361 1.082 0 N-CA-C 103.59 -2.745 . . . . 0.0 103.59 171.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -82.64 134.26 35.16 Favored 'General case' 0 C--N 1.365 1.273 0 C-N-CA 125.734 1.614 . . . . 0.0 110.448 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.5 p -142.51 170.44 15.7 Favored 'General case' 0 C--N 1.36 1.029 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 -167.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.03 22.37 0.76 Allowed 'General case' 0 C--N 1.355 0.843 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 171.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.7 p -170.42 150.16 3.31 Favored Pre-proline 0 C--N 1.362 1.121 0 N-CA-C 105.399 -2.075 . . . . 0.0 105.399 -174.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -71.46 -15.79 30.92 Favored 'Trans proline' 0 C--N 1.355 0.909 0 C-N-CA 124.196 3.264 . . . . 0.0 114.891 169.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -82.66 -2.35 53.74 Favored 'General case' 0 C--N 1.368 1.385 0 C-N-CA 126.947 2.099 . . . . 0.0 114.315 171.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -101.87 7.53 41.56 Favored 'General case' 0 C--N 1.372 1.568 0 C-N-CA 127.195 2.198 . . . . 0.0 109.233 170.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.2 t -128.25 -14.3 4.86 Favored 'General case' 0 C--N 1.359 0.996 0 C-N-CA 127.229 2.212 . . . . 0.0 108.253 -178.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.9 m -84.24 -1.15 54.72 Favored 'General case' 0 C--N 1.372 1.571 0 C-N-CA 126.064 1.746 . . . . 0.0 111.756 175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -79.47 -58.67 0.64 Allowed Pre-proline 0 C--N 1.358 0.965 0 C-N-CA 128.926 2.89 . . . . 0.0 111.74 170.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.413 ' HG3' HG11 ' A' ' 5' ' ' VAL . 66.7 Cg_endo -70.89 -39.66 4.16 Favored 'Trans proline' 0 C--N 1.364 1.366 0 C-N-CA 124.966 3.778 . . . . 0.0 113.522 175.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.6 m -69.42 -31.79 70.35 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.824 2.45 . . . . 0.0 114.679 -178.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -88.06 -6.38 57.97 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.853 1.261 . . . . 0.0 113.184 172.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -88.23 -19.65 26.57 Favored 'General case' 0 C--N 1.361 1.108 0 C-N-CA 125.814 1.646 . . . . 0.0 111.232 165.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 40.0 mt -93.38 -67.11 0.88 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 127.636 2.374 . . . . 0.0 111.059 178.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -94.89 -11.36 28.87 Favored 'General case' 0 C--N 1.362 1.14 0 C-N-CA 128.115 2.566 . . . . 0.0 112.277 -167.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.86 -79.72 0.31 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 124.753 1.168 . . . . 0.0 113.284 165.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -146.42 -15.1 0.44 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 125.495 1.518 . . . . 0.0 107.097 -175.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.7 t -103.43 72.8 1.16 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 126.94 2.096 . . . . 0.0 106.14 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.0 122.58 30.37 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 125.792 1.637 . . . . 0.0 106.777 -174.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.9 85.25 0.75 Allowed Glycine 0 C--N 1.365 2.156 0 N-CA-C 107.647 -2.181 . . . . 0.0 107.647 172.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.09 115.07 27.34 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 125.567 1.547 . . . . 0.0 109.896 -169.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.7 mttp -123.37 142.92 50.47 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 -171.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.8 t -123.31 114.52 20.31 Favored 'General case' 0 C--N 1.351 0.645 0 N-CA-C 105.603 -1.999 . . . . 0.0 105.603 -179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.45 123.0 39.67 Favored 'General case' 0 C--N 1.358 0.95 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 177.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 77.33 -84.6 0.02 OUTLIER 'General case' 0 C--N 1.381 1.949 0 C-N-CA 127.481 2.312 . . . . 0.0 111.27 176.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.59 54.52 0.19 Allowed Glycine 0 N--CA 1.433 -1.558 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 168.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.1 mtmt -152.85 152.23 31.31 Favored 'General case' 0 C--N 1.364 1.224 0 N-CA-C 105.925 -1.88 . . . . 0.0 105.925 175.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.8 t -104.99 145.04 30.98 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 127.514 2.326 . . . . 0.0 109.038 -164.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -125.97 138.07 53.73 Favored 'General case' 0 CA--C 1.5 -0.968 0 C-N-CA 126.074 1.749 . . . . 0.0 106.624 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.0 m -124.36 112.69 17.26 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 124.482 1.113 . . . . 0.0 108.573 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -114.34 -147.05 0.41 Allowed 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 126.985 2.114 . . . . 0.0 106.396 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -135.87 155.61 50.05 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 105.821 -1.918 . . . . 0.0 105.821 176.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -88.08 122.13 31.3 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 107.321 -1.362 . . . . 0.0 107.321 172.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.366 0 CA-C-N 116.201 -0.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 87.6 m . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.3 mt -119.42 117.57 54.46 Favored 'Isoleucine or valine' 0 C--N 1.361 1.085 0 N-CA-C 104.066 -2.568 . . . . 0.0 104.066 179.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 26.4 pt -100.8 177.94 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.288 0 C-N-CA 125.188 1.395 . . . . 0.0 110.953 -176.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 -113.38 71.4 0.74 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 126.273 1.829 . . . . 0.0 108.34 -174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.2 t -133.56 143.92 37.48 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.179 0 N-CA-C 103.567 -2.753 . . . . 0.0 103.567 172.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 44.4 mmtm -103.25 139.97 38.01 Favored 'General case' 0 C--N 1.363 1.182 0 C-N-CA 126.827 2.051 . . . . 0.0 107.068 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.4 p -143.28 177.82 8.16 Favored 'General case' 0 C--N 1.358 0.946 0 N-CA-C 108.396 -0.965 . . . . 0.0 108.396 -170.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -155.02 22.99 0.44 Allowed 'General case' 0 C--N 1.355 0.815 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 174.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.2 p -174.79 148.01 1.14 Allowed Pre-proline 0 C--N 1.361 1.078 0 N-CA-C 105.235 -2.135 . . . . 0.0 105.235 -172.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -71.81 -13.19 29.32 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.444 3.429 . . . . 0.0 114.157 167.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -73.97 -21.41 60.02 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 128.495 2.718 . . . . 0.0 114.833 170.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -87.4 -15.08 38.82 Favored 'General case' 0 C--N 1.372 1.55 0 C-N-CA 128.095 2.558 . . . . 0.0 110.743 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.4 t -104.45 -14.22 15.79 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 126.732 2.013 . . . . 0.0 109.955 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 p -87.97 3.33 49.09 Favored 'General case' 0 C--N 1.368 1.374 0 O-C-N 120.498 -1.376 . . . . 0.0 111.371 174.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.4 mttp -79.16 -59.62 0.6 Allowed Pre-proline 0 C--N 1.361 1.099 0 C-N-CA 129.364 3.066 . . . . 0.0 111.221 169.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.75 -39.42 4.62 Favored 'Trans proline' 0 C--N 1.366 1.488 0 C-N-CA 125.08 3.853 . . . . 0.0 113.653 174.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.99 -30.65 66.97 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.87 2.468 . . . . 0.0 114.653 -177.18 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -88.1 -7.37 57.05 Favored 'General case' 0 C--N 1.37 1.493 0 C-N-CA 124.766 1.226 . . . . 0.0 113.281 171.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -86.66 -18.98 29.95 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 125.702 1.601 . . . . 0.0 111.468 165.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.2 mt -94.04 -66.8 0.89 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 127.615 2.366 . . . . 0.0 111.153 178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -95.25 -9.44 33.17 Favored 'General case' 0 C--N 1.363 1.159 0 C-N-CA 128.001 2.521 . . . . 0.0 112.329 -167.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.39 -79.79 0.32 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 124.868 1.223 . . . . 0.0 113.234 166.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.42 -14.2 0.39 Allowed 'General case' 0 C--N 1.354 0.78 0 C-N-CA 125.543 1.537 . . . . 0.0 106.949 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.8 t -103.51 72.46 1.14 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.022 2.129 . . . . 0.0 106.369 178.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.67 124.8 34.51 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 106.83 -1.544 . . . . 0.0 106.83 -175.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.71 84.47 0.67 Allowed Glycine 0 C--N 1.364 2.108 0 N-CA-C 107.493 -2.243 . . . . 0.0 107.493 172.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.35 116.15 28.7 Favored 'General case' 0 C--N 1.36 1.032 0 C-N-CA 125.563 1.545 . . . . 0.0 109.923 -170.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -122.99 139.73 53.76 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.648 -1.612 . . . . 0.0 106.648 -171.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 48.5 t -121.01 111.94 18.11 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.89 -1.892 . . . . 0.0 105.89 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -119.91 123.17 42.91 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 104.854 -2.276 . . . . 0.0 104.854 177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 77.58 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.382 2.004 0 C-N-CA 127.646 2.378 . . . . 0.0 111.027 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.54 55.95 0.19 Allowed Glycine 0 N--CA 1.433 -1.546 0 N-CA-C 105.219 -3.152 . . . . 0.0 105.219 168.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -153.08 148.31 26.85 Favored 'General case' 0 C--N 1.362 1.14 0 N-CA-C 105.574 -2.01 . . . . 0.0 105.574 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 45.2 t -106.45 143.36 34.68 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 127.373 2.269 . . . . 0.0 109.529 -165.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -125.99 142.28 51.59 Favored 'General case' 0 C--N 1.357 0.926 0 C-N-CA 126.575 1.95 . . . . 0.0 107.083 175.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.09 120.56 32.72 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 124.687 1.195 . . . . 0.0 108.399 178.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -121.5 -147.43 0.39 Allowed 'General case' 0 N--CA 1.436 -1.126 0 N-CA-C 105.605 -1.998 . . . . 0.0 105.605 178.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.0 m120 -135.08 156.5 48.91 Favored 'General case' 0 C--N 1.358 0.961 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 177.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -90.38 126.8 36.0 Favored 'General case' 0 C--N 1.359 0.986 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.366 1.296 0 O-C-N 123.427 0.454 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 80.6 p . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 121.951 0.881 . . . . 0.0 110.937 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 42.6 mt -124.48 116.87 48.85 Favored 'Isoleucine or valine' 0 C--N 1.36 1.039 0 N-CA-C 103.525 -2.769 . . . . 0.0 103.525 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.9 pt -103.63 -176.38 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.279 0 C-N-CA 125.357 1.463 . . . . 0.0 109.128 178.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.1 m-80 -129.38 79.23 1.9 Allowed 'General case' 0 C--N 1.361 1.102 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -176.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 11.6 t -129.55 127.83 65.18 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.621 -2.733 . . . . 0.0 103.621 171.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm -82.37 133.82 35.23 Favored 'General case' 0 C--N 1.364 1.238 0 C-N-CA 126.183 1.793 . . . . 0.0 109.967 -175.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.2 p -142.65 172.51 12.6 Favored 'General case' 0 C--N 1.357 0.904 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 -167.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.0 26.91 0.48 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 170.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.7 p -170.4 148.29 2.83 Favored Pre-proline 0 C--N 1.36 1.039 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 -176.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -71.34 -16.08 31.25 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 124.199 3.266 . . . . 0.0 114.672 169.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -80.75 -7.28 59.33 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 127.217 2.207 . . . . 0.0 114.636 171.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -94.55 -3.25 50.13 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.195 2.198 . . . . 0.0 109.945 170.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.3 t -116.69 -13.92 10.8 Favored 'General case' 0 C--N 1.36 1.049 0 C-N-CA 127.28 2.232 . . . . 0.0 108.238 -179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -83.97 -1.18 54.15 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 126.196 1.799 . . . . 0.0 111.394 174.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.11 -59.35 0.54 Allowed Pre-proline 0 C--N 1.357 0.931 0 C-N-CA 129.556 3.142 . . . . 0.0 111.322 172.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -70.68 -40.87 3.5 Favored 'Trans proline' 0 C--N 1.365 1.397 0 C-N-CA 125.079 3.853 . . . . 0.0 113.48 174.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.4 m -69.93 -31.33 69.03 Favored 'General case' 0 C--N 1.366 1.322 0 C-N-CA 127.736 2.415 . . . . 0.0 114.824 -176.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -88.07 -7.37 57.09 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 124.624 1.169 . . . . 0.0 113.338 172.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -87.14 -20.66 26.72 Favored 'General case' 0 C--N 1.362 1.111 0 C-N-CA 125.649 1.58 . . . . 0.0 111.447 165.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.1 mt -92.74 -66.7 0.91 Allowed 'General case' 0 C--N 1.366 1.303 0 C-N-CA 127.553 2.341 . . . . 0.0 111.086 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -96.59 -7.86 33.28 Favored 'General case' 0 C--N 1.361 1.097 0 C-N-CA 128.107 2.563 . . . . 0.0 112.253 -167.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.81 -80.03 0.5 Allowed Glycine 0 C--N 1.365 2.167 0 C-N-CA 124.936 1.255 . . . . 0.0 113.621 165.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.1 m -147.63 -11.38 0.4 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.74 1.616 . . . . 0.0 107.093 -175.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.6 t -105.13 69.17 0.84 Allowed 'General case' 0 C--N 1.366 1.298 0 C-N-CA 126.907 2.083 . . . . 0.0 106.142 177.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.78 126.14 42.91 Favored 'General case' 0 C--N 1.358 0.976 0 C-N-CA 125.741 1.616 . . . . 0.0 106.855 -175.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.494 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -101.56 85.8 0.57 Allowed Glycine 0 C--N 1.363 2.054 0 N-CA-C 107.298 -2.321 . . . . 0.0 107.298 170.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.08 112.88 24.53 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 125.327 1.451 . . . . 0.0 109.812 -169.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -121.91 141.78 50.94 Favored 'General case' 0 C--N 1.361 1.088 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 -170.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.6 t -127.96 110.62 12.71 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 -177.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -118.93 128.11 54.11 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 174.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 78.75 -85.54 0.02 OUTLIER 'General case' 0 C--N 1.383 2.023 0 C-N-CA 127.537 2.335 . . . . 0.0 111.023 173.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 55.6 0.18 Allowed Glycine 0 N--CA 1.432 -1.582 0 N-CA-C 106.083 -2.807 . . . . 0.0 106.083 169.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.5 mttp -153.45 151.99 30.5 Favored 'General case' 0 C--N 1.362 1.148 0 N-CA-C 106.264 -1.754 . . . . 0.0 106.264 175.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -106.35 144.98 32.26 Favored 'General case' 0 C--N 1.357 0.906 0 C-N-CA 127.558 2.343 . . . . 0.0 109.239 -165.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 29.3 mtmm -127.11 139.02 53.28 Favored 'General case' 0 CA--C 1.502 -0.881 0 C-N-CA 126.059 1.744 . . . . 0.0 106.835 173.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.7 m -120.66 119.42 32.79 Favored 'General case' 0 C--N 1.36 1.037 0 C-N-CA 124.523 1.129 . . . . 0.0 108.16 177.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 -118.55 -160.98 0.81 Allowed 'General case' 0 N--CA 1.438 -1.061 0 C-N-CA 126.37 1.868 . . . . 0.0 106.008 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 55.4 m-80 -130.97 94.25 3.56 Favored 'General case' 0 C--N 1.36 1.026 0 N-CA-C 106.198 -1.778 . . . . 0.0 106.198 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.494 HD22 ' HA3' ' A' ' 26' ' ' GLY . 69.5 m-80 -139.97 95.31 2.88 Favored 'General case' 0 C--N 1.356 0.878 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 175.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.375 0 CA-C-N 116.093 -0.503 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 45.5 p . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.6 mt -129.84 125.17 60.28 Favored 'Isoleucine or valine' 0 C--N 1.364 1.222 0 N-CA-C 104.311 -2.477 . . . . 0.0 104.311 -178.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -113.56 -169.93 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.303 0 C-N-CA 125.631 1.572 . . . . 0.0 107.961 174.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.97 80.73 1.86 Allowed 'General case' 0 C--N 1.361 1.084 0 C-N-CA 124.406 1.083 . . . . 0.0 108.431 -178.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.6 t -128.35 126.97 66.7 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 103.665 -2.717 . . . . 0.0 103.665 172.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -78.56 134.19 37.26 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 126.395 1.878 . . . . 0.0 110.919 -175.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.2 p -145.95 168.82 19.93 Favored 'General case' 0 C--N 1.357 0.929 0 N-CA-C 108.494 -0.928 . . . . 0.0 108.494 -166.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -151.92 26.37 0.64 Allowed 'General case' 0 C--N 1.357 0.9 0 N-CA-C 105.445 -2.058 . . . . 0.0 105.445 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.7 p -168.85 149.77 4.31 Favored Pre-proline 0 C--N 1.361 1.074 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 -177.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -71.86 -13.46 29.27 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.257 3.304 . . . . 0.0 114.727 169.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -86.63 6.91 28.71 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 126.855 2.062 . . . . 0.0 113.582 170.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -113.09 22.23 14.56 Favored 'General case' 0 C--N 1.37 1.468 0 C-N-CA 127.38 2.272 . . . . 0.0 107.24 170.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.8 t -144.93 -19.01 0.5 Allowed 'General case' 0 N--CA 1.441 -0.881 0 C-N-CA 126.372 1.869 . . . . 0.0 108.858 -175.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 65.4 m -82.58 -1.26 50.21 Favored 'General case' 0 C--N 1.373 1.619 0 C-N-CA 126.347 1.859 . . . . 0.0 111.798 174.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt -82.6 -56.81 0.49 Allowed Pre-proline 0 C--N 1.357 0.919 0 C-N-CA 129.357 3.063 . . . . 0.0 111.424 172.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.34 -40.47 5.94 Favored 'Trans proline' 0 C--N 1.365 1.441 0 C-N-CA 124.939 3.759 . . . . 0.0 113.881 172.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.41 -31.8 70.39 Favored 'General case' 0 C--N 1.367 1.329 0 C-N-CA 127.698 2.399 . . . . 0.0 114.74 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -88.06 -6.73 57.78 Favored 'General case' 0 C--N 1.369 1.422 0 C-N-CA 124.992 1.317 . . . . 0.0 113.252 172.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -87.44 -19.51 27.92 Favored 'General case' 0 C--N 1.361 1.092 0 C-N-CA 125.749 1.619 . . . . 0.0 111.392 165.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -93.77 -67.38 0.86 Allowed 'General case' 0 C--N 1.364 1.22 0 C-N-CA 127.598 2.359 . . . . 0.0 111.089 178.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -94.75 -10.61 31.07 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 128.089 2.555 . . . . 0.0 112.269 -167.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 104.22 -79.97 0.31 Allowed Glycine 0 C--N 1.365 2.142 0 C-N-CA 124.882 1.23 . . . . 0.0 113.106 165.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.37 -15.39 0.44 Allowed 'General case' 0 C--N 1.355 0.824 0 C-N-CA 125.569 1.548 . . . . 0.0 107.092 -175.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.1 t -102.85 74.74 1.35 Allowed 'General case' 0 C--N 1.364 1.228 0 C-N-CA 127.005 2.122 . . . . 0.0 106.134 177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.87 122.95 26.52 Favored 'General case' 0 C--N 1.36 1.033 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 -174.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.59 86.51 0.76 Allowed Glycine 0 C--N 1.363 2.071 0 N-CA-C 107.565 -2.214 . . . . 0.0 107.565 172.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.72 116.0 28.21 Favored 'General case' 0 C--N 1.359 1.013 0 C-N-CA 125.504 1.521 . . . . 0.0 109.957 -169.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 60.7 mttm -123.93 143.41 50.4 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 -171.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 50.3 t -122.83 114.87 21.09 Favored 'General case' 0 C--N 1.353 0.75 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -125.62 124.15 40.55 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 104.429 -2.434 . . . . 0.0 104.429 178.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.43 -84.13 0.02 OUTLIER 'General case' 0 C--N 1.383 2.03 0 C-N-CA 127.579 2.352 . . . . 0.0 110.88 176.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.08 53.14 0.19 Allowed Glycine 0 N--CA 1.433 -1.538 0 N-CA-C 106.059 -2.816 . . . . 0.0 106.059 168.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.5 mttp -152.75 153.92 34.17 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 105.982 -1.858 . . . . 0.0 105.982 176.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.1 t -105.08 145.33 30.65 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 127.384 2.274 . . . . 0.0 108.73 -164.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -126.37 138.67 53.58 Favored 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 126.225 1.81 . . . . 0.0 106.447 175.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 65.5 m -125.33 112.51 16.43 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 124.473 1.109 . . . . 0.0 108.51 -179.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -113.63 -146.23 0.4 Allowed 'General case' 0 N--CA 1.438 -1.035 0 C-N-CA 126.931 2.092 . . . . 0.0 106.546 179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -135.68 155.97 49.58 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 105.733 -1.951 . . . . 0.0 105.733 177.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -89.35 123.8 33.85 Favored 'General case' 0 C--N 1.359 1.017 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 171.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.401 0 CA-C-N 116.184 -0.462 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 81.2 p . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 121.956 0.884 . . . . 0.0 111.003 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.0 mt -127.06 115.19 40.28 Favored 'Isoleucine or valine' 0 C--N 1.36 1.024 0 N-CA-C 102.955 -2.98 . . . . 0.0 102.955 175.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.0 pt -102.0 -177.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.32 0 C-N-CA 125.435 1.494 . . . . 0.0 109.831 -178.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.6 m120 -126.87 76.8 1.67 Allowed 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.815 1.246 . . . . 0.0 108.196 -173.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.2 t -132.11 130.59 60.99 Favored 'Isoleucine or valine' 0 C--N 1.36 1.058 0 N-CA-C 103.957 -2.608 . . . . 0.0 103.957 173.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm -80.56 137.11 36.37 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.202 1.801 . . . . 0.0 110.605 -178.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.82 172.51 12.92 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 -170.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.83 27.85 0.43 Allowed 'General case' 0 C--N 1.355 0.82 0 N-CA-C 105.245 -2.131 . . . . 0.0 105.245 169.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.4 p -171.23 149.14 2.55 Favored Pre-proline 0 C--N 1.36 1.037 0 N-CA-C 104.999 -2.223 . . . . 0.0 104.999 -176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -71.35 -16.78 31.11 Favored 'Trans proline' 0 C--N 1.355 0.883 0 C-N-CA 124.278 3.319 . . . . 0.0 114.775 169.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -81.62 -6.84 59.38 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.139 2.176 . . . . 0.0 114.647 172.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -94.49 -4.11 48.72 Favored 'General case' 0 C--N 1.37 1.48 0 C-N-CA 127.173 2.189 . . . . 0.0 110.1 170.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.6 t -116.19 -13.45 11.13 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 127.402 2.281 . . . . 0.0 108.048 -178.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.4 m -84.04 0.09 49.6 Favored 'General case' 0 C--N 1.371 1.512 0 C-N-CA 126.367 1.867 . . . . 0.0 111.304 173.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -80.27 -59.37 0.53 Allowed Pre-proline 0 C--N 1.358 0.94 0 C-N-CA 129.365 3.066 . . . . 0.0 111.14 172.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.22 -40.49 3.16 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 124.902 3.735 . . . . 0.0 113.509 174.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.79 -31.13 68.88 Favored 'General case' 0 C--N 1.368 1.382 0 C-N-CA 127.535 2.334 . . . . 0.0 114.747 -177.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.09 -7.87 56.32 Favored 'General case' 0 C--N 1.371 1.516 0 C-N-CA 124.59 1.156 . . . . 0.0 113.289 172.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -86.92 -21.16 26.45 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 125.798 1.639 . . . . 0.0 111.528 165.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.7 mt -92.16 -66.46 0.92 Allowed 'General case' 0 C--N 1.366 1.301 0 C-N-CA 127.601 2.36 . . . . 0.0 111.04 178.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -95.72 -12.14 25.93 Favored 'General case' 0 C--N 1.363 1.175 0 C-N-CA 128.022 2.529 . . . . 0.0 112.106 -167.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.74 -74.59 0.4 Allowed Glycine 0 C--N 1.364 2.133 0 C-N-CA 124.915 1.245 . . . . 0.0 113.836 164.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 p -141.72 -36.59 0.43 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.584 1.553 . . . . 0.0 107.218 -170.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.6 t -90.5 75.07 6.78 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.86 2.464 . . . . 0.0 108.346 176.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -129.32 124.8 35.24 Favored 'General case' 0 C--N 1.361 1.087 0 N-CA-C 106.239 -1.763 . . . . 0.0 106.239 -176.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.455 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -101.52 87.06 0.63 Allowed Glycine 0 C--N 1.362 1.992 0 N-CA-C 107.545 -2.222 . . . . 0.0 107.545 172.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.26 115.21 27.12 Favored 'General case' 0 C--N 1.357 0.902 0 C-N-CA 125.286 1.434 . . . . 0.0 109.721 -171.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -123.33 142.27 51.13 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 -172.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.9 t -123.56 113.87 19.29 Favored 'General case' 0 C--N 1.351 0.635 0 N-CA-C 105.885 -1.894 . . . . 0.0 105.885 -178.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 79.0 mtp -120.38 123.4 42.98 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.991 -2.225 . . . . 0.0 104.991 175.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 78.58 -84.78 0.02 OUTLIER 'General case' 0 C--N 1.383 2.039 0 C-N-CA 127.512 2.325 . . . . 0.0 110.936 174.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.8 55.28 0.2 Allowed Glycine 0 N--CA 1.434 -1.499 0 N-CA-C 105.806 -2.917 . . . . 0.0 105.806 168.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.1 mttm -154.04 152.5 30.57 Favored 'General case' 0 C--N 1.363 1.18 0 N-CA-C 106.07 -1.826 . . . . 0.0 106.07 176.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.91 146.44 29.98 Favored 'General case' 0 C--N 1.358 0.951 0 C-N-CA 127.438 2.295 . . . . 0.0 109.568 -163.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -126.13 141.82 51.78 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 126.294 1.838 . . . . 0.0 106.793 173.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -124.79 122.89 38.73 Favored 'General case' 0 C--N 1.359 0.989 0 C-N-CA 124.255 1.022 . . . . 0.0 108.261 177.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -122.52 -159.72 0.85 Allowed 'General case' 0 N--CA 1.435 -1.178 0 N-CA-C 105.798 -1.927 . . . . 0.0 105.798 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 -132.36 90.68 2.83 Favored 'General case' 0 C--N 1.36 1.045 0 N-CA-C 105.841 -1.911 . . . . 0.0 105.841 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.455 HD22 ' HA3' ' A' ' 26' ' ' GLY . 70.9 m-80 -138.99 93.63 2.72 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.298 -2.112 . . . . 0.0 105.298 176.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.356 0 CA-C-N 116.038 -0.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 74.3 p . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 121.952 0.882 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.9 mt -124.89 119.45 56.01 Favored 'Isoleucine or valine' 0 C--N 1.361 1.067 0 N-CA-C 103.51 -2.774 . . . . 0.0 103.51 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.4 pt -104.16 -176.72 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.279 1.431 . . . . 0.0 109.299 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -127.73 77.19 1.73 Allowed 'General case' 0 C--N 1.362 1.115 0 C-N-CA 124.699 1.2 . . . . 0.0 107.8 -175.599 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.433 HG11 ' HG3' ' A' ' 16' ' ' PRO . 12.3 t -129.98 129.69 65.87 Favored 'Isoleucine or valine' 0 C--N 1.361 1.087 0 N-CA-C 103.928 -2.619 . . . . 0.0 103.928 172.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -79.72 137.02 36.92 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 126.451 1.901 . . . . 0.0 110.447 -178.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -145.86 173.43 12.14 Favored 'General case' 0 C--N 1.358 0.965 0 N-CA-C 108.237 -1.023 . . . . 0.0 108.237 -169.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -154.96 27.27 0.42 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.227 -2.138 . . . . 0.0 105.227 169.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.4 p -172.06 147.32 1.87 Allowed Pre-proline 0 C--N 1.359 1.017 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 -174.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -71.07 -13.71 31.52 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.609 3.539 . . . . 0.0 114.28 167.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 52.7 tptt -72.18 -23.27 61.24 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 128.879 2.872 . . . . 0.0 114.438 169.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.5 tt0 -89.42 -8.74 52.4 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 127.555 2.342 . . . . 0.0 110.931 177.088 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -110.45 -15.24 13.96 Favored 'General case' 0 C--N 1.36 1.03 0 C-N-CA 126.984 2.114 . . . . 0.0 109.417 -178.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.3 p -87.89 3.01 50.07 Favored 'General case' 0 C--N 1.369 1.422 0 O-C-N 120.179 -1.576 . . . . 0.0 111.156 175.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -79.87 -58.25 0.63 Allowed Pre-proline 0 C--N 1.359 1.002 0 C-N-CA 129.846 3.258 . . . . 0.0 111.347 170.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.433 ' HG3' HG11 ' A' ' 5' ' ' VAL . 67.0 Cg_endo -70.15 -40.22 4.95 Favored 'Trans proline' 0 C--N 1.365 1.437 0 C-N-CA 125.119 3.879 . . . . 0.0 113.756 173.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -69.78 -31.68 69.75 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.647 2.379 . . . . 0.0 114.796 -176.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -88.1 -8.0 56.11 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 124.952 1.301 . . . . 0.0 113.16 172.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -86.85 -20.16 27.89 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 125.81 1.644 . . . . 0.0 111.434 165.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 35.5 mt -92.02 -66.66 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.692 2.397 . . . . 0.0 111.097 177.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -96.9 -11.21 25.02 Favored 'General case' 0 C--N 1.362 1.129 0 C-N-CA 127.914 2.486 . . . . 0.0 112.288 -166.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -78.55 0.43 Allowed Glycine 0 C--N 1.363 2.08 0 C-N-CA 124.933 1.254 . . . . 0.0 113.097 166.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.7 m -148.47 -6.96 0.4 Allowed 'General case' 0 C--N 1.356 0.855 0 C-N-CA 125.764 1.625 . . . . 0.0 107.201 -175.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.415 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.7 t -107.39 64.46 0.63 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 126.77 2.028 . . . . 0.0 106.156 178.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -124.6 127.0 46.71 Favored 'General case' 0 C--N 1.358 0.946 0 C-N-CA 125.944 1.697 . . . . 0.0 107.227 -174.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.507 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -103.92 87.74 0.58 Allowed Glycine 0 C--N 1.362 1.983 0 N-CA-C 107.023 -2.431 . . . . 0.0 107.023 169.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.04 114.75 26.59 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 125.227 1.411 . . . . 0.0 109.868 -170.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.1 mtpm? -124.42 140.53 52.86 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 -171.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.3 t -124.33 119.2 28.59 Favored 'General case' 0 C--N 1.352 0.703 0 N-CA-C 105.755 -1.943 . . . . 0.0 105.755 -178.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.5 mtt -127.42 126.98 43.37 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 104.045 -2.576 . . . . 0.0 104.045 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.05 -84.24 0.02 OUTLIER 'General case' 0 C--N 1.382 2.011 0 C-N-CA 127.553 2.341 . . . . 0.0 110.82 173.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.3 55.94 0.17 Allowed Glycine 0 N--CA 1.432 -1.586 0 N-CA-C 106.088 -2.805 . . . . 0.0 106.088 167.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.6 mttt -154.0 151.54 29.49 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.5 t -106.81 146.69 30.6 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 127.543 2.337 . . . . 0.0 109.367 -163.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.0 mtmm -127.29 139.12 53.11 Favored 'General case' 0 C--N 1.357 0.922 0 C-N-CA 126.432 1.893 . . . . 0.0 106.701 174.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.8 m -123.81 116.15 22.51 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 124.458 1.103 . . . . 0.0 108.043 178.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.3 m-85 -114.55 -168.05 1.31 Allowed 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 126.51 1.924 . . . . 0.0 106.883 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -124.42 88.97 2.99 Favored 'General case' 0 C--N 1.359 1.012 0 N-CA-C 106.362 -1.718 . . . . 0.0 106.362 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.507 HD22 ' HA3' ' A' ' 26' ' ' GLY . 69.7 m-80 -137.68 95.61 3.09 Favored 'General case' 0 C--N 1.356 0.865 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 177.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.376 0 CA-C-N 116.054 -0.521 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 122.026 0.917 . . . . 0.0 109.956 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 45.5 mt -119.67 119.37 60.21 Favored 'Isoleucine or valine' 0 C--N 1.36 1.06 0 N-CA-C 103.728 -2.693 . . . . 0.0 103.728 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 33.6 pt -103.21 -173.11 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.319 0 C-N-CA 125.39 1.476 . . . . 0.0 109.015 178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -134.95 78.16 1.72 Allowed 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.244 1.018 . . . . 0.0 108.379 -175.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.3 t -128.31 128.1 68.05 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.725 -2.694 . . . . 0.0 103.725 172.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -79.2 134.62 36.68 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 126.354 1.861 . . . . 0.0 110.472 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -144.39 169.47 17.86 Favored 'General case' 0 C--N 1.358 0.961 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 -167.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -148.8 18.86 1.01 Allowed 'General case' 0 C--N 1.353 0.733 0 C-N-CA 125.874 1.67 . . . . 0.0 106.515 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.7 p -169.6 151.19 4.25 Favored Pre-proline 0 C--N 1.36 1.033 0 N-CA-C 105.699 -1.963 . . . . 0.0 105.699 -175.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -71.26 -15.15 31.68 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 124.597 3.531 . . . . 0.0 114.326 166.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -73.63 -19.61 60.81 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.306 2.642 . . . . 0.0 114.744 170.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.0 tp60 -88.96 -13.76 38.2 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.415 2.686 . . . . 0.0 110.883 175.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.7 t -106.29 -13.79 15.29 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.11 2.164 . . . . 0.0 109.407 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 77.2 p -87.82 4.41 44.61 Favored 'General case' 0 C--N 1.368 1.398 0 O-C-N 120.303 -1.498 . . . . 0.0 111.251 174.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -79.04 -59.33 0.63 Allowed Pre-proline 0 C--N 1.361 1.107 0 C-N-CA 129.279 3.032 . . . . 0.0 111.139 169.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.72 -39.41 4.68 Favored 'Trans proline' 0 C--N 1.366 1.484 0 C-N-CA 125.089 3.859 . . . . 0.0 113.651 174.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.7 m -70.78 -30.32 66.77 Favored 'General case' 0 C--N 1.368 1.398 0 C-N-CA 127.57 2.348 . . . . 0.0 114.818 -176.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -88.08 -8.85 54.89 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 124.787 1.235 . . . . 0.0 112.682 171.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -86.43 -19.93 28.91 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 125.731 1.612 . . . . 0.0 111.696 166.098 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.1 mt -94.01 -67.9 0.83 Allowed 'General case' 0 C--N 1.365 1.261 0 C-N-CA 127.521 2.328 . . . . 0.0 110.873 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -93.99 -10.47 33.51 Favored 'General case' 0 C--N 1.363 1.193 0 C-N-CA 128.169 2.587 . . . . 0.0 112.2 -168.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.1 -79.71 0.42 Allowed Glycine 0 C--N 1.364 2.136 0 C-N-CA 124.897 1.237 . . . . 0.0 113.69 164.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.3 m -145.2 -15.39 0.51 Allowed 'General case' 0 C--N 1.354 0.804 0 C-N-CA 125.681 1.592 . . . . 0.0 107.284 -173.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.0 t -105.6 72.66 0.98 Allowed 'General case' 0 C--N 1.364 1.239 0 C-N-CA 126.835 2.054 . . . . 0.0 105.89 177.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.43 121.9 30.08 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 125.687 1.595 . . . . 0.0 106.864 -174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.97 84.27 0.64 Allowed Glycine 0 C--N 1.365 2.178 0 N-CA-C 107.672 -2.171 . . . . 0.0 107.672 171.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.04 117.08 29.66 Favored 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.532 1.533 . . . . 0.0 110.141 -170.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 87.5 mttt -124.64 140.33 53.04 Favored 'General case' 0 C--N 1.36 1.056 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 -171.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.2 t -124.62 119.4 28.92 Favored 'General case' 0 C--N 1.35 0.614 0 N-CA-C 105.439 -2.06 . . . . 0.0 105.439 -178.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -129.39 126.3 38.51 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 103.857 -2.646 . . . . 0.0 103.857 176.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.2 m120 78.6 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.008 0 C-N-CA 127.564 2.346 . . . . 0.0 110.968 174.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.34 55.64 0.18 Allowed Glycine 0 N--CA 1.432 -1.567 0 N-CA-C 106.069 -2.812 . . . . 0.0 106.069 168.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.8 mttt -154.01 153.16 31.46 Favored 'General case' 0 C--N 1.362 1.141 0 N-CA-C 106.557 -1.646 . . . . 0.0 106.557 173.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -107.54 146.07 32.33 Favored 'General case' 0 C--N 1.356 0.885 0 C-N-CA 127.596 2.358 . . . . 0.0 109.092 -164.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -127.65 139.47 52.7 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 126.391 1.876 . . . . 0.0 106.451 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -121.58 118.72 29.94 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 124.563 1.145 . . . . 0.0 108.149 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.5 m-85 -119.5 -149.18 0.43 Allowed 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 -134.96 154.92 51.53 Favored 'General case' 0 C--N 1.358 0.944 0 N-CA-C 105.858 -1.905 . . . . 0.0 105.858 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -88.48 122.37 31.89 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 107.333 -1.358 . . . . 0.0 107.333 172.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.36 0 CA-C-N 116.212 -0.449 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 5.3 t . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.414 HG23 ' HG2' ' A' ' 35' ' ' LYS . 85.4 mt -104.88 124.34 59.48 Favored 'Isoleucine or valine' 0 C--N 1.367 1.356 0 C-N-CA 126.777 2.031 . . . . 0.0 105.82 -174.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.6 pt -102.47 179.22 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.082 0 C-N-CA 125.272 1.429 . . . . 0.0 111.113 -171.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -120.41 67.96 0.85 Allowed 'General case' 0 C--N 1.362 1.11 0 C-N-CA 125.741 1.616 . . . . 0.0 108.42 -172.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.2 t -125.91 129.64 72.4 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 N-CA-C 104.629 -2.36 . . . . 0.0 104.629 174.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -87.68 133.73 33.78 Favored 'General case' 0 C--N 1.363 1.185 0 C-N-CA 125.98 1.712 . . . . 0.0 108.991 -177.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 27.0 p -138.5 175.26 9.72 Favored 'General case' 0 C--N 1.358 0.947 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -168.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -154.54 23.12 0.47 Allowed 'General case' 0 C--N 1.356 0.855 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 174.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.3 p -173.68 149.39 1.58 Allowed Pre-proline 0 C--N 1.361 1.1 0 N-CA-C 105.036 -2.209 . . . . 0.0 105.036 -173.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -71.4 -16.34 31.01 Favored 'Trans proline' 0 C--N 1.355 0.892 0 C-N-CA 124.189 3.259 . . . . 0.0 114.617 168.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -78.31 -13.75 59.71 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 127.624 2.37 . . . . 0.0 114.897 173.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -88.2 -11.26 47.23 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 127.962 2.505 . . . . 0.0 110.324 171.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -110.13 -12.34 14.5 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 127.322 2.249 . . . . 0.0 108.758 -178.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.6 m -85.68 -1.65 57.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.535 1.934 . . . . 0.0 111.12 173.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -79.08 -59.27 0.63 Allowed Pre-proline 0 C--N 1.359 0.979 0 C-N-CA 129.203 3.001 . . . . 0.0 111.319 171.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -71.22 -41.9 2.3 Favored 'Trans proline' 0 C--N 1.364 1.365 0 C-N-CA 125.004 3.803 . . . . 0.0 113.551 175.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.32 -29.05 65.66 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.656 2.383 . . . . 0.0 114.813 -177.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 59.7 mttp -88.0 -8.39 55.7 Favored 'General case' 0 C--N 1.37 1.476 0 CA-C-N 120.069 1.304 . . . . 0.0 113.545 170.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -86.55 -20.74 27.53 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 125.694 1.598 . . . . 0.0 111.536 166.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.9 mt -93.96 -66.21 0.93 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.549 2.339 . . . . 0.0 111.141 178.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -95.4 -7.76 37.5 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.812 2.445 . . . . 0.0 112.212 -167.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.8 -78.77 0.37 Allowed Glycine 0 C--N 1.366 2.196 0 C-N-CA 125.124 1.345 . . . . 0.0 113.334 165.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.413 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.9 t -153.12 -7.92 0.17 Allowed 'General case' 0 C--N 1.354 0.787 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 -175.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.413 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.3 t -104.93 69.7 0.88 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 127.103 2.161 . . . . 0.0 105.687 175.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.99 127.49 41.76 Favored 'General case' 0 C--N 1.359 1.008 0 C-N-CA 125.709 1.604 . . . . 0.0 106.691 -175.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.56 89.57 0.66 Allowed Glycine 0 C--N 1.36 1.91 0 N-CA-C 107.084 -2.406 . . . . 0.0 107.084 171.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.11 116.52 29.11 Favored 'General case' 0 C--N 1.356 0.874 0 C-N-CA 125.144 1.378 . . . . 0.0 109.736 -171.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.3 mtpm? -123.44 141.73 51.7 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 -173.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -123.03 110.29 15.16 Favored 'General case' 0 C--N 1.353 0.727 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 -178.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 49.9 mtt -117.38 122.8 44.83 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 175.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 79.12 -85.34 0.02 OUTLIER 'General case' 0 C--N 1.383 2.022 0 C-N-CA 127.561 2.345 . . . . 0.0 110.204 175.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.28 56.49 0.18 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 105.218 -3.153 . . . . 0.0 105.218 169.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.7 mtpt -152.37 149.88 29.09 Favored 'General case' 0 C--N 1.362 1.135 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 176.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.0 t -105.83 142.33 35.74 Favored 'General case' 0 C--N 1.356 0.867 0 C-N-CA 127.238 2.215 . . . . 0.0 109.086 -165.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.414 ' HG2' HG23 ' A' ' 2' ' ' ILE . 51.6 mtmt -120.82 146.14 46.86 Favored 'General case' 0 CA--C 1.5 -0.96 0 C-N-CA 126.219 1.807 . . . . 0.0 107.168 172.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.88 142.84 48.31 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 106.734 -1.58 . . . . 0.0 106.734 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -138.67 -160.6 1.08 Allowed 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 103.631 -2.729 . . . . 0.0 103.631 177.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -132.36 96.66 3.91 Favored 'General case' 0 C--N 1.358 0.974 0 N-CA-C 105.845 -1.909 . . . . 0.0 105.845 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -138.31 98.59 3.64 Favored 'General case' 0 C--N 1.356 0.868 0 N-CA-C 105.193 -2.151 . . . . 0.0 105.193 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.382 0 CA-C-N 116.103 -0.499 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 40.1 p . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 38.1 mt -125.2 128.84 73.13 Favored 'Isoleucine or valine' 0 C--N 1.363 1.166 0 N-CA-C 104.377 -2.453 . . . . 0.0 104.377 -176.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -107.65 -174.88 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.295 0 C-N-CA 125.143 1.377 . . . . 0.0 109.189 176.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.6 m-80 -131.63 80.05 1.91 Allowed 'General case' 0 C--N 1.361 1.101 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -177.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.8 t -129.16 126.46 64.2 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 N-CA-C 103.46 -2.793 . . . . 0.0 103.46 171.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.0 mppt? -85.75 138.19 32.27 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 125.902 1.681 . . . . 0.0 108.872 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.1 p -146.74 171.07 15.71 Favored 'General case' 0 C--N 1.357 0.901 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 -162.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.63 21.73 0.71 Allowed 'General case' 0 C--N 1.355 0.817 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 174.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.8 p -170.15 149.96 3.44 Favored Pre-proline 0 C--N 1.36 1.036 0 N-CA-C 105.258 -2.127 . . . . 0.0 105.258 -174.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -70.98 -17.37 32.09 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 124.443 3.429 . . . . 0.0 114.55 168.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -79.8 -10.86 59.83 Favored 'General case' 0 C--N 1.369 1.455 0 C-N-CA 127.353 2.261 . . . . 0.0 114.923 173.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -89.03 -10.64 46.77 Favored 'General case' 0 C--N 1.371 1.54 0 C-N-CA 127.685 2.394 . . . . 0.0 110.248 170.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.5 t -108.83 -14.6 14.55 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.193 2.197 . . . . 0.0 108.646 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.6 m -83.97 -0.68 52.52 Favored 'General case' 0 C--N 1.369 1.433 0 C-N-CA 126.208 1.803 . . . . 0.0 111.358 173.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 56.9 mttp -79.15 -59.65 0.6 Allowed Pre-proline 0 C--N 1.358 0.969 0 C-N-CA 128.85 2.86 . . . . 0.0 111.277 170.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.04 -42.51 3.05 Favored 'Trans proline' 0 C--N 1.366 1.451 0 C-N-CA 125.017 3.812 . . . . 0.0 113.423 174.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.5 -32.59 72.67 Favored 'General case' 0 C--N 1.368 1.388 0 C-N-CA 127.442 2.297 . . . . 0.0 115.135 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -88.06 -7.41 57.04 Favored 'General case' 0 C--N 1.37 1.488 0 C-N-CA 124.429 1.092 . . . . 0.0 112.605 173.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -87.82 -22.57 24.41 Favored 'General case' 0 C--N 1.364 1.207 0 C-N-CA 125.795 1.638 . . . . 0.0 111.73 165.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -92.06 -66.68 0.91 Allowed 'General case' 0 C--N 1.366 1.293 0 C-N-CA 127.527 2.331 . . . . 0.0 110.964 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 85.8 m-85 -91.95 -18.65 23.4 Favored 'General case' 0 C--N 1.362 1.137 0 C-N-CA 128.21 2.604 . . . . 0.0 111.685 -169.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.96 -75.21 0.46 Allowed Glycine 0 C--N 1.365 2.192 0 C-N-CA 125.081 1.324 . . . . 0.0 113.211 165.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 73.3 m -144.95 -9.48 0.6 Allowed 'General case' 0 C--N 1.354 0.802 0 C-N-CA 126.227 1.811 . . . . 0.0 107.694 -171.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.6 t -111.31 61.99 0.61 Allowed 'General case' 0 C--N 1.365 1.248 0 C-N-CA 126.353 1.861 . . . . 0.0 106.216 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.8 124.09 45.27 Favored 'General case' 0 C--N 1.358 0.959 0 C-N-CA 126.063 1.745 . . . . 0.0 107.458 -176.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.11 85.77 0.47 Allowed Glycine 0 C--N 1.362 2.012 0 N-CA-C 106.652 -2.579 . . . . 0.0 106.652 168.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.84 111.96 23.72 Favored 'General case' 0 C--N 1.357 0.921 0 C-N-CA 125.224 1.409 . . . . 0.0 110.094 -168.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -119.68 146.23 45.77 Favored 'General case' 0 CA--C 1.497 -1.089 0 C-N-CA 125.194 1.397 . . . . 0.0 107.268 -171.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 52.5 t -129.97 114.87 16.37 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 -178.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.1 mmt -126.78 127.02 44.39 Favored 'General case' 0 C--N 1.359 1.014 0 N-CA-C 103.569 -2.752 . . . . 0.0 103.569 176.496 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 80.11 -83.65 0.02 OUTLIER 'General case' 0 C--N 1.383 2.048 0 C-N-CA 127.469 2.308 . . . . 0.0 109.946 175.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.26 56.83 0.12 Allowed Glycine 0 N--CA 1.431 -1.675 0 N-CA-C 105.42 -3.072 . . . . 0.0 105.42 168.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -153.68 152.08 30.4 Favored 'General case' 0 C--N 1.364 1.198 0 N-CA-C 106.227 -1.768 . . . . 0.0 106.227 174.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -106.19 142.72 35.41 Favored 'General case' 0 C--N 1.357 0.932 0 C-N-CA 127.713 2.405 . . . . 0.0 109.314 -164.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 27.2 mtmm -124.87 138.01 54.27 Favored 'General case' 0 CA--C 1.5 -0.952 0 C-N-CA 126.045 1.738 . . . . 0.0 106.887 173.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.1 m -121.27 110.71 16.47 Favored 'General case' 0 C--N 1.359 1.01 0 C-N-CA 124.428 1.091 . . . . 0.0 108.103 178.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -107.73 -173.78 2.37 Favored 'General case' 0 N--CA 1.44 -0.945 0 C-N-CA 126.744 2.018 . . . . 0.0 107.858 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -118.27 86.12 2.47 Favored 'General case' 0 C--N 1.361 1.071 0 N-CA-C 106.672 -1.603 . . . . 0.0 106.672 -176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -134.58 97.26 3.75 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 105.893 -1.892 . . . . 0.0 105.893 178.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.394 0 CA-C-N 116.089 -0.505 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 65.6 p . . . . . 0 N--CA 1.491 1.622 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.3 mt -104.99 115.3 46.61 Favored 'Isoleucine or valine' 0 C--N 1.365 1.255 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 -171.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.9 pt -101.67 -178.41 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.221 0 C-N-CA 125.819 1.648 . . . . 0.0 109.852 -176.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.71 76.63 1.69 Allowed 'General case' 0 C--N 1.362 1.132 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 -175.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.404 HG11 ' HG3' ' A' ' 16' ' ' PRO . 18.4 t -127.23 126.08 67.23 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.776 -2.675 . . . . 0.0 103.776 172.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -83.49 132.54 34.94 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 125.962 1.705 . . . . 0.0 110.151 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 p -141.66 171.56 13.89 Favored 'General case' 0 C--N 1.357 0.925 0 N-CA-C 108.348 -0.982 . . . . 0.0 108.348 -165.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -153.43 26.93 0.51 Allowed 'General case' 0 C--N 1.356 0.87 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 170.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -170.13 148.76 3.11 Favored Pre-proline 0 C--N 1.359 1.006 0 N-CA-C 105.196 -2.15 . . . . 0.0 105.196 -176.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -71.58 -15.93 30.51 Favored 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 124.216 3.278 . . . . 0.0 114.764 169.452 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 14.2 tppt? -79.43 -11.04 59.92 Favored 'General case' 0 C--N 1.371 1.503 0 C-N-CA 127.493 2.317 . . . . 0.0 114.356 171.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -92.23 -2.23 56.62 Favored 'General case' 0 C--N 1.372 1.575 0 C-N-CA 127.216 2.207 . . . . 0.0 110.238 171.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.5 t -118.81 -13.55 9.53 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.254 2.221 . . . . 0.0 108.243 -178.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -85.1 -0.84 55.83 Favored 'General case' 0 C--N 1.37 1.487 0 C-N-CA 126.077 1.751 . . . . 0.0 111.251 174.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.9 mmmm -81.45 -57.31 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.927 0 C-N-CA 128.915 2.886 . . . . 0.0 111.282 171.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.404 ' HG3' HG11 ' A' ' 5' ' ' VAL . 61.9 Cg_endo -70.04 -41.36 3.98 Favored 'Trans proline' 0 C--N 1.364 1.376 0 C-N-CA 124.796 3.664 . . . . 0.0 113.832 173.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.75 -30.59 68.22 Favored 'General case' 0 C--N 1.367 1.368 0 C-N-CA 127.522 2.329 . . . . 0.0 114.824 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.05 -7.62 56.74 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 124.747 1.219 . . . . 0.0 113.071 172.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.69 -20.26 26.51 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 125.656 1.582 . . . . 0.0 111.706 165.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.0 mt -94.9 -67.86 0.83 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.499 2.32 . . . . 0.0 110.967 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -91.65 -13.22 32.18 Favored 'General case' 0 C--N 1.364 1.204 0 C-N-CA 128.373 2.669 . . . . 0.0 111.789 -169.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.95 -75.63 0.29 Allowed Glycine 0 C--N 1.365 2.148 0 C-N-CA 124.916 1.246 . . . . 0.0 113.942 162.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.41 -34.76 0.48 Allowed 'General case' 0 C--N 1.354 0.795 0 C-N-CA 125.543 1.537 . . . . 0.0 107.071 -170.054 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 15.3 t -92.61 78.93 4.86 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 127.877 2.471 . . . . 0.0 107.778 175.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -132.82 120.13 21.17 Favored 'General case' 0 C--N 1.361 1.077 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 -176.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.32 85.53 0.73 Allowed Glycine 0 C--N 1.363 2.076 0 N-CA-C 107.638 -2.185 . . . . 0.0 107.638 172.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.18 117.6 30.26 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 125.65 1.58 . . . . 0.0 110.095 -169.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 59.4 mttm -123.99 141.39 52.09 Favored 'General case' 0 C--N 1.362 1.146 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -171.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.5 t -122.68 111.0 16.22 Favored 'General case' 0 C--N 1.351 0.671 0 N-CA-C 105.861 -1.903 . . . . 0.0 105.861 -178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 77.3 mtp -117.81 123.67 46.52 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 105.109 -2.182 . . . . 0.0 105.109 175.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 78.58 -84.3 0.02 OUTLIER 'General case' 0 C--N 1.383 2.026 0 C-N-CA 127.641 2.376 . . . . 0.0 110.826 174.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.04 56.07 0.18 Allowed Glycine 0 N--CA 1.432 -1.571 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 168.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -154.0 152.36 30.44 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 105.813 -1.921 . . . . 0.0 105.813 175.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.9 t -105.58 145.5 30.88 Favored 'General case' 0 C--N 1.357 0.924 0 C-N-CA 127.262 2.225 . . . . 0.0 109.574 -164.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.3 mtmt -126.04 143.62 51.04 Favored 'General case' 0 CA--C 1.5 -0.948 0 C-N-CA 126.225 1.81 . . . . 0.0 106.964 173.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -127.59 116.6 20.58 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 124.949 1.3 . . . . 0.0 108.298 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 69.7 m-85 -117.58 -146.45 0.4 Allowed 'General case' 0 N--CA 1.438 -1.053 0 C-N-CA 126.429 1.892 . . . . 0.0 105.935 178.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.21 154.69 51.51 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 176.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -86.64 120.43 27.94 Favored 'General case' 0 C--N 1.359 0.981 0 N-CA-C 107.605 -1.258 . . . . 0.0 107.605 172.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.33 0 CA-C-N 116.187 -0.46 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 77.0 p . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 122.015 0.912 . . . . 0.0 110.898 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.4 mt -126.49 117.99 49.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.126 -2.916 . . . . 0.0 103.126 175.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.6 pt -103.42 -171.11 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.273 0 C-N-CA 125.442 1.497 . . . . 0.0 109.335 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -133.48 77.71 1.74 Allowed 'General case' 0 C--N 1.361 1.077 0 C-N-CA 124.464 1.106 . . . . 0.0 108.685 -174.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -129.49 127.7 65.18 Favored 'Isoleucine or valine' 0 C--N 1.362 1.121 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 171.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -82.43 132.78 35.2 Favored 'General case' 0 C--N 1.366 1.289 0 C-N-CA 125.964 1.706 . . . . 0.0 109.9 -176.657 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.0 p -141.38 166.62 24.25 Favored 'General case' 0 CA--C 1.49 -1.331 0 CA-C-O 123.821 1.772 . . . . 0.0 110.079 -165.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 83.3 m -128.91 -49.11 1.23 Allowed 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 129.634 3.174 . . . . 0.0 104.699 -174.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.9 p -114.23 163.24 19.64 Favored Pre-proline 0 C--N 1.36 1.058 0 C-N-CA 127.443 2.297 . . . . 0.0 109.011 -177.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -72.6 -17.31 26.51 Favored 'Trans proline' 0 C--N 1.356 0.925 0 C-N-CA 124.546 3.497 . . . . 0.0 114.409 164.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.8 tptp -75.68 -14.98 60.36 Favored 'General case' 0 C--N 1.372 1.57 0 C-N-CA 127.681 2.392 . . . . 0.0 114.469 170.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -84.81 -14.63 47.46 Favored 'General case' 0 C--N 1.37 1.491 0 C-N-CA 128.399 2.679 . . . . 0.0 110.62 172.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.0 t -107.46 -14.08 14.94 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 127.343 2.257 . . . . 0.0 109.077 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.7 m -84.52 -2.06 56.75 Favored 'General case' 0 C--N 1.369 1.413 0 C-N-CA 126.067 1.747 . . . . 0.0 111.386 174.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -80.43 -57.29 0.63 Allowed Pre-proline 0 N--CA 1.442 -0.866 0 C-N-CA 129.042 2.937 . . . . 0.0 111.5 171.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.63 -41.52 4.37 Favored 'Trans proline' 0 C--N 1.365 1.434 0 C-N-CA 124.984 3.789 . . . . 0.0 114.049 173.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -69.75 -30.9 68.59 Favored 'General case' 0 C--N 1.368 1.379 0 C-N-CA 127.579 2.352 . . . . 0.0 114.815 -177.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -88.08 -7.7 56.58 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 124.921 1.288 . . . . 0.0 113.33 172.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -86.99 -20.12 27.71 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 125.654 1.582 . . . . 0.0 111.436 165.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.4 mt -92.39 -66.51 0.92 Allowed 'General case' 0 C--N 1.366 1.317 0 C-N-CA 127.51 2.324 . . . . 0.0 111.168 177.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -97.2 -8.83 29.04 Favored 'General case' 0 C--N 1.362 1.132 0 C-N-CA 128.032 2.533 . . . . 0.0 112.245 -166.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.64 0.46 Allowed Glycine 0 C--N 1.364 2.109 0 C-N-CA 125.042 1.306 . . . . 0.0 113.377 165.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.42 -8.65 0.38 Allowed 'General case' 0 C--N 1.354 0.787 0 C-N-CA 125.843 1.657 . . . . 0.0 107.143 -175.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.1 t -106.56 67.78 0.73 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 126.822 2.049 . . . . 0.0 105.933 177.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.74 126.26 43.16 Favored 'General case' 0 CA--C 1.5 -0.969 0 C-N-CA 125.748 1.619 . . . . 0.0 106.946 -174.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.507 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -102.79 88.07 0.63 Allowed Glycine 0 C--N 1.361 1.97 0 N-CA-C 107.372 -2.291 . . . . 0.0 107.372 170.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.97 114.17 25.86 Favored 'General case' 0 C--N 1.357 0.908 0 C-N-CA 125.048 1.339 . . . . 0.0 109.84 -171.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -119.65 141.95 48.88 Favored 'General case' 0 C--N 1.361 1.083 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -173.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.0 t -122.2 110.37 15.64 Favored 'General case' 0 C--N 1.351 0.667 0 N-CA-C 105.417 -2.068 . . . . 0.0 105.417 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -120.9 123.42 42.47 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 104.79 -2.3 . . . . 0.0 104.79 178.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.02 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.591 2.356 . . . . 0.0 110.901 177.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.91 54.62 0.17 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.631 -2.988 . . . . 0.0 105.631 168.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 43.4 mtpt -152.55 152.3 31.71 Favored 'General case' 0 C--N 1.363 1.192 0 N-CA-C 105.762 -1.94 . . . . 0.0 105.762 177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.6 t -105.15 144.29 32.16 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.16 2.184 . . . . 0.0 109.417 -165.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -125.28 139.69 53.49 Favored 'General case' 0 C--N 1.357 0.914 0 C-N-CA 126.463 1.905 . . . . 0.0 107.181 173.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.9 m -123.76 118.97 28.39 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.361 1.064 . . . . 0.0 108.319 178.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -117.75 -161.63 0.83 Allowed 'General case' 0 N--CA 1.438 -1.074 0 C-N-CA 126.569 1.948 . . . . 0.0 106.381 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -129.54 94.32 3.74 Favored 'General case' 0 C--N 1.36 1.043 0 N-CA-C 106.02 -1.845 . . . . 0.0 106.02 179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.507 HD22 ' HA3' ' A' ' 26' ' ' GLY . 69.5 m-80 -139.98 92.01 2.51 Favored 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.09 -2.189 . . . . 0.0 105.09 175.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.417 0 CA-C-N 116.031 -0.531 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 95.1 m . . . . . 0 N--CA 1.49 1.527 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt -120.13 122.14 67.63 Favored 'Isoleucine or valine' 0 C--N 1.361 1.099 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.9 pt -103.54 -170.77 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.337 0 C-N-CA 125.601 1.56 . . . . 0.0 109.142 178.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -135.01 78.43 1.73 Allowed 'General case' 0 C--N 1.361 1.07 0 C-N-CA 124.33 1.052 . . . . 0.0 108.555 -175.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.0 t -128.87 127.21 66.04 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.563 -2.754 . . . . 0.0 103.563 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -83.7 133.13 34.82 Favored 'General case' 0 C--N 1.363 1.191 0 C-N-CA 125.613 1.565 . . . . 0.0 110.201 -174.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.4 p -142.12 171.71 13.68 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -165.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -153.28 27.33 0.51 Allowed 'General case' 0 C--N 1.357 0.893 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 169.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 78.3 p -170.53 149.22 2.97 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 -176.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -71.31 -14.25 31.14 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 124.228 3.286 . . . . 0.0 114.822 168.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -87.75 9.43 21.7 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 126.71 2.004 . . . . 0.0 113.464 171.259 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -113.1 19.55 17.08 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.189 2.196 . . . . 0.0 107.614 168.574 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.3 t -142.58 -16.06 0.72 Allowed 'General case' 0 C--N 1.356 0.891 0 C-N-CA 126.36 1.864 . . . . 0.0 109.001 -175.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.8 m -83.83 -0.7 52.2 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 126.333 1.853 . . . . 0.0 111.717 174.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.1 mptp? -83.13 -57.3 0.44 Allowed Pre-proline 0 C--N 1.358 0.959 0 C-N-CA 129.069 2.947 . . . . 0.0 110.885 173.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -69.83 -40.01 5.71 Favored 'Trans proline' 0 C--N 1.367 1.521 0 C-N-CA 124.877 3.718 . . . . 0.0 113.714 174.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -70.07 -31.44 69.05 Favored 'General case' 0 C--N 1.366 1.307 0 C-N-CA 127.805 2.442 . . . . 0.0 114.782 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 mttp -88.07 -5.02 58.69 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 124.78 1.232 . . . . 0.0 113.463 171.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -87.05 -24.92 24.45 Favored 'General case' 0 C--N 1.36 1.039 0 C-N-CA 125.98 1.712 . . . . 0.0 110.655 164.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 42.9 mt -89.78 -63.38 1.29 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.473 2.309 . . . . 0.0 111.913 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.7 m-85 -98.21 -9.05 26.24 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 127.797 2.439 . . . . 0.0 111.893 -167.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.56 -80.12 0.36 Allowed Glycine 0 C--N 1.365 2.176 0 C-N-CA 124.898 1.237 . . . . 0.0 113.407 165.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 24' ' ' SER . 74.8 m -146.31 -15.79 0.44 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.458 1.503 . . . . 0.0 107.006 -176.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.402 ' H ' ' H ' ' A' ' 23' ' ' SER . 17.5 t -102.71 74.3 1.34 Allowed 'General case' 0 C--N 1.365 1.265 0 C-N-CA 126.948 2.099 . . . . 0.0 106.435 178.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -130.27 125.45 34.83 Favored 'General case' 0 C--N 1.36 1.025 0 N-CA-C 106.856 -1.535 . . . . 0.0 106.856 -176.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.99 85.91 0.65 Allowed Glycine 0 C--N 1.362 2.016 0 N-CA-C 107.343 -2.303 . . . . 0.0 107.343 171.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.05 117.74 30.53 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 125.49 1.516 . . . . 0.0 109.964 -170.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.0 mtpt -124.51 144.32 50.18 Favored 'General case' 0 C--N 1.362 1.138 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 -170.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -122.96 113.46 19.11 Favored 'General case' 0 C--N 1.352 0.712 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.2 mmt -126.01 125.85 43.32 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 104.438 -2.43 . . . . 0.0 104.438 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 81.04 -86.25 0.02 OUTLIER 'General case' 0 C--N 1.384 2.068 0 C-N-CA 127.592 2.357 . . . . 0.0 109.158 178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -173.23 54.51 0.16 Allowed Glycine 0 N--CA 1.432 -1.593 0 N-CA-C 104.923 -3.271 . . . . 0.0 104.923 166.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -150.23 152.95 35.39 Favored 'General case' 0 C--N 1.365 1.27 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.9 t -105.05 144.12 32.3 Favored 'General case' 0 C--N 1.358 0.972 0 C-N-CA 126.771 2.029 . . . . 0.0 109.297 -164.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.6 mtmt -124.32 142.31 51.37 Favored 'General case' 0 C--N 1.357 0.929 0 C-N-CA 126.179 1.792 . . . . 0.0 106.774 174.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.8 m -125.97 119.01 26.58 Favored 'General case' 0 C--N 1.358 0.967 0 C-N-CA 124.342 1.057 . . . . 0.0 108.198 179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -120.08 -147.01 0.39 Allowed 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.769 -1.938 . . . . 0.0 105.769 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.7 m120 -135.09 156.77 48.45 Favored 'General case' 0 C--N 1.359 0.98 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 177.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -88.66 124.32 33.97 Favored 'General case' 0 C--N 1.36 1.029 0 N-CA-C 107.149 -1.426 . . . . 0.0 107.149 171.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.367 0 CA-C-N 116.168 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.3 t . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 122.115 0.959 . . . . 0.0 109.877 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.6 mt -124.65 113.69 37.32 Favored 'Isoleucine or valine' 0 C--N 1.36 1.036 0 N-CA-C 102.897 -3.001 . . . . 0.0 102.897 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.0 pt -99.5 -177.33 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.314 0 C-N-CA 125.556 1.543 . . . . 0.0 110.235 -178.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -127.39 74.47 1.52 Allowed 'General case' 0 C--N 1.362 1.146 0 C-N-CA 124.813 1.245 . . . . 0.0 107.957 -174.607 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 20.4 t -126.81 122.6 60.95 Favored 'Isoleucine or valine' 0 C--N 1.362 1.124 0 N-CA-C 103.36 -2.83 . . . . 0.0 103.36 171.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.2 mptt -85.62 136.45 33.37 Favored 'General case' 0 C--N 1.364 1.226 0 C-N-CA 125.771 1.628 . . . . 0.0 109.029 -173.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.3 p -145.61 170.47 16.39 Favored 'General case' 0 C--N 1.356 0.891 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 -160.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.43 22.63 0.72 Allowed 'General case' 0 C--N 1.355 0.841 0 N-CA-C 105.789 -1.93 . . . . 0.0 105.789 174.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.4 p -170.62 148.36 2.71 Favored Pre-proline 0 C--N 1.36 1.054 0 N-CA-C 105.62 -1.993 . . . . 0.0 105.62 -174.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_exo -71.52 -13.36 30.13 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 124.632 3.554 . . . . 0.0 114.291 165.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -75.57 -15.22 60.39 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 128.156 2.582 . . . . 0.0 114.786 170.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -91.85 -9.8 42.05 Favored 'General case' 0 C--N 1.37 1.483 0 C-N-CA 128.052 2.541 . . . . 0.0 110.332 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.7 t -112.64 -12.86 13.35 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.857 2.063 . . . . 0.0 109.456 -174.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 60.2 p -87.96 0.43 55.9 Favored 'General case' 0 C--N 1.366 1.294 0 C-N-CA 125.71 1.604 . . . . 0.0 111.345 175.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 21.0 mtmm -78.96 -58.05 0.73 Allowed Pre-proline 0 C--N 1.36 1.053 0 C-N-CA 128.42 2.688 . . . . 0.0 111.775 169.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -70.98 -41.41 2.74 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 124.945 3.763 . . . . 0.0 113.204 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -69.89 -31.66 69.58 Favored 'General case' 0 C--N 1.367 1.352 0 C-N-CA 127.831 2.452 . . . . 0.0 114.971 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -88.01 -6.64 57.88 Favored 'General case' 0 C--N 1.371 1.515 0 C-N-CA 124.659 1.184 . . . . 0.0 113.304 173.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -89.09 -22.32 22.96 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 126.255 1.822 . . . . 0.0 111.638 165.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.2 mt -91.3 -68.17 0.81 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.287 2.235 . . . . 0.0 110.966 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -93.24 -30.07 15.37 Favored 'General case' 0 C--N 1.36 1.055 0 C-N-CA 128.001 2.52 . . . . 0.0 111.672 -167.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.48 -169.64 14.88 Favored Glycine 0 C--N 1.36 1.883 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 34.2 m -69.23 -4.92 19.73 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 128.496 2.719 . . . . 0.0 116.302 -174.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 16.4 t -109.57 67.1 0.64 Allowed 'General case' 0 C--N 1.363 1.159 0 C-N-CA 126.717 2.007 . . . . 0.0 106.196 167.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.47 140.73 49.04 Favored 'General case' 0 C--N 1.363 1.186 0 C-N-CA 126.055 1.742 . . . . 0.0 106.6 175.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.82 87.11 0.62 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.476 -2.25 . . . . 0.0 107.476 173.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.94 112.59 24.29 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.357 1.463 . . . . 0.0 109.425 -171.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -123.23 139.0 54.5 Favored 'General case' 0 C--N 1.362 1.111 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 -171.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.9 t -119.88 112.45 19.23 Favored 'General case' 0 CA--C 1.509 -0.632 0 N-CA-C 105.533 -2.025 . . . . 0.0 105.533 -178.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -121.97 123.52 41.86 Favored 'General case' 0 C--N 1.358 0.957 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 178.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 37.7 t30 79.23 -84.48 0.02 OUTLIER 'General case' 0 C--N 1.381 1.963 0 C-N-CA 127.285 2.234 . . . . 0.0 110.217 175.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.48 55.35 0.17 Allowed Glycine 0 N--CA 1.432 -1.599 0 N-CA-C 105.495 -3.042 . . . . 0.0 105.495 168.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -154.05 153.95 32.81 Favored 'General case' 0 C--N 1.363 1.175 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -105.03 148.47 26.72 Favored 'General case' 0 C--N 1.359 0.983 0 C-N-CA 127.23 2.212 . . . . 0.0 109.454 -165.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -128.15 142.66 51.12 Favored 'General case' 0 CA--C 1.501 -0.921 0 C-N-CA 126.238 1.815 . . . . 0.0 106.89 174.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 54.8 m -123.67 123.72 41.17 Favored 'General case' 0 C--N 1.36 1.028 0 N-CA-C 108.058 -1.09 . . . . 0.0 108.058 177.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -123.35 -154.5 0.61 Allowed 'General case' 0 N--CA 1.437 -1.12 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -130.55 22.53 5.1 Favored 'General case' 0 C--N 1.36 1.057 0 C-N-CA 125.042 1.337 . . . . 0.0 108.89 -175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -94.97 76.82 3.56 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.84 1.256 . . . . 0.0 109.629 -176.238 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.391 0 CA-C-N 116.227 -0.442 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 122.112 0.958 . . . . 0.0 109.815 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.4 mt -123.73 114.86 43.29 Favored 'Isoleucine or valine' 0 C--N 1.36 1.062 0 N-CA-C 102.995 -2.965 . . . . 0.0 102.995 174.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.1 pt -99.8 -178.93 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.287 0 C-N-CA 125.576 1.55 . . . . 0.0 109.858 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -127.21 75.66 1.6 Allowed 'General case' 0 C--N 1.363 1.183 0 C-N-CA 124.541 1.137 . . . . 0.0 107.935 -174.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.413 HG11 ' HG3' ' A' ' 16' ' ' PRO . 15.6 t -129.38 129.22 67.08 Favored 'Isoleucine or valine' 0 C--N 1.36 1.055 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 172.805 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -82.59 140.88 32.98 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 125.914 1.686 . . . . 0.0 109.613 -175.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.9 p -147.67 167.35 24.83 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 -167.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -148.83 22.12 1.0 Allowed 'General case' 0 C--N 1.355 0.81 0 N-CA-C 105.495 -2.039 . . . . 0.0 105.495 171.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 89.0 p -169.01 150.73 4.53 Favored Pre-proline 0 C--N 1.361 1.067 0 N-CA-C 105.304 -2.109 . . . . 0.0 105.304 -175.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -71.62 -16.32 30.31 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 124.114 3.21 . . . . 0.0 114.815 169.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.51 -4.82 57.02 Favored 'General case' 0 C--N 1.369 1.437 0 C-N-CA 127.009 2.123 . . . . 0.0 114.569 171.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -99.14 3.01 46.42 Favored 'General case' 0 C--N 1.372 1.559 0 C-N-CA 127.161 2.184 . . . . 0.0 109.648 171.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.4 t -122.99 -14.04 7.68 Favored 'General case' 0 C--N 1.36 1.054 0 C-N-CA 127.465 2.306 . . . . 0.0 108.007 -179.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 m -85.66 0.66 52.06 Favored 'General case' 0 C--N 1.371 1.541 0 C-N-CA 126.195 1.798 . . . . 0.0 110.81 173.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.45 -57.21 0.55 Allowed Pre-proline 0 N--CA 1.44 -0.965 0 C-N-CA 129.297 3.039 . . . . 0.0 110.92 172.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.413 ' HG3' HG11 ' A' ' 5' ' ' VAL . 62.2 Cg_endo -70.05 -42.04 3.43 Favored 'Trans proline' 0 C--N 1.366 1.47 0 C-N-CA 124.867 3.711 . . . . 0.0 113.919 171.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.6 m -70.3 -28.98 65.61 Favored 'General case' 0 C--N 1.369 1.416 0 C-N-CA 127.293 2.237 . . . . 0.0 114.941 -175.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.3 mtmt -88.09 -11.08 48.12 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.589 1.156 . . . . 0.0 113.026 171.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -84.78 -20.37 31.13 Favored 'General case' 0 C--N 1.362 1.136 0 C-N-CA 125.527 1.531 . . . . 0.0 111.872 166.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.5 mt -93.42 -67.01 0.88 Allowed 'General case' 0 C--N 1.365 1.275 0 C-N-CA 127.626 2.37 . . . . 0.0 111.03 178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -96.78 -6.61 35.75 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 127.866 2.466 . . . . 0.0 112.518 -166.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.22 -78.73 0.52 Allowed Glycine 0 C--N 1.366 2.203 0 C-N-CA 125.074 1.321 . . . . 0.0 113.672 164.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.405 ' H ' ' H ' ' A' ' 24' ' ' SER . 10.1 t -153.2 -7.96 0.17 Allowed 'General case' 0 C--N 1.354 0.776 0 N-CA-C 106.528 -1.656 . . . . 0.0 106.528 -174.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.405 ' H ' ' H ' ' A' ' 23' ' ' SER . 20.5 t -106.21 68.71 0.77 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.001 2.12 . . . . 0.0 105.66 174.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.86 128.88 48.32 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.013 1.725 . . . . 0.0 106.892 -174.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.46 87.53 0.54 Allowed Glycine 0 C--N 1.362 2.005 0 N-CA-C 106.965 -2.454 . . . . 0.0 106.965 170.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.42 113.45 25.11 Favored 'General case' 0 C--N 1.357 0.916 0 C-N-CA 125.235 1.414 . . . . 0.0 109.704 -171.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -124.03 140.36 53.04 Favored 'General case' 0 C--N 1.36 1.054 0 N-CA-C 106.423 -1.695 . . . . 0.0 106.423 -171.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 45.3 t -121.24 113.62 20.21 Favored 'General case' 0 CA--C 1.508 -0.651 0 N-CA-C 105.746 -1.946 . . . . 0.0 105.746 -176.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.6 mmm -124.23 123.62 40.66 Favored 'General case' 0 C--N 1.359 1.003 0 N-CA-C 104.693 -2.336 . . . . 0.0 104.693 178.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 79.23 -85.73 0.02 OUTLIER 'General case' 0 C--N 1.382 1.993 0 C-N-CA 127.463 2.305 . . . . 0.0 110.266 175.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -170.76 54.12 0.19 Allowed Glycine 0 N--CA 1.433 -1.522 0 N-CA-C 105.453 -3.059 . . . . 0.0 105.453 169.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 79.7 mttt -154.02 154.35 33.57 Favored 'General case' 0 C--N 1.364 1.205 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 176.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.2 t -106.1 147.15 29.28 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.368 2.267 . . . . 0.0 109.407 -164.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.1 mtmt -126.81 141.06 51.93 Favored 'General case' 0 CA--C 1.501 -0.916 0 C-N-CA 126.165 1.786 . . . . 0.0 106.794 173.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.4 m -123.56 124.42 42.77 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 108.015 -1.106 . . . . 0.0 108.015 177.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.7 m-85 -123.83 -159.38 0.86 Allowed 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 105.623 -1.991 . . . . 0.0 105.623 -179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -131.99 86.91 2.38 Favored 'General case' 0 C--N 1.359 1.011 0 N-CA-C 106.449 -1.685 . . . . 0.0 106.449 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -113.61 98.72 7.23 Favored 'General case' 0 C--N 1.358 0.936 0 N-CA-C 105.269 -2.123 . . . . 0.0 105.269 173.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.362 0 CA-C-N 116.245 -0.434 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 40.0 p . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 108.59 -0.892 . . . . 0.0 108.59 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.434 HG23 ' HG2' ' A' ' 35' ' ' LYS . 88.1 mt -104.88 121.65 57.04 Favored 'Isoleucine or valine' 0 C--N 1.364 1.197 0 N-CA-C 106.154 -1.795 . . . . 0.0 106.154 -170.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.1 pt -105.38 -177.56 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.117 0 C-N-CA 125.938 1.695 . . . . 0.0 109.933 -172.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -127.26 75.93 1.62 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 124.918 1.287 . . . . 0.0 107.686 -174.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 t -126.76 125.66 67.28 Favored 'Isoleucine or valine' 0 C--N 1.362 1.126 0 N-CA-C 103.909 -2.626 . . . . 0.0 103.909 173.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -80.58 133.13 35.73 Favored 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.13 1.772 . . . . 0.0 110.067 -177.143 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.7 p -141.0 169.94 16.66 Favored 'General case' 0 C--N 1.357 0.934 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -166.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.49 22.07 0.72 Allowed 'General case' 0 C--N 1.355 0.822 0 N-CA-C 105.918 -1.882 . . . . 0.0 105.918 174.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 68.1 p -170.06 149.51 3.37 Favored Pre-proline 0 C--N 1.36 1.044 0 N-CA-C 105.344 -2.095 . . . . 0.0 105.344 -175.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -71.64 -16.64 30.16 Favored 'Trans proline' 0 C--N 1.356 0.962 0 C-N-CA 124.317 3.345 . . . . 0.0 114.601 168.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -82.27 -3.43 55.19 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.931 2.093 . . . . 0.0 114.628 171.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -94.23 -5.81 46.05 Favored 'General case' 0 C--N 1.37 1.499 0 C-N-CA 127.319 2.248 . . . . 0.0 109.827 169.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.0 t -116.35 -13.05 11.03 Favored 'General case' 0 C--N 1.36 1.065 0 C-N-CA 126.921 2.089 . . . . 0.0 108.795 -177.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -86.25 -2.38 58.33 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 126.655 1.982 . . . . 0.0 110.604 172.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -79.15 -57.97 0.72 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.099 2.959 . . . . 0.0 111.389 171.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -71.18 -45.01 0.96 Allowed 'Trans proline' 0 C--N 1.363 1.323 0 C-N-CA 124.984 3.789 . . . . 0.0 113.577 174.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.2 m -69.43 -28.93 66.55 Favored 'General case' 0 C--N 1.369 1.427 0 C-N-CA 127.296 2.238 . . . . 0.0 115.048 -177.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -88.05 -9.3 53.79 Favored 'General case' 0 C--N 1.371 1.523 0 CA-C-N 120.328 1.422 . . . . 0.0 113.73 170.528 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -86.04 -23.28 26.84 Favored 'General case' 0 C--N 1.362 1.126 0 C-N-CA 125.651 1.58 . . . . 0.0 111.319 167.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 53.8 mt -87.99 -61.16 1.78 Allowed 'General case' 0 C--N 1.366 1.299 0 C-N-CA 127.785 2.434 . . . . 0.0 111.389 176.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 -107.34 1.71 23.94 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.664 1.986 . . . . 0.0 112.323 -162.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.84 -82.79 0.75 Allowed Glycine 0 C--N 1.365 2.163 0 C-N-CA 125.163 1.363 . . . . 0.0 113.711 165.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.5 m -148.2 -6.75 0.42 Allowed 'General case' 0 C--N 1.355 0.81 0 C-N-CA 125.909 1.684 . . . . 0.0 106.797 -178.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 23' ' ' SER . 22.0 t -102.65 77.89 1.65 Allowed 'General case' 0 C--N 1.365 1.281 0 C-N-CA 127.392 2.277 . . . . 0.0 106.316 179.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -145.36 125.9 14.12 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 106.295 -1.743 . . . . 0.0 106.295 -173.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.21 87.35 0.66 Allowed Glycine 0 C--N 1.366 2.208 0 N-CA-C 107.535 -2.226 . . . . 0.0 107.535 171.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.1 113.18 25.36 Favored 'General case' 0 C--N 1.356 0.86 0 C-N-CA 125.171 1.388 . . . . 0.0 110.71 -168.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -117.91 145.62 44.52 Favored 'General case' 0 C--N 1.363 1.177 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 -173.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -125.09 112.95 17.11 Favored 'General case' 0 CA--C 1.507 -0.68 0 N-CA-C 105.469 -2.048 . . . . 0.0 105.469 178.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.4 mmt -123.85 123.91 41.49 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 104.4 -2.445 . . . . 0.0 104.4 178.097 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.0 m120 77.65 -84.03 0.03 OUTLIER 'General case' 0 C--N 1.383 2.027 0 C-N-CA 127.617 2.367 . . . . 0.0 111.09 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.64 55.44 0.16 Allowed Glycine 0 N--CA 1.433 -1.505 0 N-CA-C 105.623 -2.991 . . . . 0.0 105.623 169.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -152.51 153.02 32.62 Favored 'General case' 0 C--N 1.364 1.197 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 174.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.0 t -104.99 142.98 33.82 Favored 'General case' 0 C--N 1.357 0.899 0 C-N-CA 127.347 2.259 . . . . 0.0 109.238 -165.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.434 ' HG2' HG23 ' A' ' 2' ' ' ILE . 57.3 mtmt -125.63 145.53 50.11 Favored 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 126.031 1.732 . . . . 0.0 108.107 174.466 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 16.6 m -117.43 135.44 53.89 Favored 'General case' 0 C--N 1.36 1.049 0 N-CA-C 105.14 -2.17 . . . . 0.0 105.14 170.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -117.44 -27.22 6.43 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 124.801 1.24 . . . . 0.0 109.097 -174.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 81.52 39.28 0.06 Allowed 'General case' 0 C--N 1.365 1.272 0 C-N-CA 128.376 2.67 . . . . 0.0 111.676 173.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -85.02 -79.99 0.22 Allowed 'General case' 0 C--N 1.357 0.929 0 C-N-CA 125.738 1.615 . . . . 0.0 110.011 -174.63 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.335 0 O-C-N 123.025 0.203 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 38.6 p . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 44.8 mt -125.44 129.29 72.94 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 N-CA-C 104.318 -2.475 . . . . 0.0 104.318 -177.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 43.3 pt -106.68 -172.58 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.249 0 C-N-CA 125.385 1.474 . . . . 0.0 108.949 176.01 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -133.33 85.74 2.24 Favored 'General case' 0 C--N 1.361 1.085 0 N-CA-C 107.343 -1.355 . . . . 0.0 107.343 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.0 t -131.42 129.45 62.15 Favored 'Isoleucine or valine' 0 C--N 1.361 1.096 0 N-CA-C 103.473 -2.788 . . . . 0.0 103.473 171.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -79.29 135.38 36.73 Favored 'General case' 0 C--N 1.366 1.283 0 C-N-CA 126.283 1.833 . . . . 0.0 110.187 -178.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.6 p -144.72 173.06 12.17 Favored 'General case' 0 C--N 1.356 0.871 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 -168.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.01 27.34 0.42 Allowed 'General case' 0 C--N 1.355 0.844 0 N-CA-C 105.234 -2.136 . . . . 0.0 105.234 169.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.3 p -171.32 148.54 2.38 Favored Pre-proline 0 C--N 1.361 1.075 0 N-CA-C 105.1 -2.185 . . . . 0.0 105.1 -176.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_exo -70.7 -17.46 33.28 Favored 'Trans proline' 0 C--N 1.356 0.943 0 C-N-CA 124.286 3.324 . . . . 0.0 114.857 169.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -79.63 -8.77 59.41 Favored 'General case' 0 C--N 1.368 1.392 0 C-N-CA 127.556 2.342 . . . . 0.0 114.204 172.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -93.96 -1.84 54.03 Favored 'General case' 0 C--N 1.37 1.492 0 C-N-CA 126.954 2.102 . . . . 0.0 110.193 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.8 t -118.51 -12.97 9.74 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 127.157 2.183 . . . . 0.0 108.209 -179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.3 m -83.47 -1.94 54.75 Favored 'General case' 0 C--N 1.37 1.462 0 C-N-CA 125.987 1.715 . . . . 0.0 112.099 174.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -80.99 -56.96 0.6 Allowed Pre-proline 0 C--N 1.361 1.067 0 C-N-CA 128.304 2.642 . . . . 0.0 111.358 171.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -70.26 -40.81 4.16 Favored 'Trans proline' 0 C--N 1.366 1.456 0 C-N-CA 124.78 3.653 . . . . 0.0 113.59 175.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.7 m -69.19 -31.87 70.78 Favored 'General case' 0 C--N 1.368 1.391 0 C-N-CA 127.787 2.435 . . . . 0.0 114.888 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 61.6 mttp -88.07 -6.01 58.16 Favored 'General case' 0 C--N 1.369 1.436 0 C-N-CA 124.852 1.261 . . . . 0.0 113.267 172.633 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -88.59 -20.31 25.16 Favored 'General case' 0 C--N 1.36 1.053 0 C-N-CA 125.906 1.682 . . . . 0.0 111.243 165.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.7 mt -93.1 -67.09 0.88 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.571 2.348 . . . . 0.0 111.119 178.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -95.56 -10.07 30.58 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 128.163 2.585 . . . . 0.0 112.121 -167.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.62 -79.55 0.39 Allowed Glycine 0 C--N 1.365 2.139 0 C-N-CA 125.01 1.29 . . . . 0.0 113.404 165.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.69 -13.38 0.44 Allowed 'General case' 0 C--N 1.355 0.843 0 C-N-CA 125.65 1.58 . . . . 0.0 107.071 -175.048 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.4 t -104.43 70.18 0.94 Allowed 'General case' 0 C--N 1.366 1.321 0 C-N-CA 126.862 2.065 . . . . 0.0 106.1 177.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.45 126.25 43.47 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.738 1.615 . . . . 0.0 106.826 -175.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.25 86.54 0.57 Allowed Glycine 0 C--N 1.361 1.95 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 171.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.36 114.73 26.83 Favored 'General case' 0 C--N 1.357 0.934 0 C-N-CA 125.185 1.394 . . . . 0.0 109.822 -171.336 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 49.3 mmtm -121.34 145.54 47.78 Favored 'General case' 0 C--N 1.361 1.092 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 -173.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.1 t -127.93 112.08 14.29 Favored 'General case' 0 C--N 1.353 0.719 0 N-CA-C 105.996 -1.853 . . . . 0.0 105.996 -179.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 65.9 mtt -131.92 130.85 42.11 Favored 'General case' 0 C--N 1.359 1.009 0 N-CA-C 103.571 -2.751 . . . . 0.0 103.571 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 66.9 m-20 79.36 -14.36 0.87 Allowed 'General case' 0 C--N 1.384 2.072 0 C-N-CA 126.869 2.068 . . . . 0.0 114.516 172.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 95.22 41.18 4.06 Favored Glycine 0 C--N 1.361 1.952 0 C-N-CA 127.36 2.41 . . . . 0.0 110.451 -171.101 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.7 mptt -148.54 151.33 34.92 Favored 'General case' 0 C--N 1.365 1.246 0 N-CA-C 104.626 -2.361 . . . . 0.0 104.626 177.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 48.5 t -104.94 140.09 38.69 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 126.583 1.953 . . . . 0.0 109.462 -163.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -121.76 140.53 52.23 Favored 'General case' 0 CA--C 1.499 -1.004 0 C-N-CA 126.128 1.771 . . . . 0.0 107.066 173.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.2 m -125.72 113.2 17.01 Favored 'General case' 0 C--N 1.358 0.964 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -112.87 -155.86 0.58 Allowed 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 127.243 2.217 . . . . 0.0 106.767 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -133.76 103.55 5.92 Favored 'General case' 0 C--N 1.359 1.006 0 N-CA-C 106.078 -1.823 . . . . 0.0 106.078 179.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.5 m120 -142.47 100.15 3.63 Favored 'General case' 0 C--N 1.355 0.835 0 N-CA-C 104.759 -2.311 . . . . 0.0 104.759 174.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.401 0 CA-C-N 116.155 -0.475 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 92.4 m . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp -123.86 120.54 59.96 Favored 'Isoleucine or valine' 0 C--N 1.36 1.061 0 N-CA-C 103.9 -2.63 . . . . 0.0 103.9 178.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 42.3 pt -102.52 -179.73 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.318 0 C-N-CA 125.715 1.606 . . . . 0.0 110.013 -178.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -123.77 71.9 1.12 Allowed 'General case' 0 C--N 1.363 1.157 0 C-N-CA 125.075 1.35 . . . . 0.0 108.323 -173.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.469 HG11 ' HG3' ' A' ' 16' ' ' PRO . 14.1 t -128.94 131.18 68.44 Favored 'Isoleucine or valine' 0 C--N 1.362 1.111 0 N-CA-C 103.564 -2.754 . . . . 0.0 103.564 173.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -85.73 140.18 30.71 Favored 'General case' 0 C--N 1.365 1.249 0 C-N-CA 125.868 1.667 . . . . 0.0 109.308 -173.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 23.6 p -146.3 168.56 20.78 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -168.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -153.38 26.02 0.52 Allowed 'General case' 0 C--N 1.355 0.848 0 N-CA-C 105.691 -1.966 . . . . 0.0 105.691 167.388 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 84.4 p -167.46 148.22 4.88 Favored Pre-proline 0 C--N 1.361 1.068 0 N-CA-C 105.19 -2.152 . . . . 0.0 105.19 -178.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -72.59 -14.74 27.52 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 123.966 3.111 . . . . 0.0 114.844 171.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -76.88 -15.97 59.54 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 127.234 2.214 . . . . 0.0 114.28 169.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -88.65 -3.76 58.71 Favored 'General case' 0 C--N 1.372 1.544 0 C-N-CA 127.262 2.225 . . . . 0.0 110.636 173.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.2 t -117.41 -13.84 10.36 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 127.556 2.342 . . . . 0.0 108.433 -179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.7 m -85.99 -1.85 57.73 Favored 'General case' 0 C--N 1.373 1.592 0 C-N-CA 126.184 1.793 . . . . 0.0 111.075 174.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 54.0 mttp -77.4 -59.01 0.9 Allowed Pre-proline 0 C--N 1.357 0.895 0 C-N-CA 129.006 2.923 . . . . 0.0 111.813 170.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.469 ' HG3' HG11 ' A' ' 5' ' ' VAL . 71.1 Cg_endo -71.32 -41.04 2.7 Favored 'Trans proline' 0 C--N 1.362 1.277 0 C-N-CA 124.961 3.774 . . . . 0.0 113.676 174.892 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.47 -29.31 65.83 Favored 'General case' 0 C--N 1.367 1.344 0 C-N-CA 127.509 2.324 . . . . 0.0 114.566 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -88.06 -9.91 51.89 Favored 'General case' 0 C--N 1.371 1.524 0 C-N-CA 124.732 1.213 . . . . 0.0 113.103 171.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -85.5 -20.08 30.22 Favored 'General case' 0 C--N 1.362 1.139 0 C-N-CA 125.613 1.565 . . . . 0.0 111.706 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 45.1 mt -93.81 -66.53 0.91 Allowed 'General case' 0 C--N 1.365 1.264 0 C-N-CA 127.681 2.393 . . . . 0.0 111.092 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -96.12 -7.63 35.44 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.875 2.47 . . . . 0.0 112.346 -167.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.14 -78.91 0.4 Allowed Glycine 0 C--N 1.364 2.125 0 C-N-CA 124.982 1.277 . . . . 0.0 113.445 165.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.7 t -153.06 -8.43 0.17 Allowed 'General case' 0 C--N 1.354 0.775 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.4 t -106.3 68.78 0.77 Allowed 'General case' 0 C--N 1.365 1.272 0 C-N-CA 126.947 2.099 . . . . 0.0 105.649 175.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.57 126.57 45.01 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 125.956 1.702 . . . . 0.0 106.725 -174.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.432 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -102.29 86.32 0.56 Allowed Glycine 0 C--N 1.361 1.962 0 N-CA-C 107.326 -2.31 . . . . 0.0 107.326 171.015 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.07 113.09 24.99 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 125.356 1.462 . . . . 0.0 109.534 -172.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -121.61 137.7 54.63 Favored 'General case' 0 C--N 1.36 1.032 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 -171.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.5 t -115.0 126.62 54.97 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 106.711 -1.589 . . . . 0.0 106.711 -177.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 95.9 mmm -110.42 69.14 0.68 Allowed 'General case' 0 C--N 1.359 1.02 0 N-CA-C 104.349 -2.463 . . . . 0.0 104.349 172.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -2.9 71.32 0.0 OUTLIER 'General case' 0 C--N 1.38 1.927 1 C-N-CA 134.678 5.191 . . . . 0.0 118.433 -172.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 156.48 -39.38 0.58 Allowed Glycine 0 C--N 1.354 1.545 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -164.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.8 mttp -154.06 158.27 40.26 Favored 'General case' 0 C--N 1.37 1.474 0 CA-C-N 119.443 1.622 . . . . 0.0 108.666 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -107.46 153.81 22.27 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 128.661 2.784 . . . . 0.0 109.688 -166.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -131.46 142.77 50.06 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 127.04 2.136 . . . . 0.0 106.896 175.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.1 m -125.6 122.58 36.87 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.301 1.04 . . . . 0.0 108.748 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -122.17 -160.72 0.89 Allowed 'General case' 0 N--CA 1.437 -1.082 0 C-N-CA 126.443 1.897 . . . . 0.0 105.911 179.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 53.8 m-80 -131.63 89.39 2.7 Favored 'General case' 0 C--N 1.36 1.038 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.432 HD22 ' HA3' ' A' ' 26' ' ' GLY . 73.1 m-80 -135.32 86.58 2.26 Favored 'General case' 0 C--N 1.356 0.855 0 N-CA-C 105.192 -2.151 . . . . 0.0 105.192 175.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.438 0 CA-C-N 115.93 -0.577 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 63.3 m . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 107.703 -1.221 . . . . 0.0 107.703 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.408 HG23 ' HG2' ' A' ' 35' ' ' LYS . 72.1 mt -104.94 121.14 56.51 Favored 'Isoleucine or valine' 0 C--N 1.365 1.266 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 -171.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.8 pt -103.72 -176.55 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.125 0 C-N-CA 125.597 1.559 . . . . 0.0 110.354 -173.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.3 t30 -127.41 79.86 1.92 Allowed 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -128.37 123.07 59.2 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.038 0 N-CA-C 103.085 -2.931 . . . . 0.0 103.085 170.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -81.82 130.28 35.01 Favored 'General case' 0 C--N 1.366 1.285 0 C-N-CA 125.954 1.702 . . . . 0.0 109.651 -175.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.1 p -139.01 171.48 14.26 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -164.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -151.87 22.85 0.68 Allowed 'General case' 0 C--N 1.355 0.847 0 N-CA-C 105.737 -1.949 . . . . 0.0 105.737 174.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.4 p -171.52 148.01 2.2 Favored Pre-proline 0 C--N 1.36 1.043 0 N-CA-C 105.526 -2.028 . . . . 0.0 105.526 -174.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_exo -71.56 -13.63 30.15 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 124.632 3.554 . . . . 0.0 114.173 165.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -75.28 -16.15 60.46 Favored 'General case' 0 C--N 1.369 1.447 0 C-N-CA 128.35 2.66 . . . . 0.0 114.76 171.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -89.8 -12.05 40.35 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 128.225 2.61 . . . . 0.0 110.441 174.396 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.8 t -111.82 -12.92 13.75 Favored 'General case' 0 C--N 1.36 1.031 0 C-N-CA 126.797 2.039 . . . . 0.0 109.636 -173.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 64.2 p -88.04 -1.22 57.86 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 125.613 1.565 . . . . 0.0 111.61 175.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 mtmm -78.03 -58.49 0.85 Allowed Pre-proline 0 C--N 1.36 1.03 0 C-N-CA 128.586 2.754 . . . . 0.0 111.668 169.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -69.9 -43.92 2.27 Favored 'Trans proline' 0 C--N 1.365 1.438 0 C-N-CA 124.98 3.787 . . . . 0.0 113.198 177.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 66.0 m -67.58 -33.58 75.3 Favored 'General case' 0 C--N 1.366 1.314 0 C-N-CA 128.26 2.624 . . . . 0.0 115.411 -178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -88.06 -5.04 58.69 Favored 'General case' 0 C--N 1.37 1.465 0 CA-C-N 119.628 1.103 . . . . 0.0 113.337 173.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -88.97 -23.44 22.65 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 125.97 1.708 . . . . 0.0 111.628 164.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.6 mt -90.77 -64.14 1.17 Allowed 'General case' 0 C--N 1.366 1.308 0 C-N-CA 127.41 2.284 . . . . 0.0 111.611 -179.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.0 m-85 -90.05 -32.82 16.56 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 128.154 2.581 . . . . 0.0 110.797 -168.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 91.66 92.6 1.37 Allowed Glycine 0 C--N 1.364 2.116 0 C-N-CA 124.966 1.27 . . . . 0.0 114.299 163.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . 0.259 20.1 m 83.57 -53.01 0.15 Allowed 'General case' 0 C--N 1.367 1.348 0 C-N-CA 128.439 2.696 . . . . 0.0 114.554 169.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.1 t -109.31 71.74 0.78 Allowed 'General case' 0 C--N 1.362 1.119 0 C-N-CA 126.652 1.981 . . . . 0.0 107.103 -177.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.96 146.84 34.55 Favored 'General case' 0 C--N 1.364 1.196 0 C-N-CA 125.559 1.544 . . . . 0.0 107.572 176.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.5 89.44 0.78 Allowed Glycine 0 C--N 1.359 1.854 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 175.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.46 115.94 28.12 Favored 'General case' 0 C--N 1.355 0.827 0 C-N-CA 125.283 1.433 . . . . 0.0 109.438 -172.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.6 mtpt -122.81 140.29 53.09 Favored 'General case' 0 C--N 1.362 1.147 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.1 t -119.44 110.45 16.94 Favored 'General case' 0 C--N 1.351 0.648 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 -179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.3 mmm -120.05 122.91 42.14 Favored 'General case' 0 C--N 1.358 0.949 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 178.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.9 m120 77.44 -84.58 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.635 2.374 . . . . 0.0 111.195 176.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.15 55.27 0.18 Allowed Glycine 0 N--CA 1.433 -1.539 0 N-CA-C 105.38 -3.088 . . . . 0.0 105.38 169.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.1 mtmt -153.67 152.2 30.55 Favored 'General case' 0 C--N 1.364 1.203 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 176.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.2 t -105.22 143.15 33.8 Favored 'General case' 0 C--N 1.356 0.89 0 C-N-CA 127.119 2.167 . . . . 0.0 109.214 -166.021 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.408 ' HG2' HG23 ' A' ' 2' ' ' ILE . 54.0 mtmt -122.06 148.15 45.22 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 126.045 1.738 . . . . 0.0 107.232 172.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 49.4 m -126.02 133.69 51.67 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 176.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -132.89 -160.13 1.02 Allowed 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 104.561 -2.385 . . . . 0.0 104.561 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -135.12 62.06 1.65 Allowed 'General case' 0 C--N 1.36 1.062 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 178.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -102.17 121.01 41.4 Favored 'General case' 0 C--N 1.358 0.954 0 N-CA-C 106.847 -1.538 . . . . 0.0 106.847 178.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.337 0 CA-C-N 116.194 -0.457 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 44.8 p . . . . . 0 N--CA 1.489 1.494 0 N-CA-C 110.711 -0.107 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 35.9 mt -130.0 126.33 61.9 Favored 'Isoleucine or valine' 0 C--N 1.364 1.224 0 N-CA-C 104.398 -2.445 . . . . 0.0 104.398 -177.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.9 pt -111.53 -171.65 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.34 0 C-N-CA 125.631 1.572 . . . . 0.0 108.305 174.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -131.45 82.01 2.01 Favored 'General case' 0 C--N 1.364 1.22 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 -178.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.448 HG11 ' HG3' ' A' ' 16' ' ' PRO . 9.0 t -132.89 130.0 58.37 Favored 'Isoleucine or valine' 0 C--N 1.361 1.092 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 171.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -81.68 135.05 35.53 Favored 'General case' 0 C--N 1.366 1.297 0 C-N-CA 125.866 1.666 . . . . 0.0 110.357 -177.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 29.2 p -143.72 171.8 13.7 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 -168.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -153.72 27.28 0.49 Allowed 'General case' 0 C--N 1.356 0.861 0 N-CA-C 105.307 -2.109 . . . . 0.0 105.307 169.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 76.1 p -170.71 149.16 2.84 Favored Pre-proline 0 C--N 1.36 1.04 0 N-CA-C 105.189 -2.152 . . . . 0.0 105.189 -176.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_exo -71.69 -13.1 29.58 Favored 'Trans proline' 0 C--N 1.357 0.999 0 C-N-CA 124.46 3.44 . . . . 0.0 114.081 167.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.05 -13.72 59.92 Favored 'General case' 0 C--N 1.371 1.501 0 C-N-CA 128.793 2.837 . . . . 0.0 113.915 172.001 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -98.17 0.71 46.42 Favored 'General case' 0 C--N 1.37 1.476 0 C-N-CA 127.719 2.408 . . . . 0.0 109.913 176.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.5 t -122.51 -17.5 6.97 Favored 'General case' 0 C--N 1.359 0.985 0 C-N-CA 126.504 1.922 . . . . 0.0 108.669 -175.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 58.2 p -87.04 1.58 52.41 Favored 'General case' 0 C--N 1.369 1.416 0 O-C-N 120.155 -1.591 . . . . 0.0 111.095 176.426 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.6 mmtp -81.86 -56.81 0.54 Allowed Pre-proline 0 N--CA 1.438 -1.04 0 C-N-CA 129.67 3.188 . . . . 0.0 110.942 170.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.448 ' HG3' HG11 ' A' ' 5' ' ' VAL . 55.6 Cg_endo -67.35 -46.8 2.59 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 124.863 3.709 . . . . 0.0 113.646 171.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -62.87 -37.79 88.28 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.984 2.514 . . . . 0.0 115.517 -176.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 95.4 mttt -88.1 -3.25 58.91 Favored 'General case' 0 C--N 1.368 1.4 0 C-N-CA 125.012 1.325 . . . . 0.0 113.447 175.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -89.02 -25.85 21.76 Favored 'General case' 0 C--N 1.362 1.109 0 C-N-CA 125.401 1.48 . . . . 0.0 111.911 162.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.5 mt -94.58 -61.85 1.43 Allowed 'General case' 0 C--N 1.367 1.332 0 C-N-CA 127.044 2.137 . . . . 0.0 112.844 -173.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -91.41 -33.59 15.19 Favored 'General case' 0 C--N 1.367 1.328 0 C-N-CA 127.092 2.157 . . . . 0.0 112.416 -161.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 173.88 -113.39 0.46 Allowed Glycine 0 C--N 1.356 1.661 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 176.542 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -148.52 -10.5 0.36 Allowed 'General case' 0 C--N 1.356 0.877 0 C-N-CA 126.258 1.823 . . . . 0.0 106.51 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.5 t -128.54 73.87 1.52 Allowed 'General case' 0 C--N 1.362 1.116 0 N-CA-C 104.797 -2.298 . . . . 0.0 104.797 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -101.88 153.37 19.91 Favored 'General case' 0 C--N 1.365 1.246 0 C-N-CA 125.908 1.683 . . . . 0.0 108.687 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.55 87.35 0.94 Allowed Glycine 0 C--N 1.364 2.124 0 N-CA-C 109.033 -1.627 . . . . 0.0 109.033 175.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.75 115.82 28.09 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 125.239 1.416 . . . . 0.0 109.459 -171.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -124.91 140.6 52.77 Favored 'General case' 0 C--N 1.36 1.058 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 -172.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.3 t -121.33 114.7 21.71 Favored 'General case' 0 C--N 1.351 0.644 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 -178.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -124.94 124.14 41.4 Favored 'General case' 0 C--N 1.358 0.966 0 N-CA-C 104.671 -2.344 . . . . 0.0 104.671 178.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 33.1 m120 78.41 -84.46 0.02 OUTLIER 'General case' 0 C--N 1.382 2.007 0 C-N-CA 127.592 2.357 . . . . 0.0 110.916 176.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.6 54.34 0.18 Allowed Glycine 0 N--CA 1.433 -1.511 0 N-CA-C 105.48 -3.048 . . . . 0.0 105.48 168.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 31.8 mtmm -153.99 151.74 29.73 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 105.631 -1.989 . . . . 0.0 105.631 177.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.5 t -104.96 145.92 29.76 Favored 'General case' 0 C--N 1.357 0.9 0 C-N-CA 127.44 2.296 . . . . 0.0 109.067 -164.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -125.77 138.86 53.87 Favored 'General case' 0 CA--C 1.499 -1.003 0 C-N-CA 126.34 1.856 . . . . 0.0 106.441 174.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 66.5 m -125.5 116.11 21.28 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.286 1.034 . . . . 0.0 108.717 179.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -116.16 -167.92 1.35 Allowed 'General case' 0 N--CA 1.436 -1.127 0 C-N-CA 127.197 2.199 . . . . 0.0 106.536 179.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -126.97 78.1 1.78 Allowed 'General case' 0 C--N 1.36 1.037 0 N-CA-C 106.293 -1.743 . . . . 0.0 106.293 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.7 m120 -117.85 -97.33 0.46 Allowed 'General case' 0 C--N 1.357 0.934 0 N-CA-C 106.204 -1.776 . . . . 0.0 106.204 176.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.39 0 CA-C-N 117.822 0.283 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.9 mt -127.84 120.9 55.19 Favored 'Isoleucine or valine' 0 C--N 1.365 1.28 0 N-CA-C 103.106 -2.924 . . . . 0.0 103.106 177.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 48.0 pt -105.8 -175.11 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.269 0 C-N-CA 125.307 1.443 . . . . 0.0 109.445 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 72.2 m-80 -129.63 78.42 1.85 Allowed 'General case' 0 C--N 1.362 1.114 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -176.091 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.66 127.62 66.9 Favored 'Isoleucine or valine' 0 C--N 1.362 1.128 0 N-CA-C 103.772 -2.677 . . . . 0.0 103.772 172.557 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -80.35 132.84 35.85 Favored 'General case' 0 C--N 1.366 1.318 0 C-N-CA 126.218 1.807 . . . . 0.0 110.409 -176.116 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.8 p -142.85 173.13 11.82 Favored 'General case' 0 CA--C 1.494 -1.208 0 CA-C-O 123.219 1.485 . . . . 0.0 109.009 -165.938 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 96.3 m -142.05 -52.73 0.42 Allowed 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 102.625 -3.102 . . . . 0.0 102.625 -168.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 88.7 p -107.98 162.74 18.82 Favored Pre-proline 0 C--N 1.362 1.127 0 C-N-CA 127.635 2.374 . . . . 0.0 109.351 179.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -72.12 -18.35 27.32 Favored 'Trans proline' 0 C--N 1.355 0.878 0 C-N-CA 124.685 3.59 . . . . 0.0 114.417 164.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -81.43 -2.29 48.96 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.735 2.014 . . . . 0.0 114.505 171.759 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.3 tp-100 -93.13 -10.27 36.52 Favored 'General case' 0 C--N 1.37 1.465 0 C-N-CA 128.162 2.585 . . . . 0.0 109.773 169.762 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 42.6 t -112.74 -14.67 13.09 Favored 'General case' 0 C--N 1.361 1.094 0 C-N-CA 127.511 2.324 . . . . 0.0 108.159 -177.031 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -82.91 -0.69 49.6 Favored 'General case' 0 C--N 1.369 1.445 0 C-N-CA 126.749 2.019 . . . . 0.0 111.25 173.426 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -82.09 -57.65 0.49 Allowed Pre-proline 0 N--CA 1.439 -1.01 0 C-N-CA 129.272 3.029 . . . . 0.0 110.881 172.78 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.07 -43.69 3.07 Favored 'Trans proline' 0 C--N 1.366 1.457 0 C-N-CA 124.911 3.741 . . . . 0.0 113.796 171.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 59.7 m -68.1 -30.39 69.54 Favored 'General case' 0 C--N 1.367 1.36 0 C-N-CA 127.138 2.175 . . . . 0.0 115.215 -176.01 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -88.05 -9.31 53.78 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.946 1.298 . . . . 0.0 113.076 173.108 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -87.5 -22.13 25.07 Favored 'General case' 0 C--N 1.362 1.114 0 C-N-CA 125.917 1.687 . . . . 0.0 112.219 165.735 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.8 mt -96.54 -71.13 0.69 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.214 2.206 . . . . 0.0 110.756 -177.336 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -89.45 -25.89 21.25 Favored 'General case' 0 C--N 1.361 1.102 0 C-N-CA 128.568 2.747 . . . . 0.0 111.531 -169.851 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.73 -155.86 20.14 Favored Glycine 0 C--N 1.361 1.966 0 C-N-CA 125.669 1.604 . . . . 0.0 109.826 177.333 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.4 m -72.46 -4.51 30.72 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 128.337 2.655 . . . . 0.0 114.911 179.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.7 t -104.52 71.78 1.01 Allowed 'General case' 0 C--N 1.365 1.245 0 C-N-CA 127.261 2.224 . . . . 0.0 105.73 165.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.46 127.07 36.63 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 106.045 -1.835 . . . . 0.0 106.045 179.629 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.519 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -101.6 87.45 0.65 Allowed Glycine 0 C--N 1.361 1.96 0 N-CA-C 107.085 -2.406 . . . . 0.0 107.085 170.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.81 111.37 23.16 Favored 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.473 1.509 . . . . 0.0 109.754 -170.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -120.81 141.63 50.36 Favored 'General case' 0 C--N 1.362 1.122 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -170.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.2 t -122.59 111.77 17.18 Favored 'General case' 0 C--N 1.352 0.675 0 N-CA-C 105.57 -2.011 . . . . 0.0 105.57 -178.194 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.8 mmm -120.59 124.79 46.15 Favored 'General case' 0 C--N 1.359 0.985 0 N-CA-C 104.415 -2.439 . . . . 0.0 104.415 178.55 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.47 12.5 p30 70.41 -79.07 0.04 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 128.647 2.779 . . . . 0.0 113.596 -179.613 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.23 54.0 0.14 Allowed Glycine 0 N--CA 1.434 -1.474 0 N-CA-C 105.854 -2.898 . . . . 0.0 105.854 169.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.0 mttm -153.23 151.49 30.13 Favored 'General case' 0 C--N 1.361 1.095 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 176.428 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.11 144.37 32.0 Favored 'General case' 0 C--N 1.358 0.942 0 C-N-CA 127.212 2.205 . . . . 0.0 109.295 -163.656 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.9 mtmt -124.99 140.63 52.75 Favored 'General case' 0 CA--C 1.501 -0.912 0 C-N-CA 126.01 1.724 . . . . 0.0 107.027 174.219 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.3 m -125.31 110.79 14.42 Favored 'General case' 0 C--N 1.357 0.919 0 C-N-CA 124.307 1.043 . . . . 0.0 108.492 179.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -107.78 -161.42 0.78 Allowed 'General case' 0 C--N 1.357 0.928 0 C-N-CA 127.23 2.212 . . . . 0.0 106.829 177.462 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.4 m-80 -132.29 95.72 3.71 Favored 'General case' 0 C--N 1.36 1.025 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 178.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.519 HD22 ' HA3' ' A' ' 26' ' ' GLY . 68.9 m-80 -139.63 100.35 3.94 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.01 -2.218 . . . . 0.0 105.01 176.841 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.425 0 CA-C-N 116.1 -0.5 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 122.081 0.943 . . . . 0.0 109.809 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 47.1 mt -121.78 117.43 52.45 Favored 'Isoleucine or valine' 0 C--N 1.361 1.098 0 N-CA-C 103.366 -2.827 . . . . 0.0 103.366 174.8 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 36.7 pt -101.01 -172.67 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.286 0 C-N-CA 125.422 1.489 . . . . 0.0 109.644 179.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.5 p30 -133.38 73.15 1.5 Allowed 'General case' 0 C--N 1.36 1.049 0 C-N-CA 124.424 1.09 . . . . 0.0 108.669 -173.1 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 17.8 t -125.32 125.48 69.13 Favored 'Isoleucine or valine' 0 C--N 1.361 1.073 0 N-CA-C 103.893 -2.632 . . . . 0.0 103.893 171.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -88.77 125.0 34.68 Favored 'General case' 0 C--N 1.363 1.176 0 C-N-CA 125.264 1.426 . . . . 0.0 108.813 -171.107 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 26.6 p -131.37 176.09 8.58 Favored 'General case' 0 C--N 1.358 0.961 0 C-N-CA 124.177 0.991 . . . . 0.0 109.314 -162.931 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.7 t -154.84 23.27 0.45 Allowed 'General case' 0 C--N 1.356 0.88 0 N-CA-C 105.734 -1.951 . . . . 0.0 105.734 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.6 p -173.47 149.56 1.67 Allowed Pre-proline 0 C--N 1.359 1.002 0 N-CA-C 105.118 -2.179 . . . . 0.0 105.118 -173.59 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -70.58 -17.33 33.9 Favored 'Trans proline' 0 C--N 1.355 0.912 0 C-N-CA 124.538 3.492 . . . . 0.0 114.36 167.847 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mptt -78.02 -14.28 59.57 Favored 'General case' 0 C--N 1.37 1.473 0 C-N-CA 128.584 2.754 . . . . 0.0 114.001 174.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -88.66 -11.44 45.29 Favored 'General case' 0 C--N 1.372 1.574 0 C-N-CA 127.852 2.461 . . . . 0.0 110.263 172.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 51.5 t -109.08 -13.41 14.7 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.04 2.136 . . . . 0.0 109.135 -179.144 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -84.8 -0.41 53.77 Favored 'General case' 0 C--N 1.37 1.459 0 C-N-CA 126.021 1.728 . . . . 0.0 111.202 173.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.9 mtpp -80.09 -59.06 0.56 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.108 2.963 . . . . 0.0 111.266 171.21 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.7 Cg_endo -70.88 -41.77 2.65 Favored 'Trans proline' 0 C--N 1.365 1.396 0 C-N-CA 125.023 3.815 . . . . 0.0 113.509 174.663 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.59 -30.06 66.65 Favored 'General case' 0 C--N 1.367 1.356 0 C-N-CA 127.482 2.313 . . . . 0.0 114.941 -176.621 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -88.07 -8.94 54.79 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.823 1.192 . . . . 0.0 112.792 171.975 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -86.27 -21.37 27.39 Favored 'General case' 0 C--N 1.361 1.106 0 C-N-CA 125.836 1.654 . . . . 0.0 111.586 166.471 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.9 mt -91.92 -66.27 0.94 Allowed 'General case' 0 C--N 1.365 1.273 0 C-N-CA 127.563 2.345 . . . . 0.0 111.023 178.006 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -97.16 -8.57 29.75 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 127.863 2.465 . . . . 0.0 112.263 -167.179 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.38 -79.64 0.58 Allowed Glycine 0 C--N 1.365 2.183 0 C-N-CA 125.099 1.333 . . . . 0.0 113.655 164.92 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.8 m -147.97 -7.13 0.43 Allowed 'General case' 0 C--N 1.354 0.797 0 C-N-CA 126.005 1.722 . . . . 0.0 107.225 -174.683 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.411 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.3 t -108.73 66.6 0.64 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 126.733 2.013 . . . . 0.0 105.886 177.372 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.58 125.31 42.98 Favored 'General case' 0 C--N 1.359 0.979 0 C-N-CA 125.715 1.606 . . . . 0.0 106.838 -175.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.483 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -103.16 83.59 0.43 Allowed Glycine 0 C--N 1.362 2.018 0 N-CA-C 106.897 -2.481 . . . . 0.0 106.897 170.177 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.89 113.59 25.34 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 125.291 1.437 . . . . 0.0 110.172 -168.427 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.6 mmmp? -119.78 149.28 42.3 Favored 'General case' 0 CA--C 1.495 -1.148 0 C-N-CA 125.197 1.399 . . . . 0.0 108.026 -171.165 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.7 t -131.33 115.34 16.14 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 -179.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 94.7 mtp -124.34 127.37 47.49 Favored 'General case' 0 C--N 1.358 0.967 0 N-CA-C 103.815 -2.661 . . . . 0.0 103.815 173.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.44 -83.31 0.02 OUTLIER 'General case' 0 C--N 1.384 2.104 0 C-N-CA 127.562 2.345 . . . . 0.0 110.533 174.518 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -175.54 57.14 0.11 Allowed Glycine 0 N--CA 1.43 -1.756 0 N-CA-C 105.558 -3.017 . . . . 0.0 105.558 167.527 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 53.8 mttp -152.09 150.21 29.66 Favored 'General case' 0 C--N 1.365 1.25 0 N-CA-C 105.796 -1.927 . . . . 0.0 105.796 175.758 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.8 t -105.04 142.88 34.04 Favored 'General case' 0 C--N 1.357 0.93 0 C-N-CA 127.28 2.232 . . . . 0.0 109.555 -164.747 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 31.3 mtmm -123.58 140.6 52.83 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.83 1.652 . . . . 0.0 107.315 173.008 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -120.62 119.26 32.35 Favored 'General case' 0 C--N 1.361 1.082 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 176.385 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -117.5 -168.0 1.42 Allowed 'General case' 0 N--CA 1.438 -1.061 0 N-CA-C 106.215 -1.772 . . . . 0.0 106.215 178.039 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -126.18 89.38 3.0 Favored 'General case' 0 C--N 1.36 1.022 0 N-CA-C 106.354 -1.721 . . . . 0.0 106.354 -177.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.483 HD22 ' HA3' ' A' ' 26' ' ' GLY . 70.0 m-80 -137.74 94.85 2.95 Favored 'General case' 0 C--N 1.357 0.894 0 N-CA-C 105.297 -2.112 . . . . 0.0 105.297 177.494 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.385 0 CA-C-N 116.063 -0.517 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 N--CA 1.491 1.599 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.0 mt -124.8 119.66 56.66 Favored 'Isoleucine or valine' 0 C--N 1.366 1.304 0 N-CA-C 103.064 -2.939 . . . . 0.0 103.064 176.344 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.1 pt -103.78 -175.85 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.248 0 C-N-CA 125.12 1.368 . . . . 0.0 109.679 -179.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -128.73 78.69 1.86 Allowed 'General case' 0 C--N 1.362 1.12 0 C-N-CA 124.913 1.285 . . . . 0.0 107.589 -175.061 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.4 t -128.26 124.37 62.11 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.719 -2.326 . . . . 0.0 104.719 173.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -80.87 134.94 35.84 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 126.904 2.082 . . . . 0.0 110.125 -177.87 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.3 p -142.33 -179.18 6.12 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.726 0.774 . . . . 0.0 110.079 -164.253 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.5 t -148.94 18.64 0.99 Allowed 'General case' 0 C--N 1.355 0.839 0 C-N-CA 126.064 1.746 . . . . 0.0 106.772 168.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.2 p -172.96 155.96 3.03 Favored Pre-proline 0 C--N 1.363 1.189 0 C-N-CA 124.651 1.181 . . . . 0.0 108.196 -172.705 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -69.75 -18.22 37.17 Favored 'Trans proline' 0 C--N 1.361 1.198 1 C-N-CA 125.395 4.064 . . . . 0.0 114.804 163.224 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -76.09 -17.11 59.76 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 128.161 2.584 . . . . 0.0 113.744 174.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.5 tp60 -91.6 -7.86 48.94 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 128.499 2.72 . . . . 0.0 110.179 174.293 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.9 t -109.06 -13.54 14.69 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.522 2.329 . . . . 0.0 109.144 -179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.1 m -84.39 -1.88 56.24 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 126.332 1.853 . . . . 0.0 111.295 174.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -79.95 -59.37 0.55 Allowed Pre-proline 0 C--N 1.357 0.907 0 C-N-CA 129.331 3.053 . . . . 0.0 111.314 171.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -70.61 -41.02 3.47 Favored 'Trans proline' 0 C--N 1.365 1.399 0 C-N-CA 125.114 3.876 . . . . 0.0 113.584 175.332 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -69.12 -31.44 70.13 Favored 'General case' 0 C--N 1.37 1.463 0 C-N-CA 127.684 2.394 . . . . 0.0 114.735 -177.85 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -88.08 -6.4 57.95 Favored 'General case' 0 C--N 1.37 1.486 0 C-N-CA 124.651 1.18 . . . . 0.0 113.2 172.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -88.65 -20.44 24.91 Favored 'General case' 0 C--N 1.361 1.082 0 C-N-CA 125.68 1.592 . . . . 0.0 111.471 165.632 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.3 mt -93.36 -66.88 0.89 Allowed 'General case' 0 C--N 1.365 1.262 0 C-N-CA 127.506 2.322 . . . . 0.0 111.111 179.555 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -92.68 -14.92 27.4 Favored 'General case' 0 C--N 1.363 1.163 0 C-N-CA 128.181 2.592 . . . . 0.0 111.705 -169.416 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.0 -74.29 0.29 Allowed Glycine 0 C--N 1.365 2.154 0 C-N-CA 124.9 1.238 . . . . 0.0 113.746 163.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.0 p -141.39 -35.22 0.47 Allowed 'General case' 0 C--N 1.354 0.766 0 C-N-CA 125.588 1.555 . . . . 0.0 107.13 -169.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.8 t -93.14 75.64 4.66 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 127.823 2.449 . . . . 0.0 108.034 176.466 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.53 121.15 28.16 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 106.55 -1.648 . . . . 0.0 106.55 -177.24 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.36 85.08 0.78 Allowed Glycine 0 C--N 1.364 2.104 0 N-CA-C 107.783 -2.127 . . . . 0.0 107.783 172.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.65 114.55 27.14 Favored 'General case' 0 C--N 1.361 1.076 0 C-N-CA 125.556 1.542 . . . . 0.0 109.843 -170.841 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 58.1 mttm -123.99 143.21 50.55 Favored 'General case' 0 CA--C 1.491 -1.296 0 N-CA-C 104.436 -2.431 . . . . 0.0 104.436 -172.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.8 113.38 8.54 Favored 'General case' 0 CA--C 1.502 -0.881 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -176.696 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.5 mmt -115.0 122.32 45.85 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 -175.003 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 77.92 -83.91 0.03 OUTLIER 'General case' 0 C--N 1.38 1.895 0 C-N-CA 127.491 2.316 . . . . 0.0 111.152 176.954 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.76 49.44 0.25 Allowed Glycine 0 N--CA 1.434 -1.493 0 N-CA-C 107.194 -2.362 . . . . 0.0 107.194 170.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.9 mttm -151.28 149.25 29.15 Favored 'General case' 0 C--N 1.367 1.343 0 N-CA-C 107.189 -1.412 . . . . 0.0 107.189 173.173 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -104.97 150.11 25.19 Favored 'General case' 0 C--N 1.361 1.071 0 C-N-CA 127.91 2.484 . . . . 0.0 110.076 -161.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -132.31 138.39 47.8 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 126.559 1.943 . . . . 0.0 106.035 177.743 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.4 m -124.41 113.43 18.16 Favored 'General case' 0 C--N 1.359 1.001 0 C-N-CA 124.336 1.054 . . . . 0.0 108.685 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -113.0 -148.36 0.43 Allowed 'General case' 0 N--CA 1.44 -0.964 0 C-N-CA 127.112 2.165 . . . . 0.0 106.311 178.312 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -133.77 155.93 48.91 Favored 'General case' 0 C--N 1.359 0.995 0 N-CA-C 105.443 -2.058 . . . . 0.0 105.443 175.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 89.6 m-20 -86.98 121.09 28.96 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 172.351 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.349 0 CA-C-N 116.168 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 122.069 0.938 . . . . 0.0 109.837 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 49.9 mt -123.75 115.7 45.96 Favored 'Isoleucine or valine' 0 C--N 1.359 1.021 0 N-CA-C 103.061 -2.94 . . . . 0.0 103.061 174.647 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.6 pt -99.88 -177.83 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.382 0 C-N-CA 125.367 1.467 . . . . 0.0 109.777 -179.094 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -127.36 77.58 1.75 Allowed 'General case' 0 C--N 1.362 1.123 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 -173.853 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.7 t -128.63 125.44 63.51 Favored 'Isoleucine or valine' 0 C--N 1.362 1.12 0 N-CA-C 104.535 -2.395 . . . . 0.0 104.535 174.103 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -78.27 138.78 38.78 Favored 'General case' 0 C--N 1.367 1.338 0 C-N-CA 127.091 2.156 . . . . 0.0 110.914 -177.705 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.3 p -147.96 -176.35 5.24 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-O 121.421 0.629 . . . . 0.0 109.606 -166.865 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.8 t -155.11 27.3 0.42 Allowed 'General case' 0 C--N 1.359 0.984 0 N-CA-C 105.252 -2.129 . . . . 0.0 105.252 163.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.9 p -174.44 151.25 1.57 Allowed Pre-proline 0 C--N 1.364 1.213 0 C-N-CA 124.669 1.188 . . . . 0.0 108.137 -170.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -69.12 -17.15 40.62 Favored 'Trans proline' 0 C--N 1.361 1.185 1 C-N-CA 125.333 4.022 . . . . 0.0 115.305 165.059 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -88.02 6.89 33.83 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 126.093 1.757 . . . . 0.0 113.746 172.385 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -113.0 25.42 11.41 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 126.917 2.087 . . . . 0.0 107.366 167.129 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 49.9 t -145.2 -18.26 0.49 Allowed 'General case' 0 C--N 1.356 0.857 0 C-N-CA 126.329 1.852 . . . . 0.0 109.549 -175.547 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 4.9 t -88.02 1.26 54.62 Favored 'General case' 0 C--N 1.37 1.496 0 CA-C-N 121.147 1.794 . . . . 0.0 110.464 177.26 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -82.79 -55.34 0.53 Allowed Pre-proline 0 C--N 1.359 1.011 0 C-N-CA 129.346 3.058 . . . . 0.0 110.955 171.155 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -69.83 -39.09 6.77 Favored 'Trans proline' 0 C--N 1.368 1.558 0 C-N-CA 124.99 3.793 . . . . 0.0 113.79 172.724 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.8 m -70.18 -29.42 66.29 Favored 'General case' 0 C--N 1.367 1.347 0 C-N-CA 127.601 2.36 . . . . 0.0 114.828 -179.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 47.7 mtmt -88.08 -8.27 55.75 Favored 'General case' 0 C--N 1.371 1.529 0 C-N-CA 124.922 1.289 . . . . 0.0 113.204 170.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -87.71 -20.42 26.25 Favored 'General case' 0 C--N 1.359 1.018 0 C-N-CA 125.797 1.639 . . . . 0.0 111.157 167.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 31.3 mt -92.91 -66.47 0.92 Allowed 'General case' 0 C--N 1.365 1.255 0 C-N-CA 127.663 2.385 . . . . 0.0 111.016 177.578 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -97.42 -7.48 31.6 Favored 'General case' 0 C--N 1.363 1.164 0 C-N-CA 127.682 2.393 . . . . 0.0 112.447 -167.055 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.56 -80.75 0.52 Allowed Glycine 0 C--N 1.364 2.1 0 C-N-CA 124.953 1.263 . . . . 0.0 113.738 165.318 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.29 -11.2 0.42 Allowed 'General case' 0 C--N 1.355 0.834 0 C-N-CA 125.762 1.625 . . . . 0.0 107.167 -175.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.8 t -105.78 70.59 0.87 Allowed 'General case' 0 C--N 1.365 1.269 0 C-N-CA 126.811 2.045 . . . . 0.0 105.842 176.694 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.81 129.39 48.21 Favored 'General case' 0 C--N 1.36 1.033 0 C-N-CA 125.718 1.607 . . . . 0.0 107.042 -174.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 89.37 0.61 Allowed Glycine 0 C--N 1.361 1.964 0 N-CA-C 107.208 -2.357 . . . . 0.0 107.208 171.39 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -94.48 115.66 27.87 Favored 'General case' 0 C--N 1.359 0.981 0 C-N-CA 125.253 1.421 . . . . 0.0 109.653 -173.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -128.89 142.97 50.78 Favored 'General case' 0 CA--C 1.491 -1.3 0 N-CA-C 103.536 -2.764 . . . . 0.0 103.536 -171.501 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.7 115.37 9.07 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 106.982 -1.488 . . . . 0.0 106.982 -174.236 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 92.1 mtp -113.29 121.92 45.86 Favored 'General case' 0 C--N 1.362 1.135 0 C-N-CA 126.28 1.832 . . . . 0.0 106.183 -177.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 78.58 -84.34 0.02 OUTLIER 'General case' 0 C--N 1.38 1.899 0 C-N-CA 127.385 2.274 . . . . 0.0 111.332 173.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -165.11 48.95 0.28 Allowed Glycine 0 N--CA 1.434 -1.471 0 N-CA-C 107.54 -2.224 . . . . 0.0 107.54 171.71 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -151.75 150.86 30.66 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 107.413 -1.328 . . . . 0.0 107.413 171.078 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 41.4 t -105.01 154.05 20.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 128.016 2.526 . . . . 0.0 110.472 -162.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -134.74 140.81 46.22 Favored 'General case' 0 C--N 1.36 1.044 0 C-N-CA 126.623 1.969 . . . . 0.0 105.945 177.502 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.7 m -125.86 128.02 46.96 Favored 'General case' 0 C--N 1.359 1.014 0 C-N-CA 124.417 1.087 . . . . 0.0 108.067 178.247 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 61.0 m-85 -128.42 -157.73 0.84 Allowed 'General case' 0 N--CA 1.436 -1.141 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 -177.841 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -132.66 89.81 2.69 Favored 'General case' 0 C--N 1.359 1.018 0 N-CA-C 106.482 -1.673 . . . . 0.0 106.482 -179.952 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 81.7 m-20 -115.82 99.44 7.3 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 105.002 -2.221 . . . . 0.0 105.002 172.897 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.377 0 CA-C-N 116.174 -0.466 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 81.3 p . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 122.035 0.921 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 52.3 mt -125.71 113.38 34.45 Favored 'Isoleucine or valine' 0 C--N 1.361 1.069 0 N-CA-C 102.832 -3.025 . . . . 0.0 102.832 175.303 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 25.6 pt -100.64 -179.05 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.353 0 C-N-CA 125.098 1.359 . . . . 0.0 110.17 -177.849 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -124.52 73.94 1.29 Allowed 'General case' 0 C--N 1.363 1.156 0 C-N-CA 124.952 1.301 . . . . 0.0 108.397 -173.071 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.41 HG11 ' HG3' ' A' ' 16' ' ' PRO . 12.6 t -128.96 126.51 64.76 Favored 'Isoleucine or valine' 0 C--N 1.362 1.15 0 N-CA-C 104.437 -2.431 . . . . 0.0 104.437 174.009 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 12.2 mptt -84.26 140.96 31.31 Favored 'General case' 0 C--N 1.367 1.34 0 C-N-CA 126.424 1.89 . . . . 0.0 109.146 -175.944 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.96 -178.79 6.38 Favored 'General case' 0 C--N 1.357 0.909 0 CA-C-O 121.552 0.692 . . . . 0.0 110.41 -164.822 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -154.94 25.19 0.43 Allowed 'General case' 0 C--N 1.358 0.959 0 N-CA-C 105.679 -1.971 . . . . 0.0 105.679 167.233 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 57.5 p -173.81 152.07 1.93 Allowed Pre-proline 0 C--N 1.365 1.274 0 C-N-CA 124.653 1.181 . . . . 0.0 107.975 -172.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -69.79 -17.89 37.18 Favored 'Trans proline' 0 C--N 1.36 1.172 0 C-N-CA 125.269 3.98 . . . . 0.0 115.288 164.512 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.2 tptt -78.89 -13.74 59.63 Favored 'General case' 0 C--N 1.37 1.474 0 C-N-CA 126.676 1.99 . . . . 0.0 114.374 172.585 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -90.37 -3.71 57.54 Favored 'General case' 0 C--N 1.37 1.485 0 C-N-CA 127.239 2.215 . . . . 0.0 110.077 171.522 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -114.19 -14.15 12.33 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.285 2.234 . . . . 0.0 109.138 179.725 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 71.0 m -85.14 -3.77 58.92 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 126.071 1.748 . . . . 0.0 111.013 174.874 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -77.83 -59.33 0.8 Allowed Pre-proline 0 N--CA 1.441 -0.906 0 C-N-CA 129.408 3.083 . . . . 0.0 111.907 170.832 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.41 ' HG3' HG11 ' A' ' 5' ' ' VAL . 66.6 Cg_endo -71.14 -39.96 3.62 Favored 'Trans proline' 0 C--N 1.364 1.344 0 C-N-CA 125.138 3.892 . . . . 0.0 113.841 175.111 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.2 m -70.72 -29.7 66.04 Favored 'General case' 0 C--N 1.367 1.369 0 C-N-CA 127.487 2.315 . . . . 0.0 114.294 -177.115 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -88.04 -8.19 55.92 Favored 'General case' 0 C--N 1.369 1.449 0 C-N-CA 124.889 1.276 . . . . 0.0 113.143 171.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -87.07 -19.94 27.87 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 125.608 1.563 . . . . 0.0 111.443 165.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.4 mt -92.83 -66.51 0.92 Allowed 'General case' 0 C--N 1.364 1.227 0 C-N-CA 127.666 2.386 . . . . 0.0 111.122 178.211 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -95.53 -10.4 29.77 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.991 2.516 . . . . 0.0 112.247 -167.769 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.35 -79.97 0.37 Allowed Glycine 0 C--N 1.366 2.198 0 C-N-CA 124.863 1.221 . . . . 0.0 113.351 165.517 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.0 m -146.76 -14.01 0.43 Allowed 'General case' 0 C--N 1.355 0.808 0 C-N-CA 125.661 1.584 . . . . 0.0 107.072 -174.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.7 t -104.56 70.1 0.93 Allowed 'General case' 0 C--N 1.365 1.267 0 C-N-CA 126.866 2.066 . . . . 0.0 106.146 176.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -125.1 122.89 38.47 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.134 1.774 . . . . 0.0 106.813 -176.276 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -98.23 84.01 0.68 Allowed Glycine 0 C--N 1.364 2.097 0 N-CA-C 107.597 -2.201 . . . . 0.0 107.597 171.718 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.86 115.8 28.45 Favored 'General case' 0 C--N 1.36 1.035 0 C-N-CA 125.298 1.439 . . . . 0.0 109.689 -171.932 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 44.7 mmtm -122.57 145.55 48.24 Favored 'General case' 0 CA--C 1.494 -1.186 0 N-CA-C 102.984 -2.969 . . . . 0.0 102.984 -173.65 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.89 132.05 28.09 Favored 'General case' 0 CA--C 1.499 -1.009 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.747 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 96.8 mtp -105.46 73.39 1.02 Allowed 'General case' 0 C--N 1.359 1.009 0 N-CA-C 105.072 -2.195 . . . . 0.0 105.072 175.259 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -0.76 68.28 0.0 OUTLIER 'General case' 0 C--N 1.378 1.813 1 C-N-CA 135.193 5.397 . . . . 0.0 118.537 -175.354 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 160.61 -42.24 0.43 Allowed Glycine 0 C--N 1.355 1.624 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -161.799 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -153.96 155.4 35.53 Favored 'General case' 0 C--N 1.37 1.482 0 CA-C-N 119.264 1.532 . . . . 0.0 109.369 179.74 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.8 t -107.02 153.63 22.31 Favored 'General case' 0 C--N 1.366 1.308 0 C-N-CA 129.275 3.03 . . . . 0.0 110.519 -165.266 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -133.37 137.18 45.75 Favored 'General case' 0 C--N 1.364 1.201 0 C-N-CA 126.79 2.036 . . . . 0.0 106.557 176.148 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 63.4 m -121.11 122.7 40.6 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 124.369 1.067 . . . . 0.0 108.721 177.935 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -123.63 -149.7 0.43 Allowed 'General case' 0 N--CA 1.436 -1.165 0 N-CA-C 105.58 -2.007 . . . . 0.0 105.58 178.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -133.26 156.73 47.03 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 105.761 -1.94 . . . . 0.0 105.761 177.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 28.8 m120 -88.31 124.34 33.8 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 171.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 90.4 m . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 48.8 mt -120.37 121.02 64.53 Favored 'Isoleucine or valine' 0 C--N 1.361 1.093 0 N-CA-C 104.178 -2.527 . . . . 0.0 104.178 177.832 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 41.5 pt -103.15 -171.15 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.289 0 C-N-CA 125.538 1.535 . . . . 0.0 108.936 177.554 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 45.0 t-20 -134.99 91.62 2.77 Favored 'General case' 0 C--N 1.36 1.046 0 N-CA-C 106.467 -1.679 . . . . 0.0 106.467 -178.941 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.7 t -133.46 124.37 48.37 Favored 'Isoleucine or valine' 0 C--N 1.359 1.007 0 N-CA-C 103.251 -2.87 . . . . 0.0 103.251 169.746 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -79.32 134.63 36.61 Favored 'General case' 0 C--N 1.366 1.32 0 C-N-CA 126.689 1.996 . . . . 0.0 109.814 -178.485 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.5 p -143.32 -177.87 5.59 Favored 'General case' 0 C--N 1.357 0.917 0 CA-C-O 121.505 0.669 . . . . 0.0 110.052 -163.453 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.3 t -152.42 22.29 0.63 Allowed 'General case' 0 C--N 1.358 0.948 0 N-CA-C 105.969 -1.863 . . . . 0.0 105.969 168.556 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.2 p -173.49 151.84 2.03 Favored Pre-proline 0 C--N 1.364 1.237 0 C-N-CA 124.455 1.102 . . . . 0.0 108.28 -171.102 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -69.45 -17.79 38.79 Favored 'Trans proline' 0 C--N 1.36 1.177 1 C-N-CA 125.377 4.051 . . . . 0.0 115.153 164.139 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -77.91 -15.28 59.13 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.02 2.128 . . . . 0.0 114.455 172.483 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.4 tp-100 -89.67 -4.49 57.73 Favored 'General case' 0 C--N 1.371 1.52 0 C-N-CA 127.256 2.222 . . . . 0.0 110.005 171.749 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 47.5 t -113.18 -13.49 12.99 Favored 'General case' 0 C--N 1.36 1.038 0 C-N-CA 127.236 2.214 . . . . 0.0 109.245 178.923 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.4 m -85.29 -4.03 59.02 Favored 'General case' 0 C--N 1.369 1.432 0 C-N-CA 126.128 1.771 . . . . 0.0 111.057 174.6 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -78.61 -58.85 0.73 Allowed Pre-proline 0 C--N 1.356 0.882 0 C-N-CA 129.499 3.119 . . . . 0.0 111.7 171.05 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -70.21 -42.23 3.11 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 125.253 3.969 . . . . 0.0 113.725 174.833 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -69.43 -30.77 68.78 Favored 'General case' 0 C--N 1.367 1.367 0 C-N-CA 127.451 2.3 . . . . 0.0 114.888 -177.458 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -87.97 -7.02 57.7 Favored 'General case' 0 C--N 1.37 1.481 0 C-N-CA 124.817 1.247 . . . . 0.0 113.495 171.915 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -85.79 -25.74 26.16 Favored 'General case' 0 C--N 1.362 1.148 0 C-N-CA 125.913 1.685 . . . . 0.0 110.956 165.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 46.7 mt -89.36 -63.3 1.31 Allowed 'General case' 0 C--N 1.365 1.282 0 C-N-CA 127.553 2.341 . . . . 0.0 111.781 179.706 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -98.77 -8.84 25.31 Favored 'General case' 0 C--N 1.362 1.141 0 C-N-CA 127.786 2.434 . . . . 0.0 111.898 -167.495 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.14 -79.94 0.48 Allowed Glycine 0 C--N 1.365 2.189 0 C-N-CA 125.048 1.309 . . . . 0.0 113.551 165.237 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -147.31 -11.45 0.42 Allowed 'General case' 0 C--N 1.355 0.84 0 C-N-CA 125.711 1.604 . . . . 0.0 106.98 -175.43 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 18.9 t -105.26 69.51 0.85 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 126.887 2.075 . . . . 0.0 106.132 177.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.22 128.13 46.73 Favored 'General case' 0 C--N 1.359 1.019 0 C-N-CA 125.842 1.657 . . . . 0.0 106.723 -175.956 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -104.18 86.03 0.5 Allowed Glycine 0 C--N 1.362 1.975 0 N-CA-C 107.017 -2.433 . . . . 0.0 107.017 170.999 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.84 113.8 25.91 Favored 'General case' 0 C--N 1.358 0.964 0 C-N-CA 125.14 1.376 . . . . 0.0 109.832 -171.483 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.3 mmmt -121.52 144.13 48.89 Favored 'General case' 0 CA--C 1.497 -1.091 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 -173.595 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.82 110.76 6.23 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 -178.491 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 63.7 mtt -115.26 126.06 54.06 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 126.751 2.02 . . . . 0.0 105.695 -175.797 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 38.9 t30 81.67 -85.64 0.02 OUTLIER 'General case' 0 C--N 1.382 1.991 0 C-N-CA 127.32 2.248 . . . . 0.0 109.653 174.855 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -168.86 50.84 0.22 Allowed Glycine 0 N--CA 1.433 -1.525 0 N-CA-C 106.527 -2.629 . . . . 0.0 106.527 169.363 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 55.4 mttp -151.41 149.98 29.91 Favored 'General case' 0 C--N 1.368 1.404 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 174.595 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.4 t -104.94 150.06 25.21 Favored 'General case' 0 C--N 1.361 1.098 0 C-N-CA 127.686 2.395 . . . . 0.0 110.368 -162.785 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 52.6 mtmt -132.36 138.88 47.9 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 126.812 2.045 . . . . 0.0 106.395 177.111 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 59.9 m -123.16 121.99 37.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 124.334 1.053 . . . . 0.0 108.546 178.087 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 64.1 m-85 -120.6 -158.98 0.77 Allowed 'General case' 0 N--CA 1.437 -1.103 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.156 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 54.7 m-80 -133.32 89.14 2.57 Favored 'General case' 0 C--N 1.359 0.982 0 N-CA-C 106.469 -1.678 . . . . 0.0 106.469 -178.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -115.87 100.59 8.1 Favored 'General case' 0 C--N 1.358 0.963 0 N-CA-C 105.16 -2.163 . . . . 0.0 105.16 173.479 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.397 0 CA-C-N 116.247 -0.433 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 121.548 0.689 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 57.1 mt -105.07 124.08 59.58 Favored 'Isoleucine or valine' 0 C--N 1.363 1.193 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 178.598 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.7 pt -100.87 -171.62 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.361 1.097 0 C-N-CA 126.098 1.759 . . . . 0.0 110.111 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -130.99 82.46 2.05 Favored 'General case' 0 C--N 1.361 1.094 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 -176.309 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 t -132.84 128.05 56.44 Favored 'Isoleucine or valine' 0 C--N 1.36 1.057 0 N-CA-C 103.56 -2.755 . . . . 0.0 103.56 172.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 mmmp? -83.03 132.0 35.15 Favored 'General case' 0 C--N 1.364 1.234 0 C-N-CA 126.084 1.754 . . . . 0.0 109.551 -177.328 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -140.83 170.03 16.51 Favored 'General case' 0 C--N 1.357 0.909 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 -166.018 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -152.14 25.91 0.62 Allowed 'General case' 0 C--N 1.356 0.873 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 170.577 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.9 p -168.73 149.31 4.23 Favored Pre-proline 0 C--N 1.36 1.032 0 N-CA-C 105.175 -2.158 . . . . 0.0 105.175 -177.686 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -71.43 -15.48 31.06 Favored 'Trans proline' 0 C--N 1.357 1.0 0 C-N-CA 124.469 3.446 . . . . 0.0 114.394 168.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.43 -11.65 59.96 Favored 'General case' 0 C--N 1.369 1.435 0 C-N-CA 128.047 2.539 . . . . 0.0 113.736 172.24 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -94.24 -3.93 49.8 Favored 'General case' 0 C--N 1.371 1.53 0 C-N-CA 127.509 2.324 . . . . 0.0 110.138 173.478 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.5 t -118.12 -13.41 9.95 Favored 'General case' 0 C--N 1.36 1.061 0 C-N-CA 126.886 2.074 . . . . 0.0 108.895 -177.383 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.2 m -88.03 1.0 55.26 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 125.897 1.679 . . . . 0.0 110.949 172.651 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -79.69 -58.8 0.61 Allowed Pre-proline 0 C--N 1.359 1.003 0 C-N-CA 129.165 2.986 . . . . 0.0 111.592 170.871 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -71.23 -40.02 3.49 Favored 'Trans proline' 0 C--N 1.365 1.404 0 C-N-CA 125.024 3.816 . . . . 0.0 113.668 175.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -74.3 -25.67 59.72 Favored 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.591 2.356 . . . . 0.0 114.669 -177.251 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.13 -8.16 55.84 Favored 'General case' 0 C--N 1.371 1.531 0 CA-C-N 120.15 1.341 . . . . 0.0 113.248 168.122 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -86.91 -19.71 28.45 Favored 'General case' 0 C--N 1.361 1.073 0 C-N-CA 125.565 1.546 . . . . 0.0 111.398 166.56 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 47.9 mt -93.54 -65.92 0.96 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 127.575 2.35 . . . . 0.0 111.133 177.606 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -95.41 -6.73 40.23 Favored 'General case' 0 C--N 1.362 1.146 0 C-N-CA 127.797 2.439 . . . . 0.0 112.35 -167.407 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.64 -80.11 0.45 Allowed Glycine 0 C--N 1.365 2.188 0 C-N-CA 125.103 1.335 . . . . 0.0 113.392 165.459 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 24' ' ' SER . 75.7 m -146.68 -5.87 0.54 Allowed 'General case' 0 C--N 1.353 0.745 0 C-N-CA 125.722 1.609 . . . . 0.0 106.903 -177.164 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.424 ' H ' ' H ' ' A' ' 23' ' ' SER . 19.4 t -102.22 73.24 1.34 Allowed 'General case' 0 C--N 1.365 1.246 0 C-N-CA 127.092 2.157 . . . . 0.0 106.907 179.375 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -152.02 116.55 5.06 Favored 'General case' 0 C--N 1.358 0.973 0 N-CA-C 106.743 -1.577 . . . . 0.0 106.743 -179.253 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -108.97 72.61 0.2 Allowed Glycine 0 C--N 1.36 1.862 0 N-CA-C 106.481 -2.648 . . . . 0.0 106.481 169.035 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.11 140.54 34.98 Favored 'General case' 0 C--N 1.363 1.155 0 C-N-CA 128.366 2.666 . . . . 0.0 111.484 -167.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 53.1 mttm -122.13 142.97 49.83 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 124.787 1.235 . . . . 0.0 107.79 -163.41 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 43.5 t -117.91 103.73 10.23 Favored 'General case' 0 C--N 1.353 0.732 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 178.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 85.7 mtp -111.83 121.94 46.43 Favored 'General case' 0 C--N 1.361 1.068 0 N-CA-C 105.358 -2.09 . . . . 0.0 105.358 176.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 70.8 m-80 78.32 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.383 2.051 0 C-N-CA 127.781 2.432 . . . . 0.0 110.706 178.618 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -171.69 53.56 0.18 Allowed Glycine 0 N--CA 1.433 -1.5 0 N-CA-C 105.299 -3.121 . . . . 0.0 105.299 168.574 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -151.88 151.82 31.78 Favored 'General case' 0 C--N 1.362 1.137 0 N-CA-C 105.091 -2.189 . . . . 0.0 105.091 179.031 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.98 141.2 36.99 Favored 'General case' 0 C--N 1.356 0.864 0 C-N-CA 126.497 1.919 . . . . 0.0 109.907 -163.296 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -120.08 146.64 45.73 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 126.669 1.988 . . . . 0.0 106.746 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.1 m -117.13 137.7 52.13 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 108.029 -1.1 . . . . 0.0 108.029 174.114 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -132.41 -179.98 5.77 Favored 'General case' 0 N--CA 1.434 -1.229 0 N-CA-C 105.112 -2.181 . . . . 0.0 105.112 -178.554 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.2 m-80 -126.34 88.01 2.77 Favored 'General case' 0 C--N 1.36 1.037 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 -177.545 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -131.5 98.66 4.57 Favored 'General case' 0 C--N 1.357 0.893 0 N-CA-C 105.784 -1.932 . . . . 0.0 105.784 178.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.377 0 CA-C-N 116.133 -0.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.438 HG23 ' HG2' ' A' ' 35' ' ' LYS . 98.3 mt -105.05 126.44 60.01 Favored 'Isoleucine or valine' 0 C--N 1.368 1.389 0 N-CA-C 105.712 -1.959 . . . . 0.0 105.712 -176.531 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.3 pt -106.13 -174.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.36 1.037 0 C-N-CA 125.751 1.62 . . . . 0.0 110.093 -172.622 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -130.1 82.34 2.06 Favored 'General case' 0 C--N 1.362 1.121 0 N-CA-C 106.384 -1.71 . . . . 0.0 106.384 -177.206 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 t -130.79 126.17 59.68 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.123 0 N-CA-C 103.101 -2.926 . . . . 0.0 103.101 171.457 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -83.23 131.59 35.09 Favored 'General case' 0 C--N 1.365 1.247 0 C-N-CA 125.673 1.589 . . . . 0.0 109.519 -175.953 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.8 p -138.72 171.84 13.75 Favored 'General case' 0 C--N 1.357 0.931 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 -165.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -152.88 26.73 0.55 Allowed 'General case' 0 C--N 1.356 0.886 0 N-CA-C 105.69 -1.967 . . . . 0.0 105.69 170.202 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 77.8 p -170.18 148.39 2.98 Favored Pre-proline 0 C--N 1.36 1.056 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -177.443 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -71.14 -16.29 31.91 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 124.293 3.329 . . . . 0.0 114.801 168.965 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -84.08 -0.36 51.51 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 126.564 1.946 . . . . 0.0 114.449 171.525 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -97.17 -0.64 46.54 Favored 'General case' 0 C--N 1.371 1.523 0 C-N-CA 127.115 2.166 . . . . 0.0 109.619 168.118 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 46.6 t -122.69 -12.52 8.08 Favored 'General case' 0 C--N 1.361 1.093 0 C-N-CA 127.013 2.125 . . . . 0.0 108.866 -175.833 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.2 m -87.68 1.11 54.64 Favored 'General case' 0 C--N 1.368 1.393 0 C-N-CA 126.797 2.039 . . . . 0.0 110.16 172.183 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -81.4 -58.73 0.48 Allowed Pre-proline 0 N--CA 1.44 -0.957 0 C-N-CA 129.347 3.059 . . . . 0.0 111.096 171.342 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_endo -71.52 -40.33 3.04 Favored 'Trans proline' 0 C--N 1.364 1.393 0 C-N-CA 124.972 3.782 . . . . 0.0 113.534 173.762 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.0 m -71.88 -23.96 61.58 Favored 'General case' 0 C--N 1.366 1.295 0 C-N-CA 127.353 2.261 . . . . 0.0 114.764 -179.325 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.8 mttm -88.09 -9.06 54.46 Favored 'General case' 0 C--N 1.373 1.612 0 CA-C-N 120.471 1.487 . . . . 0.0 114.117 166.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -88.08 -20.07 26.22 Favored 'General case' 0 C--N 1.359 1.006 0 C-N-CA 125.525 1.53 . . . . 0.0 111.445 167.948 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 44.7 mt -98.8 -71.79 0.68 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.437 2.295 . . . . 0.0 110.292 179.368 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -105.82 40.48 1.56 Allowed 'General case' 0 C--N 1.359 1.004 0 C-N-CA 128.643 2.777 . . . . 0.0 109.963 -169.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -81.84 83.97 1.5 Allowed Glycine 0 C--N 1.364 2.135 0 C-N-CA 126.212 1.863 . . . . 0.0 116.051 -167.59 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 54.3 m -154.95 -61.48 0.12 Allowed 'General case' 0 CA--C 1.5 -0.943 0 N-CA-C 103.508 -2.775 . . . . 0.0 103.508 171.237 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 26.7 t -137.35 71.78 1.41 Allowed 'General case' 0 N--CA 1.439 -0.99 0 N-CA-C 104.184 -2.525 . . . . 0.0 104.184 178.028 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -83.45 135.85 34.52 Favored 'General case' 0 C--N 1.37 1.482 0 C-N-CA 125.311 1.444 . . . . 0.0 111.899 177.079 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.51 148.62 18.38 Favored Glycine 0 C--N 1.362 2.002 0 N-CA-C 106.686 -2.566 . . . . 0.0 106.686 164.558 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.98 118.5 4.51 Favored 'General case' 0 CA--C 1.496 -1.099 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 -170.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -122.28 147.15 46.58 Favored 'General case' 0 CA--C 1.495 -1.138 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -179.382 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.5 t -123.05 107.93 12.33 Favored 'General case' 0 CA--C 1.508 -0.639 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 177.763 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.2 mmm -119.54 123.69 44.57 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 104.755 -2.313 . . . . 0.0 104.755 177.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.2 m-80 78.08 -84.35 0.02 OUTLIER 'General case' 0 C--N 1.382 1.983 0 C-N-CA 127.645 2.378 . . . . 0.0 110.904 177.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.67 55.92 0.16 Allowed Glycine 0 N--CA 1.433 -1.51 0 N-CA-C 104.808 -3.317 . . . . 0.0 104.808 168.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -152.91 152.18 31.2 Favored 'General case' 0 C--N 1.363 1.178 0 N-CA-C 105.693 -1.965 . . . . 0.0 105.693 178.414 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.5 t -104.93 138.36 41.29 Favored 'General case' 0 C--N 1.356 0.865 0 C-N-CA 127.122 2.169 . . . . 0.0 108.882 -166.73 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.438 ' HG2' HG23 ' A' ' 2' ' ' ILE . 52.3 mtmt -115.56 145.85 42.28 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 125.814 1.646 . . . . 0.0 107.227 169.769 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.7 m -114.42 148.51 37.61 Favored 'General case' 0 C--N 1.357 0.905 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 169.747 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -139.69 155.28 47.47 Favored 'General case' 0 N--CA 1.433 -1.312 0 N-CA-C 105.706 -1.961 . . . . 0.0 105.706 -174.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -111.38 111.61 22.77 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 126.42 1.888 . . . . 0.0 107.142 -176.375 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -117.37 165.96 12.88 Favored 'General case' 0 C--N 1.356 0.858 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 176.934 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.379 0 CA-C-N 116.027 -0.533 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 5.8 t . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 122.064 0.935 . . . . 0.0 109.973 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 50.8 mt -121.63 117.16 51.67 Favored 'Isoleucine or valine' 0 C--N 1.36 1.046 0 N-CA-C 103.372 -2.825 . . . . 0.0 103.372 174.433 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 35.8 pt -101.9 -174.08 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.345 0 C-N-CA 125.435 1.494 . . . . 0.0 108.773 177.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 70.0 m-80 -135.01 86.6 2.27 Favored 'General case' 0 C--N 1.361 1.1 0 N-CA-C 107.058 -1.46 . . . . 0.0 107.058 -179.198 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 15.2 t -127.69 124.72 63.88 Favored 'Isoleucine or valine' 0 C--N 1.362 1.119 0 N-CA-C 103.573 -2.751 . . . . 0.0 103.573 170.687 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -85.69 129.76 34.74 Favored 'General case' 0 C--N 1.364 1.237 0 C-N-CA 126.191 1.796 . . . . 0.0 109.521 -171.824 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.4 p -138.36 -175.72 4.21 Favored 'General case' 0 C--N 1.358 0.954 0 C-N-CA 123.36 0.664 . . . . 0.0 109.607 -160.561 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.4 t -153.79 26.02 0.5 Allowed 'General case' 0 C--N 1.359 0.982 0 N-CA-C 105.585 -2.005 . . . . 0.0 105.585 164.938 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.5 p -173.87 150.55 1.69 Allowed Pre-proline 0 C--N 1.363 1.162 0 C-N-CA 124.604 1.162 . . . . 0.0 108.241 -171.525 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -68.54 -17.84 43.27 Favored 'Trans proline' 0 C--N 1.36 1.16 1 C-N-CA 125.331 4.021 . . . . 0.0 115.444 164.217 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -75.26 -20.74 59.02 Favored 'General case' 0 C--N 1.37 1.46 0 C-N-CA 127.015 2.126 . . . . 0.0 114.148 171.713 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -88.95 1.55 55.28 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.239 2.216 . . . . 0.0 110.541 173.878 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 52.5 t -117.44 -12.27 10.44 Favored 'General case' 0 C--N 1.361 1.088 0 C-N-CA 127.616 2.366 . . . . 0.0 108.785 177.264 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.4 m -86.02 -4.75 59.24 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 125.934 1.694 . . . . 0.0 111.831 174.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.18 -56.79 1.19 Allowed Pre-proline 0 C--N 1.359 1.016 0 C-N-CA 127.382 2.273 . . . . 0.0 112.634 167.797 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -70.86 -41.62 2.77 Favored 'Trans proline' 0 C--N 1.363 1.316 0 C-N-CA 124.88 3.72 . . . . 0.0 113.587 176.981 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.6 m -70.71 -29.66 66.0 Favored 'General case' 0 C--N 1.366 1.29 0 C-N-CA 127.757 2.423 . . . . 0.0 114.593 -178.059 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -88.12 -6.64 57.79 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 124.623 1.169 . . . . 0.0 113.332 171.591 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -88.68 -21.11 24.08 Favored 'General case' 0 C--N 1.361 1.075 0 C-N-CA 125.723 1.609 . . . . 0.0 111.068 166.347 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 38.3 mt -92.39 -65.65 0.99 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 127.525 2.33 . . . . 0.0 111.26 178.321 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -97.69 -5.62 34.83 Favored 'General case' 0 C--N 1.363 1.167 0 C-N-CA 127.964 2.506 . . . . 0.0 112.26 -167.611 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.26 -79.33 0.52 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.027 1.298 . . . . 0.0 113.891 164.331 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 9.8 t -152.93 -7.53 0.18 Allowed 'General case' 0 C--N 1.353 0.75 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 -175.345 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.2 68.02 0.71 Allowed 'General case' 0 C--N 1.366 1.3 0 C-N-CA 127.014 2.126 . . . . 0.0 105.528 174.769 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.1 126.62 47.41 Favored 'General case' 0 C--N 1.359 1.016 0 C-N-CA 125.806 1.642 . . . . 0.0 106.87 -176.599 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.473 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -101.24 85.37 0.56 Allowed Glycine 0 C--N 1.361 1.969 0 N-CA-C 107.265 -2.334 . . . . 0.0 107.265 170.411 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.9 113.02 24.95 Favored 'General case' 0 C--N 1.359 1.005 0 C-N-CA 125.253 1.421 . . . . 0.0 109.539 -171.963 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -122.08 143.15 49.69 Favored 'General case' 0 CA--C 1.497 -1.06 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 -171.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -143.7 115.63 8.31 Favored 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 106.5 -1.667 . . . . 0.0 106.5 -177.028 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.3 mmt -121.0 127.41 51.74 Favored 'General case' 0 C--N 1.36 1.062 0 N-CA-C 104.906 -2.257 . . . . 0.0 104.906 -176.164 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.3 m-80 79.72 -85.17 0.02 OUTLIER 'General case' 0 C--N 1.381 1.976 0 C-N-CA 127.544 2.337 . . . . 0.0 110.571 175.386 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -169.44 51.91 0.21 Allowed Glycine 0 N--CA 1.434 -1.464 0 N-CA-C 106.635 -2.586 . . . . 0.0 106.635 169.717 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -151.61 148.83 28.44 Favored 'General case' 0 C--N 1.369 1.426 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.009 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.3 t -105.1 154.05 20.68 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 128.022 2.529 . . . . 0.0 109.963 -163.44 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -138.21 137.06 37.2 Favored 'General case' 0 C--N 1.359 1.004 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 178.713 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 57.7 m -120.65 124.42 45.18 Favored 'General case' 0 C--N 1.359 0.988 0 C-N-CA 124.355 1.062 . . . . 0.0 108.179 178.353 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.2 m-85 -124.54 -158.78 0.84 Allowed 'General case' 0 N--CA 1.436 -1.15 0 N-CA-C 105.702 -1.962 . . . . 0.0 105.702 -179.329 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -132.09 95.76 3.75 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 106.194 -1.78 . . . . 0.0 106.194 -179.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.473 HD22 ' HA3' ' A' ' 26' ' ' GLY . 70.1 m-80 -139.85 93.42 2.65 Favored 'General case' 0 C--N 1.356 0.875 0 N-CA-C 104.807 -2.294 . . . . 0.0 104.807 174.407 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.384 0 CA-C-N 116.038 -0.528 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 86.8 m . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 41.9 mt -120.35 116.92 51.68 Favored 'Isoleucine or valine' 0 C--N 1.361 1.083 0 N-CA-C 104.199 -2.519 . . . . 0.0 104.199 178.853 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 34.3 pt -101.12 179.52 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.367 1.335 0 C-N-CA 125.419 1.488 . . . . 0.0 110.236 -178.757 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -119.81 73.89 0.99 Allowed 'General case' 0 C--N 1.361 1.088 0 C-N-CA 125.412 1.485 . . . . 0.0 108.546 -172.379 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.5 t -130.57 126.39 60.59 Favored 'Isoleucine or valine' 0 C--N 1.362 1.146 0 N-CA-C 105.521 -2.029 . . . . 0.0 105.521 175.289 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -83.58 138.18 33.5 Favored 'General case' 0 C--N 1.366 1.325 0 C-N-CA 127.131 2.172 . . . . 0.0 109.611 179.847 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -143.26 -177.75 5.52 Favored 'General case' 0 C--N 1.359 1.006 0 CA-C-O 121.735 0.779 . . . . 0.0 109.844 -165.957 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.9 t -149.08 18.73 0.97 Allowed 'General case' 0 C--N 1.356 0.876 0 C-N-CA 126.06 1.744 . . . . 0.0 106.495 168.566 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 51.9 p -173.67 155.52 2.57 Favored Pre-proline 0 C--N 1.364 1.236 0 C-N-CA 124.673 1.189 . . . . 0.0 108.292 -171.933 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -69.68 -18.59 37.29 Favored 'Trans proline' 0 C--N 1.362 1.24 1 C-N-CA 125.41 4.073 . . . . 0.0 115.025 163.767 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -79.26 -11.22 59.95 Favored 'General case' 0 C--N 1.369 1.431 0 C-N-CA 126.999 2.12 . . . . 0.0 114.768 173.416 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -94.02 -4.79 48.9 Favored 'General case' 0 C--N 1.368 1.411 0 C-N-CA 127.902 2.481 . . . . 0.0 109.974 171.791 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.3 t -111.69 -14.45 13.61 Favored 'General case' 0 C--N 1.361 1.08 0 C-N-CA 127.468 2.307 . . . . 0.0 108.65 179.605 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 70.9 m -84.79 -1.19 56.04 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 126.655 1.982 . . . . 0.0 110.753 173.038 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 68.0 mmtt -81.77 -57.47 0.52 Allowed Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 129.056 2.942 . . . . 0.0 110.928 172.17 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.33 -45.37 1.85 Allowed 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 124.876 3.717 . . . . 0.0 113.68 172.011 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -68.88 -29.42 67.71 Favored 'General case' 0 C--N 1.366 1.309 0 C-N-CA 127.416 2.286 . . . . 0.0 115.081 -175.158 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -88.04 -10.83 49.05 Favored 'General case' 0 C--N 1.372 1.557 0 C-N-CA 124.436 1.094 . . . . 0.0 113.429 172.641 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -85.98 -21.22 27.96 Favored 'General case' 0 C--N 1.364 1.222 0 C-N-CA 125.858 1.663 . . . . 0.0 112.086 166.375 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 54.0 mt -94.97 -69.05 0.77 Allowed 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.307 2.243 . . . . 0.0 110.942 -178.882 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -91.4 -27.83 18.07 Favored 'General case' 0 C--N 1.363 1.153 0 C-N-CA 128.035 2.534 . . . . 0.0 111.856 -167.97 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 107.75 -171.02 15.83 Favored Glycine 0 C--N 1.362 1.997 0 N-CA-C 108.922 -1.671 . . . . 0.0 108.922 179.417 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 39.1 m -71.8 -4.88 30.32 Favored 'General case' 0 C--N 1.362 1.134 0 C-N-CA 128.003 2.521 . . . . 0.0 115.571 -174.897 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.3 t -108.65 64.08 0.61 Allowed 'General case' 0 C--N 1.363 1.193 0 C-N-CA 127.059 2.144 . . . . 0.0 106.411 168.359 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.62 143.35 43.95 Favored 'General case' 0 C--N 1.364 1.205 0 C-N-CA 126.399 1.879 . . . . 0.0 106.924 176.557 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -102.71 85.49 0.52 Allowed Glycine 0 C--N 1.361 1.927 0 N-CA-C 107.559 -2.216 . . . . 0.0 107.559 171.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.55 111.07 23.06 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 125.246 1.418 . . . . 0.0 109.037 -173.368 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 84.0 mttt -123.14 141.92 51.45 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 104.181 -2.525 . . . . 0.0 104.181 -171.111 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -139.82 109.25 6.19 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 -175.662 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -110.15 123.54 49.93 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 127.071 2.148 . . . . 0.0 106.122 -176.862 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.7 m120 78.54 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.381 1.938 0 C-N-CA 127.554 2.342 . . . . 0.0 111.05 177.076 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.03 49.77 0.25 Allowed Glycine 0 N--CA 1.435 -1.407 0 N-CA-C 106.883 -2.487 . . . . 0.0 106.883 170.352 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 9.2 mtpm? -150.52 147.99 28.16 Favored 'General case' 0 C--N 1.367 1.362 0 N-CA-C 106.802 -1.555 . . . . 0.0 106.802 175.308 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.1 t -104.94 151.74 23.53 Favored 'General case' 0 C--N 1.362 1.12 0 C-N-CA 127.842 2.457 . . . . 0.0 110.506 -161.97 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -134.34 139.43 45.64 Favored 'General case' 0 C--N 1.361 1.083 0 C-N-CA 126.726 2.01 . . . . 0.0 106.241 177.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.8 m -121.78 125.77 47.3 Favored 'General case' 0 C--N 1.359 1.017 0 C-N-CA 124.375 1.07 . . . . 0.0 108.576 176.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -126.1 -163.68 1.24 Allowed 'General case' 0 N--CA 1.435 -1.224 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.282 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 61.1 m-80 -132.67 69.6 1.48 Allowed 'General case' 0 C--N 1.36 1.054 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -179.642 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -90.15 -84.74 0.23 Allowed 'General case' 0 C--N 1.359 1.005 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 176.877 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.411 0 O-C-N 123.048 0.218 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 122.073 0.94 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 3.9 mp -124.75 116.47 47.46 Favored 'Isoleucine or valine' 0 C--N 1.36 1.051 0 N-CA-C 103.062 -2.94 . . . . 0.0 103.062 173.894 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 38.7 pt -99.87 -179.99 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 125.945 1.698 . . . . 0.0 110.38 -176.071 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -123.36 70.9 1.05 Allowed 'General case' 0 C--N 1.363 1.165 0 C-N-CA 125.021 1.328 . . . . 0.0 108.422 -173.17 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.437 HG11 ' HG3' ' A' ' 16' ' ' PRO . 11.7 t -128.63 132.71 67.57 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.154 0 N-CA-C 103.607 -2.738 . . . . 0.0 103.607 173.682 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -84.66 140.99 30.93 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 125.869 1.668 . . . . 0.0 109.425 -174.999 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 22.5 p -147.07 160.76 42.02 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 121.656 0.741 . . . . 0.0 109.289 -169.379 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.3 t -133.13 -0.29 3.36 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 126.589 1.956 . . . . 0.0 108.171 169.994 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 79.8 p -152.55 157.36 33.59 Favored Pre-proline 0 C--N 1.364 1.205 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -176.087 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -71.99 -16.16 29.1 Favored 'Trans proline' 0 C--N 1.359 1.095 0 C-N-CA 124.418 3.412 . . . . 0.0 114.702 169.446 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -83.0 -1.71 53.35 Favored 'General case' 0 C--N 1.369 1.453 0 C-N-CA 126.595 1.958 . . . . 0.0 114.579 170.788 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.3 tp60 -99.71 -0.77 39.42 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.773 2.429 . . . . 0.0 109.627 171.492 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.9 t -124.34 -14.71 6.89 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.89 2.076 . . . . 0.0 108.439 -173.079 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 78.4 p -87.92 3.13 49.71 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 125.44 1.496 . . . . 0.0 110.927 173.278 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -77.49 -59.2 0.86 Allowed Pre-proline 0 C--N 1.359 1.001 0 C-N-CA 129.757 3.223 . . . . 0.0 111.419 169.786 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.437 ' HG3' HG11 ' A' ' 5' ' ' VAL . 74.2 Cg_endo -71.23 -38.42 4.85 Favored 'Trans proline' 0 C--N 1.364 1.357 0 C-N-CA 125.121 3.881 . . . . 0.0 113.878 174.156 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -71.68 -29.07 64.19 Favored 'General case' 0 C--N 1.366 1.326 0 C-N-CA 127.647 2.379 . . . . 0.0 114.46 -176.938 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -88.04 -9.0 54.77 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 125.148 1.379 . . . . 0.0 113.135 170.339 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -86.51 -20.53 27.9 Favored 'General case' 0 C--N 1.361 1.077 0 C-N-CA 125.632 1.573 . . . . 0.0 111.489 166.498 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 33.4 mt -92.78 -66.63 0.91 Allowed 'General case' 0 C--N 1.366 1.287 0 C-N-CA 127.704 2.402 . . . . 0.0 110.962 177.962 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 96.6 m-85 -95.84 -8.91 32.87 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 127.972 2.509 . . . . 0.0 112.175 -167.383 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.99 -79.83 0.54 Allowed Glycine 0 C--N 1.364 2.087 0 C-N-CA 125.289 1.423 . . . . 0.0 113.46 165.125 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.7 m -148.1 -6.29 0.44 Allowed 'General case' 0 C--N 1.353 0.749 0 C-N-CA 126.064 1.746 . . . . 0.0 106.929 -175.568 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.6 t -107.02 63.81 0.63 Allowed 'General case' 0 C--N 1.366 1.286 0 C-N-CA 126.948 2.099 . . . . 0.0 106.212 177.552 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.73 140.23 52.55 Favored 'General case' 0 C--N 1.359 1.015 0 C-N-CA 125.973 1.709 . . . . 0.0 106.732 -176.875 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -83.79 -76.07 1.17 Allowed Glycine 0 C--N 1.361 1.962 0 C-N-CA 126.316 1.913 . . . . 0.0 110.943 172.373 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . 84.97 98.9 0.04 OUTLIER 'General case' 0 C--N 1.367 1.336 0 C-N-CA 126.823 2.049 . . . . 0.0 110.984 169.024 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -125.44 141.37 52.09 Favored 'General case' 0 CA--C 1.493 -1.237 0 N-CA-C 105.409 -2.071 . . . . 0.0 105.409 -171.552 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 42.4 t -116.24 124.8 51.12 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 107.378 -1.342 . . . . 0.0 107.378 -176.171 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.2 mtp -109.34 72.17 0.8 Allowed 'General case' 0 C--N 1.36 1.058 0 N-CA-C 104.43 -2.433 . . . . 0.0 104.43 170.302 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -5.39 72.33 0.0 OUTLIER 'General case' 0 C--N 1.377 1.782 1 C-N-CA 134.63 5.172 . . . . 0.0 118.749 -171.8 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 155.76 -38.05 0.61 Allowed Glycine 0 C--N 1.354 1.536 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -166.185 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -154.05 157.68 39.38 Favored 'General case' 0 C--N 1.37 1.472 0 CA-C-N 119.45 1.625 . . . . 0.0 108.419 -175.833 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.7 t -107.26 154.62 20.98 Favored 'General case' 0 C--N 1.361 1.086 0 C-N-CA 128.66 2.784 . . . . 0.0 109.56 -166.156 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -129.82 147.49 51.6 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.733 2.013 . . . . 0.0 106.444 173.902 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 64.5 m -123.14 122.34 38.21 Favored 'General case' 0 C--N 1.359 0.999 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 175.207 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -115.65 -177.73 3.22 Favored 'General case' 0 N--CA 1.44 -0.934 0 C-N-CA 126.541 1.936 . . . . 0.0 106.141 177.383 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -122.56 96.35 5.0 Favored 'General case' 0 C--N 1.359 0.99 0 N-CA-C 106.156 -1.794 . . . . 0.0 106.156 -177.332 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -134.74 96.83 3.63 Favored 'General case' 0 C--N 1.356 0.889 0 N-CA-C 105.725 -1.954 . . . . 0.0 105.725 178.612 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.408 0 CA-C-N 116.097 -0.501 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.8 t . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 53.2 mt -125.61 119.36 54.8 Favored 'Isoleucine or valine' 0 C--N 1.366 1.298 0 N-CA-C 103.116 -2.92 . . . . 0.0 103.116 176.398 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 46.4 pt -106.06 -172.63 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.276 0 C-N-CA 125.129 1.372 . . . . 0.0 109.25 178.873 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -135.04 77.49 1.68 Allowed 'General case' 0 C--N 1.361 1.093 0 C-N-CA 124.325 1.05 . . . . 0.0 108.207 -177.23 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 25.4 t -121.06 122.52 67.83 Favored 'Isoleucine or valine' 0 C--N 1.361 1.071 0 N-CA-C 103.891 -2.633 . . . . 0.0 103.891 172.205 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 45.1 mmtm -80.9 133.98 35.65 Favored 'General case' 0 C--N 1.366 1.284 0 C-N-CA 126.757 2.023 . . . . 0.0 110.185 -172.733 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 18.7 p -145.16 -176.64 5.18 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 121.399 0.618 . . . . 0.0 110.252 -162.634 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.6 t -155.0 26.25 0.43 Allowed 'General case' 0 C--N 1.358 0.971 0 N-CA-C 105.538 -2.023 . . . . 0.0 105.538 165.428 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 59.7 p -173.63 149.87 1.67 Allowed Pre-proline 0 C--N 1.364 1.23 0 C-N-CA 124.498 1.119 . . . . 0.0 108.369 -170.751 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -68.69 -16.62 42.3 Favored 'Trans proline' 0 C--N 1.362 1.245 1 C-N-CA 125.505 4.137 . . . . 0.0 115.29 165.479 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.01 7.98 28.7 Favored 'General case' 0 C--N 1.369 1.443 0 C-N-CA 126.128 1.771 . . . . 0.0 113.824 171.006 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -113.06 27.75 9.36 Favored 'General case' 0 C--N 1.367 1.362 0 C-N-CA 127.09 2.156 . . . . 0.0 107.127 166.417 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 50.6 t -148.12 -19.63 0.34 Allowed 'General case' 0 C--N 1.357 0.913 0 C-N-CA 125.688 1.595 . . . . 0.0 110.189 -175.111 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 57.6 p -85.99 0.85 52.25 Favored 'General case' 0 C--N 1.369 1.424 0 CA-C-N 121.527 1.967 . . . . 0.0 111.476 175.968 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 6.0 mptp? -81.31 -56.49 0.6 Allowed Pre-proline 0 C--N 1.358 0.971 0 C-N-CA 129.124 2.97 . . . . 0.0 110.807 170.438 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -69.1 -42.13 4.4 Favored 'Trans proline' 0 C--N 1.368 1.596 0 C-N-CA 124.964 3.776 . . . . 0.0 113.725 173.08 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.0 m -68.08 -31.61 71.35 Favored 'General case' 0 C--N 1.367 1.359 0 C-N-CA 127.81 2.444 . . . . 0.0 115.188 -177.873 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 56.5 mtpt -88.06 -8.03 56.13 Favored 'General case' 0 C--N 1.37 1.479 0 C-N-CA 124.986 1.314 . . . . 0.0 112.92 172.928 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -87.84 -20.48 25.99 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 125.679 1.592 . . . . 0.0 111.374 166.508 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 43.9 mt -92.85 -66.48 0.92 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 127.54 2.336 . . . . 0.0 111.116 178.706 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 93.4 m-85 -96.15 -10.26 28.64 Favored 'General case' 0 C--N 1.363 1.156 0 C-N-CA 127.908 2.483 . . . . 0.0 111.999 -168.197 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.39 -79.94 0.46 Allowed Glycine 0 C--N 1.364 2.086 0 C-N-CA 125.011 1.291 . . . . 0.0 113.672 164.685 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.7 m -146.52 -10.63 0.47 Allowed 'General case' 0 C--N 1.355 0.806 0 C-N-CA 125.851 1.661 . . . . 0.0 107.266 -174.14 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.5 t -107.07 69.49 0.76 Allowed 'General case' 0 C--N 1.365 1.249 0 C-N-CA 126.88 2.072 . . . . 0.0 105.681 176.509 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.89 125.44 41.6 Favored 'General case' 0 C--N 1.361 1.085 0 C-N-CA 125.695 1.598 . . . . 0.0 106.826 -174.768 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.64 87.42 0.57 Allowed Glycine 0 C--N 1.362 2.0 0 N-CA-C 107.276 -2.33 . . . . 0.0 107.276 170.698 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.79 113.54 25.84 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.238 1.415 . . . . 0.0 109.667 -172.236 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -124.43 146.39 48.94 Favored 'General case' 0 CA--C 1.489 -1.381 0 N-CA-C 103.963 -2.606 . . . . 0.0 103.963 -172.577 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -146.45 116.1 7.19 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 106.439 -1.689 . . . . 0.0 106.439 -175.912 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 68.9 mtt -121.11 126.39 49.65 Favored 'General case' 0 C--N 1.361 1.074 0 N-CA-C 105.088 -2.189 . . . . 0.0 105.088 -176.04 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 79.33 -85.25 0.02 OUTLIER 'General case' 0 C--N 1.381 1.971 0 C-N-CA 127.505 2.322 . . . . 0.0 110.906 173.946 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.88 50.65 0.25 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 107.388 -2.285 . . . . 0.0 107.388 171.105 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -151.99 150.61 30.19 Favored 'General case' 0 C--N 1.368 1.39 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 169.846 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 43.2 t -105.0 151.96 23.3 Favored 'General case' 0 C--N 1.36 1.029 0 C-N-CA 128.499 2.72 . . . . 0.0 109.644 -165.305 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -135.4 137.63 42.48 Favored 'General case' 0 N--CA 1.44 -0.96 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 179.013 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.6 m -124.68 110.65 14.64 Favored 'General case' 0 C--N 1.358 0.966 0 C-N-CA 124.465 1.106 . . . . 0.0 108.437 -179.321 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -108.36 -160.73 0.74 Allowed 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 127.431 2.292 . . . . 0.0 107.189 179.713 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 56.7 m-80 -130.19 98.55 4.76 Favored 'General case' 0 C--N 1.359 1.003 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -135.34 -98.18 0.24 Allowed 'General case' 0 C--N 1.357 0.925 0 N-CA-C 105.325 -2.102 . . . . 0.0 105.325 175.248 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.395 0 CA-C-N 117.847 0.294 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 41.3 p . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 56.0 mt -104.97 128.1 59.0 Favored 'Isoleucine or valine' 0 C--N 1.364 1.204 0 C-N-CA 125.631 1.572 . . . . 0.0 107.019 -170.327 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 44.1 pt -106.28 -173.21 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.362 1.133 0 C-N-CA 126.229 1.811 . . . . 0.0 109.74 -175.478 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 35.8 m120 -130.96 79.95 1.92 Allowed 'General case' 0 C--N 1.362 1.112 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 -175.971 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.9 t -129.8 127.07 63.65 Favored 'Isoleucine or valine' 0 C--N 1.36 1.048 0 N-CA-C 103.851 -2.648 . . . . 0.0 103.851 173.615 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mmmm -80.83 131.8 35.42 Favored 'General case' 0 C--N 1.366 1.312 0 C-N-CA 126.133 1.773 . . . . 0.0 110.155 -176.515 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.9 p -141.28 171.08 14.56 Favored 'General case' 0 C--N 1.359 1.0 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -166.316 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.5 t -151.77 22.37 0.69 Allowed 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.88 -1.896 . . . . 0.0 105.88 174.194 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.6 p -171.09 149.23 2.63 Favored Pre-proline 0 C--N 1.36 1.06 0 N-CA-C 105.378 -2.082 . . . . 0.0 105.378 -174.781 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -71.84 -15.37 29.8 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 124.22 3.28 . . . . 0.0 114.747 168.685 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 49.3 tptt -79.3 -11.75 59.94 Favored 'General case' 0 C--N 1.371 1.508 0 C-N-CA 127.231 2.212 . . . . 0.0 114.323 171.525 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 11.5 tp-100 -89.77 -5.17 57.22 Favored 'General case' 0 C--N 1.372 1.578 0 C-N-CA 127.335 2.254 . . . . 0.0 110.178 171.357 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 45.0 t -118.19 -11.78 10.07 Favored 'General case' 0 C--N 1.359 0.984 0 C-N-CA 127.162 2.185 . . . . 0.0 108.592 -176.685 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.1 m -88.0 1.26 54.58 Favored 'General case' 0 C--N 1.37 1.464 0 C-N-CA 126.497 1.919 . . . . 0.0 110.38 171.569 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -80.93 -58.03 0.54 Allowed Pre-proline 0 C--N 1.356 0.89 0 C-N-CA 129.121 2.969 . . . . 0.0 111.301 170.998 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -72.04 -39.44 3.15 Favored 'Trans proline' 0 C--N 1.364 1.377 0 C-N-CA 125.072 3.848 . . . . 0.0 113.582 173.883 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 60.8 m -73.16 -22.69 60.45 Favored 'General case' 0 C--N 1.367 1.366 0 C-N-CA 127.185 2.194 . . . . 0.0 114.571 -179.427 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 69.0 mttm -88.14 -9.73 52.26 Favored 'General case' 0 C--N 1.374 1.633 0 CA-C-N 120.455 1.48 . . . . 0.0 114.068 166.141 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -87.39 -19.36 28.21 Favored 'General case' 0 C--N 1.359 1.02 0 C-N-CA 125.663 1.585 . . . . 0.0 111.334 168.337 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 37.6 mt -98.69 -71.33 0.69 Allowed 'General case' 0 C--N 1.365 1.25 0 C-N-CA 127.539 2.336 . . . . 0.0 110.221 178.27 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.5 m-85 -106.42 42.43 1.28 Allowed 'General case' 0 C--N 1.361 1.072 0 C-N-CA 128.655 2.782 . . . . 0.0 109.955 -169.781 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -79.47 89.04 1.22 Allowed Glycine 0 C--N 1.365 2.171 0 C-N-CA 126.488 1.994 . . . . 0.0 115.939 -169.078 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 23.0 t -168.06 -61.37 0.02 OUTLIER 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 103.275 -2.861 . . . . 0.0 103.275 174.308 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 23.0 t -137.28 70.33 1.4 Allowed 'General case' 0 N--CA 1.438 -1.028 0 N-CA-C 104.657 -2.349 . . . . 0.0 104.657 179.352 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.61 138.93 31.83 Favored 'General case' 0 C--N 1.369 1.418 0 C-N-CA 125.532 1.533 . . . . 0.0 111.606 177.261 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -106.31 152.66 17.04 Favored Glycine 0 C--N 1.359 1.858 0 N-CA-C 105.893 -2.883 . . . . 0.0 105.893 165.568 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -156.31 121.96 4.86 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 105.108 -2.182 . . . . 0.0 105.108 -171.407 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.3 mmtt -124.73 141.27 52.22 Favored 'General case' 0 C--N 1.361 1.071 0 N-CA-C 105.66 -1.978 . . . . 0.0 105.66 -179.128 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.2 t -117.56 103.37 10.0 Favored 'General case' 0 C--N 1.352 0.71 0 N-CA-C 105.854 -1.906 . . . . 0.0 105.854 178.913 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.6 mmt -108.84 121.61 45.46 Favored 'General case' 0 C--N 1.36 1.034 0 N-CA-C 105.319 -2.104 . . . . 0.0 105.319 178.857 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.466 3.6 p-10 68.66 -78.06 0.05 OUTLIER 'General case' 0 C--N 1.38 1.905 0 C-N-CA 128.718 2.807 . . . . 0.0 113.95 -177.842 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -174.28 54.46 0.14 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 105.407 -3.077 . . . . 0.0 105.407 170.664 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 51.4 mttm -153.92 152.12 30.24 Favored 'General case' 0 C--N 1.361 1.107 0 N-CA-C 105.219 -2.141 . . . . 0.0 105.219 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.2 t -104.99 141.32 36.78 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 126.637 1.975 . . . . 0.0 109.435 -164.016 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.7 mtpp -119.86 147.04 45.17 Favored 'General case' 0 CA--C 1.499 -0.989 0 C-N-CA 126.571 1.948 . . . . 0.0 106.27 172.486 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.3 m -116.33 143.47 45.5 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.329 -1.36 . . . . 0.0 107.329 172.01 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -133.34 152.76 51.94 Favored 'General case' 0 N--CA 1.434 -1.233 0 N-CA-C 105.52 -2.03 . . . . 0.0 105.52 -174.617 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -113.14 102.8 10.73 Favored 'General case' 0 C--N 1.361 1.07 0 C-N-CA 126.361 1.865 . . . . 0.0 106.592 -175.989 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 36.1 m120 -102.26 160.0 14.91 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 106.814 -1.551 . . . . 0.0 106.814 177.8 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.362 0 CA-C-N 115.817 -0.629 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 94.1 m . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 107.046 -1.464 . . . . 0.0 107.046 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 26.3 mt -126.49 125.84 68.0 Favored 'Isoleucine or valine' 0 C--N 1.361 1.105 0 N-CA-C 103.566 -2.753 . . . . 0.0 103.566 174.248 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.2 pt -102.41 -170.53 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 125.966 1.707 . . . . 0.0 109.429 -179.939 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.3 p30 -134.98 76.6 1.63 Allowed 'General case' 0 C--N 1.36 1.056 0 C-N-CA 124.333 1.053 . . . . 0.0 108.378 -175.48 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.435 HG11 ' HG3' ' A' ' 16' ' ' PRO . 7.0 t -129.59 133.26 65.42 Favored 'Isoleucine or valine' 0 C--N 1.362 1.132 0 N-CA-C 103.938 -2.615 . . . . 0.0 103.938 173.301 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -81.75 134.75 35.48 Favored 'General case' 0 C--N 1.365 1.254 0 C-N-CA 125.847 1.659 . . . . 0.0 110.447 -177.041 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 31.7 p -140.25 -178.98 5.73 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 -169.227 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 55.4 m -154.93 -53.36 0.09 Allowed 'General case' 0 N--CA 1.432 -1.366 0 N-CA-C 100.969 -3.715 . . . . 0.0 100.969 -163.057 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 87.6 p -111.25 161.91 23.17 Favored Pre-proline 0 C--N 1.362 1.112 0 C-N-CA 127.647 2.379 . . . . 0.0 108.661 177.893 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_exo -71.88 -16.2 29.45 Favored 'Trans proline' 0 C--N 1.357 0.979 0 C-N-CA 124.468 3.446 . . . . 0.0 114.535 165.803 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.9 tptp -74.73 -17.05 60.71 Favored 'General case' 0 C--N 1.371 1.542 0 C-N-CA 127.759 2.424 . . . . 0.0 114.146 168.941 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -88.85 -2.93 58.83 Favored 'General case' 0 C--N 1.37 1.496 0 C-N-CA 127.649 2.38 . . . . 0.0 110.485 174.864 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.5 t -118.93 -12.45 9.56 Favored 'General case' 0 C--N 1.36 1.034 0 C-N-CA 128.068 2.547 . . . . 0.0 108.207 179.697 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 66.3 m -86.2 -0.78 56.52 Favored 'General case' 0 C--N 1.371 1.536 0 C-N-CA 126.317 1.847 . . . . 0.0 111.06 172.867 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 55.2 mttp -77.87 -58.06 0.92 Allowed Pre-proline 0 C--N 1.357 0.917 0 C-N-CA 129.193 2.997 . . . . 0.0 111.795 170.817 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.435 ' HG3' HG11 ' A' ' 5' ' ' VAL . 74.5 Cg_endo -72.08 -37.7 4.53 Favored 'Trans proline' 0 C--N 1.363 1.309 0 C-N-CA 125.111 3.874 . . . . 0.0 113.886 174.496 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 58.8 m -70.54 -27.6 64.28 Favored 'General case' 0 C--N 1.368 1.372 0 C-N-CA 127.309 2.244 . . . . 0.0 114.298 -179.531 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.0 mttp -88.04 -8.94 54.85 Favored 'General case' 0 C--N 1.371 1.534 0 C-N-CA 125.341 1.456 . . . . 0.0 113.141 170.236 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -87.44 -19.58 27.84 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.791 1.636 . . . . 0.0 111.357 167.182 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.7 mt -95.11 -67.35 0.86 Allowed 'General case' 0 C--N 1.365 1.252 0 C-N-CA 127.696 2.398 . . . . 0.0 110.94 178.694 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -93.37 -11.21 32.84 Favored 'General case' 0 C--N 1.364 1.215 0 C-N-CA 128.198 2.599 . . . . 0.0 112.032 -168.542 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 101.19 -81.09 0.44 Allowed Glycine 0 C--N 1.364 2.131 0 C-N-CA 125.067 1.318 . . . . 0.0 113.573 164.224 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.6 m -148.46 -8.59 0.38 Allowed 'General case' 0 C--N 1.353 0.738 0 C-N-CA 125.952 1.701 . . . . 0.0 106.927 -173.81 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.2 t -108.25 63.59 0.61 Allowed 'General case' 0 C--N 1.365 1.277 0 C-N-CA 126.969 2.107 . . . . 0.0 105.386 175.391 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.16 130.73 53.15 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 125.959 1.703 . . . . 0.0 107.878 -172.916 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -101.74 153.16 18.76 Favored Glycine 0 C--N 1.359 1.829 0 N-CA-C 105.837 -2.905 . . . . 0.0 105.837 161.175 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -154.21 120.39 5.36 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 105.024 -2.213 . . . . 0.0 105.024 -171.457 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -124.7 137.65 54.34 Favored 'General case' 0 C--N 1.359 0.992 0 N-CA-C 104.667 -2.345 . . . . 0.0 104.667 -177.181 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -117.94 106.81 13.34 Favored 'General case' 0 C--N 1.35 0.613 0 N-CA-C 106.325 -1.731 . . . . 0.0 106.325 -179.443 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 84.7 mtp -111.34 121.97 46.62 Favored 'General case' 0 C--N 1.361 1.089 0 N-CA-C 105.312 -2.107 . . . . 0.0 105.312 176.69 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.467 12.0 p30 69.99 -80.8 0.04 OUTLIER 'General case' 0 C--N 1.382 1.981 0 C-N-CA 128.627 2.771 . . . . 0.0 113.704 -179.617 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -172.41 53.5 0.17 Allowed Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 105.591 -3.003 . . . . 0.0 105.591 170.686 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -152.47 150.77 29.98 Favored 'General case' 0 C--N 1.362 1.132 0 N-CA-C 105.369 -2.085 . . . . 0.0 105.369 176.891 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.2 t -104.99 144.58 31.61 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 126.746 2.018 . . . . 0.0 109.788 -162.73 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 39.2 mtpt -122.63 145.45 48.35 Favored 'General case' 0 CA--C 1.498 -1.038 0 C-N-CA 127.145 2.178 . . . . 0.0 106.119 173.544 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 85.8 m -123.84 127.64 48.34 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-O 122.25 1.024 . . . . 0.0 109.411 177.202 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -123.74 -165.77 1.39 Allowed 'General case' 0 N--CA 1.435 -1.217 0 C-N-CA 127.762 2.425 . . . . 0.0 105.383 -178.962 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -130.15 128.96 42.84 Favored 'General case' 0 C--N 1.359 0.988 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 177.839 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -111.95 86.54 2.36 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 170.833 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.417 0 CA-C-N 116.13 -0.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 81.2 p . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.75 0.786 . . . . 0.0 110.619 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 9.5 mt -127.62 124.18 62.9 Favored 'Isoleucine or valine' 0 C--N 1.36 1.05 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 174.902 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.0 pt -104.47 -171.85 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.366 1.325 0 C-N-CA 126.009 1.723 . . . . 0.0 108.936 177.686 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 74.2 m-80 -132.5 84.0 2.12 Favored 'General case' 0 C--N 1.363 1.168 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 -175.922 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.5 t -132.15 125.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.362 1.139 0 N-CA-C 104.111 -2.552 . . . . 0.0 104.111 173.519 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -76.65 137.53 39.5 Favored 'General case' 0 C--N 1.368 1.399 0 C-N-CA 127.061 2.144 . . . . 0.0 111.007 -179.238 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.7 p -145.39 178.6 7.98 Favored 'General case' 0 C--N 1.358 0.959 0 CA-C-O 121.83 0.824 . . . . 0.0 110.492 -165.506 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -149.64 19.5 0.92 Allowed 'General case' 0 C--N 1.355 0.846 0 C-N-CA 126.2 1.8 . . . . 0.0 106.65 169.526 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.1 p -172.92 155.7 3.01 Favored Pre-proline 0 C--N 1.363 1.182 0 C-N-CA 124.853 1.261 . . . . 0.0 107.975 -172.935 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -70.56 -18.44 33.22 Favored 'Trans proline' 0 C--N 1.361 1.231 0 C-N-CA 125.143 3.895 . . . . 0.0 115.181 164.273 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.6 -16.13 59.66 Favored 'General case' 0 C--N 1.37 1.478 0 C-N-CA 127.013 2.125 . . . . 0.0 114.374 172.474 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 43.5 tp60 -89.53 -4.01 58.09 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.614 2.366 . . . . 0.0 110.186 172.996 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -114.09 -13.1 12.47 Favored 'General case' 0 C--N 1.361 1.074 0 C-N-CA 127.737 2.415 . . . . 0.0 108.982 178.762 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 54.2 m -85.73 -4.12 59.08 Favored 'General case' 0 C--N 1.37 1.49 0 C-N-CA 126.173 1.789 . . . . 0.0 111.026 174.997 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -78.02 -57.29 0.96 Allowed Pre-proline 0 N--CA 1.441 -0.892 0 C-N-CA 129.393 3.077 . . . . 0.0 112.092 170.795 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -70.59 -41.31 3.31 Favored 'Trans proline' 0 C--N 1.364 1.38 0 C-N-CA 125.248 3.965 . . . . 0.0 113.943 173.711 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.3 m -70.16 -27.83 64.84 Favored 'General case' 0 C--N 1.369 1.434 0 C-N-CA 127.313 2.245 . . . . 0.0 114.838 -177.86 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -87.99 -10.5 50.2 Favored 'General case' 0 C--N 1.371 1.519 0 C-N-CA 124.865 1.266 . . . . 0.0 113.101 170.781 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 15.5 tp10 -85.96 -19.75 29.97 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 125.639 1.576 . . . . 0.0 111.539 167.365 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 39.2 mt -93.7 -66.65 0.91 Allowed 'General case' 0 C--N 1.365 1.268 0 C-N-CA 127.645 2.378 . . . . 0.0 111.013 177.758 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -96.91 -8.21 31.37 Favored 'General case' 0 C--N 1.363 1.162 0 C-N-CA 127.643 2.377 . . . . 0.0 112.326 -167.126 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 99.84 -80.99 0.51 Allowed Glycine 0 C--N 1.364 2.11 0 C-N-CA 125.015 1.293 . . . . 0.0 113.529 165.308 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.5 m -147.66 -8.67 0.42 Allowed 'General case' 0 C--N 1.354 0.782 0 C-N-CA 125.927 1.691 . . . . 0.0 107.153 -174.81 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -107.13 68.0 0.71 Allowed 'General case' 0 C--N 1.366 1.294 0 C-N-CA 126.934 2.093 . . . . 0.0 105.683 176.479 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.27 125.82 42.97 Favored 'General case' 0 CA--C 1.499 -0.986 0 C-N-CA 125.815 1.646 . . . . 0.0 107.078 -173.849 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.491 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -105.28 88.51 0.58 Allowed Glycine 0 C--N 1.359 1.836 0 N-CA-C 107.463 -2.255 . . . . 0.0 107.463 172.025 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -92.39 116.38 28.92 Favored 'General case' 0 C--N 1.358 0.935 0 C-N-CA 125.043 1.337 . . . . 0.0 109.7 -174.144 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -123.17 141.43 51.98 Favored 'General case' 0 C--N 1.36 1.053 0 N-CA-C 102.317 -3.216 . . . . 0.0 102.317 -174.464 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.92 112.63 10.8 Favored 'General case' 0 CA--C 1.505 -0.787 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.456 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.9 mmt -110.52 119.62 39.76 Favored 'General case' 0 C--N 1.361 1.089 0 C-N-CA 126.806 2.042 . . . . 0.0 106.449 -174.515 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 32.5 m120 77.26 -85.2 0.02 OUTLIER 'General case' 0 C--N 1.378 1.825 0 C-N-CA 127.452 2.301 . . . . 0.0 111.558 177.492 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -164.55 48.68 0.29 Allowed Glycine 0 C--N 1.352 1.462 0 N-CA-C 106.984 -2.446 . . . . 0.0 106.984 171.47 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 75.9 mttt -151.22 153.06 34.18 Favored 'General case' 0 C--N 1.366 1.308 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 173.387 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 40.6 t -105.03 152.55 22.6 Favored 'General case' 0 C--N 1.361 1.096 0 C-N-CA 127.458 2.303 . . . . 0.0 110.417 -161.592 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.6 mtpt -133.92 141.43 47.33 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 127.411 2.285 . . . . 0.0 105.801 178.971 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 61.2 m -126.95 124.93 40.61 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 108.476 -0.935 . . . . 0.0 108.476 178.595 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -123.01 -165.27 1.29 Allowed 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 126.879 2.072 . . . . 0.0 105.922 179.901 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -127.55 93.28 3.67 Favored 'General case' 0 C--N 1.359 1.006 0 N-CA-C 106.069 -1.826 . . . . 0.0 106.069 178.787 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.491 HD22 ' HA3' ' A' ' 26' ' ' GLY . 71.1 m-80 -133.54 -99.38 0.26 Allowed 'General case' 0 C--N 1.356 0.88 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 175.874 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.372 0 CA-C-N 117.836 0.289 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 82.3 p . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 121.909 0.862 . . . . 0.0 110.973 . . . . . . . . . 0 0 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 46.5 mt -123.76 120.16 59.03 Favored 'Isoleucine or valine' 0 C--N 1.361 1.075 0 N-CA-C 103.521 -2.77 . . . . 0.0 103.521 175.897 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 40.7 pt -104.53 -171.8 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.242 0 C-N-CA 125.497 1.519 . . . . 0.0 108.681 177.045 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 7.5 p-10 -135.04 78.63 1.74 Allowed 'General case' 0 C--N 1.36 1.032 0 C-N-CA 123.995 0.918 . . . . 0.0 108.542 -175.774 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.5 t -126.6 126.38 68.78 Favored 'Isoleucine or valine' 0 C--N 1.362 1.133 0 N-CA-C 104.392 -2.448 . . . . 0.0 104.392 172.677 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 64.6 mmtt -88.61 129.7 35.44 Favored 'General case' 0 C--N 1.363 1.194 0 C-N-CA 125.971 1.708 . . . . 0.0 109.132 -171.529 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.9 p -133.85 -174.59 3.57 Favored 'General case' 0 C--N 1.358 0.975 0 C-N-CA 123.797 0.839 . . . . 0.0 109.265 -162.373 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.9 t -151.8 22.6 0.69 Allowed 'General case' 0 C--N 1.358 0.949 0 N-CA-C 105.337 -2.098 . . . . 0.0 105.337 166.609 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.9 p -175.5 153.39 1.46 Allowed Pre-proline 0 C--N 1.365 1.269 0 C-N-CA 124.59 1.156 . . . . 0.0 108.242 -169.115 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -69.4 -17.89 38.99 Favored 'Trans proline' 0 C--N 1.361 1.191 0 C-N-CA 125.286 3.99 . . . . 0.0 115.113 163.425 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -82.14 -7.33 59.62 Favored 'General case' 0 C--N 1.368 1.41 0 C-N-CA 126.682 1.993 . . . . 0.0 114.658 173.59 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.9 tt0 -100.51 6.03 44.21 Favored 'General case' 0 C--N 1.37 1.498 0 C-N-CA 126.941 2.096 . . . . 0.0 109.156 170.699 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 53.6 t -120.3 -14.76 8.72 Favored 'General case' 0 C--N 1.362 1.131 0 C-N-CA 127.603 2.361 . . . . 0.0 108.447 177.846 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.8 m -84.61 1.09 47.67 Favored 'General case' 0 C--N 1.37 1.484 0 C-N-CA 126.406 1.882 . . . . 0.0 110.876 173.365 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 66.6 mttm -81.77 -59.79 0.43 Allowed Pre-proline 0 N--CA 1.44 -0.972 0 C-N-CA 129.454 3.101 . . . . 0.0 110.91 171.682 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -71.55 -38.91 4.01 Favored 'Trans proline' 0 C--N 1.365 1.415 0 C-N-CA 125.066 3.844 . . . . 0.0 113.561 173.987 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 63.8 m -71.6 -27.68 63.29 Favored 'General case' 0 C--N 1.368 1.397 0 C-N-CA 127.3 2.24 . . . . 0.0 114.378 -178.531 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -88.17 -6.54 57.8 Favored 'General case' 0 C--N 1.372 1.549 0 CA-C-N 119.92 1.236 . . . . 0.0 113.936 169.202 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -88.94 -18.8 26.74 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 125.833 1.653 . . . . 0.0 111.403 166.187 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 32.1 mt -99.46 -73.64 0.62 Allowed 'General case' 0 C--N 1.364 1.211 0 C-N-CA 127.418 2.287 . . . . 0.0 109.859 179.559 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -103.58 45.61 0.95 Allowed 'General case' 0 C--N 1.36 1.048 0 C-N-CA 129.079 2.952 . . . . 0.0 109.565 -173.638 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.59 81.57 1.23 Allowed Glycine 0 C--N 1.364 2.105 0 C-N-CA 126.492 1.996 . . . . 0.0 116.763 -170.778 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.3 p 175.62 -47.26 0.01 OUTLIER 'General case' 0 C--N 1.358 0.945 0 C-N-CA 127.701 2.4 . . . . 0.0 104.856 175.701 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 22.9 t -133.11 76.39 1.68 Allowed 'General case' 0 N--CA 1.439 -0.992 0 N-CA-C 104.454 -2.424 . . . . 0.0 104.454 -177.577 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.57 119.36 39.19 Favored 'General case' 0 C--N 1.366 1.304 0 C-N-CA 125.273 1.429 . . . . 0.0 108.624 178.336 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -100.37 85.71 0.62 Allowed Glycine 0 C--N 1.368 2.313 0 N-CA-C 108.34 -1.904 . . . . 0.0 108.34 170.515 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -93.86 115.79 28.2 Favored 'General case' 0 C--N 1.36 1.041 0 C-N-CA 125.332 1.453 . . . . 0.0 109.956 -172.817 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 54.3 mttm -125.43 143.84 50.8 Favored 'General case' 0 CA--C 1.491 -1.291 0 N-CA-C 104.564 -2.384 . . . . 0.0 104.564 -172.401 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -140.04 112.23 7.68 Favored 'General case' 0 CA--C 1.503 -0.834 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 -177.038 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 98.0 mmm -112.86 124.91 53.69 Favored 'General case' 0 C--N 1.36 1.026 0 C-N-CA 126.983 2.113 . . . . 0.0 105.814 -177.811 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 79.17 -86.39 0.02 OUTLIER 'General case' 0 C--N 1.38 1.928 0 C-N-CA 127.55 2.34 . . . . 0.0 110.701 176.4 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.74 50.02 0.24 Allowed Glycine 0 N--CA 1.434 -1.438 0 N-CA-C 106.593 -2.603 . . . . 0.0 106.593 169.795 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.39 148.11 29.08 Favored 'General case' 0 C--N 1.369 1.416 0 N-CA-C 106.08 -1.822 . . . . 0.0 106.08 175.59 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 44.6 t -105.02 151.34 24.07 Favored 'General case' 0 C--N 1.361 1.101 0 C-N-CA 127.39 2.276 . . . . 0.0 110.124 -161.944 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -134.0 135.1 43.19 Favored 'General case' 0 C--N 1.362 1.116 0 C-N-CA 126.489 1.915 . . . . 0.0 106.16 178.551 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.8 m -120.36 119.74 33.97 Favored 'General case' 0 C--N 1.36 1.052 0 C-N-CA 124.441 1.096 . . . . 0.0 108.538 178.53 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 60.3 m-85 -123.0 -158.64 0.8 Allowed 'General case' 0 N--CA 1.435 -1.188 0 C-N-CA 126.53 1.932 . . . . 0.0 106.219 -178.597 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -127.45 153.32 46.42 Favored 'General case' 0 C--N 1.358 0.941 0 N-CA-C 105.391 -2.077 . . . . 0.0 105.391 172.956 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -84.93 117.92 24.22 Favored 'General case' 0 C--N 1.357 0.918 0 C-N-CA 124.828 1.251 . . . . 0.0 107.966 175.564 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.364 0 CA-C-N 116.161 -0.472 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 . . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 54.1 mt -125.22 113.32 34.94 Favored 'Isoleucine or valine' 0 C--N 1.366 1.307 0 N-CA-C 102.492 -3.151 . . . . 0.0 102.492 174.361 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.6 pt -101.45 -179.29 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.271 0 C-N-CA 124.721 1.208 . . . . 0.0 110.744 -175.972 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -121.77 78.45 1.46 Allowed 'General case' 0 C--N 1.362 1.15 0 C-N-CA 125.691 1.596 . . . . 0.0 107.27 -176.206 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 22.8 t -132.12 124.59 53.0 Favored 'Isoleucine or valine' 0 C--N 1.362 1.125 0 N-CA-C 103.674 -2.713 . . . . 0.0 103.674 170.888 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? -87.96 140.94 28.99 Favored 'General case' 0 C--N 1.365 1.241 0 C-N-CA 126.18 1.792 . . . . 0.0 108.372 -175.739 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.1 p -146.01 -176.21 5.06 Favored 'General case' 0 C--N 1.357 0.919 0 CA-C-O 121.429 0.633 . . . . 0.0 110.059 -162.574 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.0 t -154.33 24.93 0.47 Allowed 'General case' 0 C--N 1.359 1.005 0 N-CA-C 105.63 -1.989 . . . . 0.0 105.63 164.534 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.0 p -173.53 150.54 1.8 Allowed Pre-proline 0 C--N 1.365 1.271 0 C-N-CA 124.399 1.08 . . . . 0.0 108.524 -170.08 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.41 ' HA ' ' HB2' ' A' ' 29' ' ' CYS . 51.8 Cg_exo -69.01 -15.22 39.73 Favored 'Trans proline' 0 C--N 1.362 1.277 1 C-N-CA 125.559 4.173 . . . . 0.0 115.119 164.96 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -88.09 5.18 42.38 Favored 'General case' 0 C--N 1.37 1.47 0 C-N-CA 126.253 1.821 . . . . 0.0 113.819 171.596 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -113.06 28.2 8.99 Favored 'General case' 0 C--N 1.368 1.384 0 C-N-CA 127.139 2.176 . . . . 0.0 106.671 168.245 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.0 t -147.46 -21.43 0.38 Allowed 'General case' 0 C--N 1.356 0.863 0 C-N-CA 125.693 1.597 . . . . 0.0 109.95 -175.864 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 53.7 p -86.27 0.27 54.2 Favored 'General case' 0 C--N 1.372 1.55 0 CA-C-N 121.434 1.924 . . . . 0.0 111.308 175.81 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -79.63 -58.53 0.63 Allowed Pre-proline 0 C--N 1.357 0.922 0 C-N-CA 129.737 3.215 . . . . 0.0 111.472 170.109 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.18 -40.31 4.79 Favored 'Trans proline' 0 C--N 1.365 1.441 1 C-N-CA 125.312 4.008 . . . . 0.0 113.787 174.041 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 62.3 m -70.08 -30.71 68.01 Favored 'General case' 0 C--N 1.367 1.326 0 C-N-CA 127.751 2.421 . . . . 0.0 114.727 -177.901 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -88.0 -7.17 57.45 Favored 'General case' 0 C--N 1.37 1.477 0 C-N-CA 124.836 1.254 . . . . 0.0 113.2 171.646 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 76.4 tt0 -86.98 -18.92 29.54 Favored 'General case' 0 C--N 1.36 1.022 0 C-N-CA 125.697 1.599 . . . . 0.0 111.322 165.512 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 41.0 mt -94.22 -66.63 0.9 Allowed 'General case' 0 C--N 1.365 1.256 0 C-N-CA 127.596 2.358 . . . . 0.0 111.278 178.495 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 87.8 m-85 -94.62 -9.46 34.97 Favored 'General case' 0 C--N 1.363 1.166 0 C-N-CA 127.998 2.519 . . . . 0.0 112.199 -167.892 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 103.6 -77.95 0.29 Allowed Glycine 0 C--N 1.364 2.138 0 C-N-CA 124.953 1.264 . . . . 0.0 113.318 165.641 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.418 ' H ' ' H ' ' A' ' 24' ' ' SER . 9.6 t -153.56 -7.43 0.17 Allowed 'General case' 0 C--N 1.355 0.806 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 -175.082 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.418 ' H ' ' H ' ' A' ' 23' ' ' SER . 18.6 t -108.68 70.93 0.76 Allowed 'General case' 0 C--N 1.364 1.232 0 C-N-CA 126.766 2.026 . . . . 0.0 105.596 175.354 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -126.7 126.12 42.97 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 125.642 1.577 . . . . 0.0 107.002 -178.077 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.51 83.59 0.59 Allowed Glycine 0 C--N 1.362 1.981 0 N-CA-C 107.053 -2.419 . . . . 0.0 107.053 171.096 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.85 115.04 27.72 Favored 'General case' 0 C--N 1.359 1.0 0 C-N-CA 125.623 1.569 . . . . 0.0 109.748 -171.117 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -124.62 147.12 48.69 Favored 'General case' 0 CA--C 1.485 -1.534 0 N-CA-C 104.064 -2.569 . . . . 0.0 104.064 -170.487 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.41 ' HB2' ' HA ' ' A' ' 10' ' ' PRO . 0.1 OUTLIER -146.3 131.49 18.41 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 106.674 -1.602 . . . . 0.0 106.674 -177.619 . . . . . . . . 3 3 . 1 . 037 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.8 mmm -109.43 84.89 2.0 Allowed 'General case' 0 C--N 1.359 1.021 0 N-CA-C 104.324 -2.473 . . . . 0.0 104.324 171.992 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.271 5.4 p30 1.32 64.93 0.0 OUTLIER 'General case' 0 C--N 1.382 2.005 1 C-N-CA 134.438 5.095 . . . . 0.0 119.273 179.345 . . . . . . . . 3 2 . 1 . 037 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 166.0 -47.11 0.27 Allowed Glycine 0 C--N 1.354 1.54 0 N-CA-C 108.927 -1.669 . . . . 0.0 108.927 -162.63 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.3 mtpt -154.0 154.98 34.72 Favored 'General case' 0 C--N 1.37 1.475 0 CA-C-N 119.398 1.599 . . . . 0.0 109.353 -177.036 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 37.4 t -107.75 152.43 24.36 Favored 'General case' 0 C--N 1.366 1.291 0 C-N-CA 129.45 3.1 . . . . 0.0 110.196 -166.913 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 32.5 mtmm -133.61 139.84 46.75 Favored 'General case' 0 C--N 1.363 1.165 0 C-N-CA 126.808 2.043 . . . . 0.0 106.425 177.554 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 62.4 m -123.18 112.92 18.26 Favored 'General case' 0 C--N 1.36 1.045 0 C-N-CA 124.704 1.202 . . . . 0.0 108.816 178.877 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -112.11 -149.39 0.45 Allowed 'General case' 0 N--CA 1.439 -0.997 0 C-N-CA 126.813 2.045 . . . . 0.0 106.539 177.084 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -135.03 156.57 48.81 Favored 'General case' 0 C--N 1.359 0.984 0 N-CA-C 105.59 -2.004 . . . . 0.0 105.59 177.37 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 29.1 m120 -87.31 122.88 31.66 Favored 'General case' 0 C--N 1.361 1.072 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 171.852 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.367 1.326 0 O-C-N 123.474 0.484 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 91.7 m . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 106.299 -1.741 . . . . 0.0 106.299 . . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 13.8 mt -104.92 118.5 52.41 Favored 'Isoleucine or valine' 0 C--N 1.361 1.101 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 -179.376 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 45.7 pt -99.28 -174.84 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.364 1.212 0 C-N-CA 126.076 1.75 . . . . 0.0 110.113 -176.76 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 14.9 t-20 -128.25 82.91 2.11 Favored 'General case' 0 C--N 1.362 1.133 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 -174.167 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 12.3 t -134.63 126.19 47.67 Favored 'Isoleucine or valine' 0 C--N 1.361 1.076 0 N-CA-C 104.273 -2.491 . . . . 0.0 104.273 172.856 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp -80.28 138.75 36.81 Favored 'General case' 0 C--N 1.366 1.315 0 C-N-CA 127.036 2.134 . . . . 0.0 110.253 -178.928 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 17.7 p -145.1 171.18 14.87 Favored 'General case' 0 C--N 1.356 0.883 0 CA-C-O 121.782 0.801 . . . . 0.0 109.356 -166.888 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 13.8 t -119.85 -22.84 6.64 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 127.04 2.136 . . . . 0.0 108.156 161.184 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 85.5 p -135.9 162.44 56.8 Favored Pre-proline 0 C--N 1.366 1.288 0 C-N-CA 125.951 1.7 . . . . 0.0 110.046 -169.132 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -69.62 -17.07 38.42 Favored 'Trans proline' 0 C--N 1.361 1.213 1 C-N-CA 125.364 4.043 . . . . 0.0 115.113 163.397 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -79.32 -11.12 59.94 Favored 'General case' 0 C--N 1.369 1.441 0 C-N-CA 127.101 2.16 . . . . 0.0 114.187 171.0 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -98.23 7.31 46.43 Favored 'General case' 0 C--N 1.372 1.564 0 C-N-CA 127.36 2.264 . . . . 0.0 109.43 172.245 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 54.1 t -123.79 -13.18 7.48 Favored 'General case' 0 C--N 1.361 1.095 0 C-N-CA 127.662 2.385 . . . . 0.0 108.602 177.767 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 68.6 m -85.36 -1.11 56.65 Favored 'General case' 0 C--N 1.371 1.525 0 C-N-CA 126.26 1.824 . . . . 0.0 110.905 173.679 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.1 mmtp -81.88 -57.23 0.52 Allowed Pre-proline 0 N--CA 1.44 -0.974 0 C-N-CA 129.31 3.044 . . . . 0.0 111.112 172.827 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -69.76 -42.41 3.43 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 124.958 3.772 . . . . 0.0 113.962 172.568 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.1 m -70.0 -29.45 66.53 Favored 'General case' 0 C--N 1.366 1.319 0 C-N-CA 127.345 2.258 . . . . 0.0 114.845 -176.661 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -88.04 -8.62 55.31 Favored 'General case' 0 C--N 1.371 1.507 0 C-N-CA 124.784 1.234 . . . . 0.0 113.303 171.356 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -84.79 -25.88 27.9 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 125.732 1.613 . . . . 0.0 111.182 165.777 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 48.8 mt -89.78 -63.42 1.29 Allowed 'General case' 0 C--N 1.367 1.33 0 C-N-CA 127.516 2.326 . . . . 0.0 111.761 179.934 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -98.53 -8.98 25.65 Favored 'General case' 0 C--N 1.363 1.161 0 C-N-CA 127.629 2.371 . . . . 0.0 111.964 -167.645 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.63 -80.95 0.47 Allowed Glycine 0 C--N 1.365 2.187 0 C-N-CA 125.039 1.304 . . . . 0.0 113.651 164.956 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.3 m -147.51 -9.69 0.42 Allowed 'General case' 0 C--N 1.354 0.793 0 C-N-CA 125.858 1.663 . . . . 0.0 106.965 -175.058 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 20.6 t -106.19 69.92 0.82 Allowed 'General case' 0 C--N 1.365 1.276 0 C-N-CA 126.946 2.098 . . . . 0.0 105.726 176.326 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 127.15 42.55 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 -175.363 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -105.98 87.19 0.51 Allowed Glycine 0 C--N 1.36 1.868 0 N-CA-C 107.211 -2.356 . . . . 0.0 107.211 172.219 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -89.56 117.31 28.36 Favored 'General case' 0 C--N 1.357 0.933 0 C-N-CA 125.328 1.451 . . . . 0.0 109.935 -174.089 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.3 mtpp -122.99 140.15 53.33 Favored 'General case' 0 CA--C 1.496 -1.101 0 N-CA-C 102.986 -2.968 . . . . 0.0 102.986 -175.575 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -136.25 107.53 6.83 Favored 'General case' 0 CA--C 1.501 -0.935 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 -178.115 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 62.4 mtt -110.61 123.89 50.84 Favored 'General case' 0 C--N 1.359 1.009 0 C-N-CA 127.295 2.238 . . . . 0.0 106.042 -174.377 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 80.39 -86.29 0.02 OUTLIER 'General case' 0 C--N 1.38 1.919 0 C-N-CA 127.403 2.281 . . . . 0.0 109.908 177.854 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -167.77 49.51 0.24 Allowed Glycine 0 N--CA 1.435 -1.429 0 N-CA-C 106.444 -2.662 . . . . 0.0 106.444 170.03 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -151.37 150.58 30.64 Favored 'General case' 0 C--N 1.367 1.335 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 177.822 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 42.9 t -105.03 150.29 25.08 Favored 'General case' 0 C--N 1.362 1.127 0 C-N-CA 127.137 2.175 . . . . 0.0 110.819 -160.712 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 10.3 mtpt -131.98 144.47 50.83 Favored 'General case' 0 C--N 1.362 1.115 0 C-N-CA 127.437 2.295 . . . . 0.0 105.948 178.092 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 58.6 m -127.8 127.53 43.68 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 124.384 1.073 . . . . 0.0 108.168 177.859 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -125.18 -163.31 1.18 Allowed 'General case' 0 N--CA 1.437 -1.11 0 N-CA-C 105.376 -2.083 . . . . 0.0 105.376 178.926 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -129.19 97.76 4.7 Favored 'General case' 0 C--N 1.359 0.998 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 179.419 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 31.2 m120 -139.15 97.65 3.35 Favored 'General case' 0 C--N 1.355 0.837 0 N-CA-C 105.068 -2.197 . . . . 0.0 105.068 176.11 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.369 1.422 0 CA-C-N 116.09 -0.505 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 80.5 p . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 121.913 0.863 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 51.9 mt -124.59 115.81 45.63 Favored 'Isoleucine or valine' 0 C--N 1.361 1.066 0 N-CA-C 103.465 -2.791 . . . . 0.0 103.465 176.061 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 47.0 pt -104.32 -176.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.365 1.261 0 C-N-CA 125.78 1.632 . . . . 0.0 108.906 178.738 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -134.97 104.01 5.8 Favored 'General case' 0 C--N 1.361 1.105 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 -178.101 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 49.3 t -114.44 -50.06 5.14 Favored 'Isoleucine or valine' 0 C--N 1.364 1.228 0 C-N-CA 125.012 1.325 . . . . 0.0 110.851 -172.491 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt 82.14 121.39 0.05 OUTLIER 'General case' 0 C--N 1.364 1.211 0 C-N-CA 131.638 3.975 . . . . 0.0 110.45 -167.192 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.8 p -148.0 -177.73 5.9 Favored 'General case' 0 C--N 1.356 0.877 0 N-CA-C 108.701 -0.852 . . . . 0.0 108.701 -166.227 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 14.1 t -152.71 24.23 0.59 Allowed 'General case' 0 C--N 1.358 0.96 0 N-CA-C 105.871 -1.9 . . . . 0.0 105.871 167.008 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.2 p -173.04 150.41 1.95 Allowed Pre-proline 0 C--N 1.364 1.218 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 -171.086 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -69.77 -14.28 35.84 Favored 'Trans proline' 0 C--N 1.36 1.149 1 C-N-CA 125.428 4.086 . . . . 0.0 114.949 162.106 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -76.8 -15.26 59.79 Favored 'General case' 0 C--N 1.37 1.458 0 C-N-CA 127.674 2.389 . . . . 0.0 114.19 170.489 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 -97.78 8.8 44.07 Favored 'General case' 0 C--N 1.371 1.521 0 C-N-CA 127.686 2.395 . . . . 0.0 109.222 173.149 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 44.0 t -124.51 -14.47 6.85 Favored 'General case' 0 C--N 1.36 1.048 0 C-N-CA 126.827 2.051 . . . . 0.0 109.446 -179.827 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 69.9 m -86.51 -6.87 58.79 Favored 'General case' 0 C--N 1.367 1.351 0 C-N-CA 125.712 1.605 . . . . 0.0 111.237 175.72 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -82.52 -54.45 0.6 Allowed Pre-proline 0 C--N 1.356 0.866 0 C-N-CA 129.3 3.04 . . . . 0.0 111.956 171.37 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -66.38 -46.0 4.61 Favored 'Trans proline' 0 C--N 1.367 1.504 1 C-N-CA 125.974 4.45 . . . . 0.0 113.802 172.92 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 61.5 m -69.05 -30.87 69.3 Favored 'General case' 0 C--N 1.368 1.38 0 C-N-CA 127.589 2.356 . . . . 0.0 115.353 -178.152 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -88.01 -6.06 58.18 Favored 'General case' 0 C--N 1.369 1.451 0 C-N-CA 124.662 1.185 . . . . 0.0 113.444 172.979 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -88.59 -21.43 24.04 Favored 'General case' 0 C--N 1.361 1.081 0 C-N-CA 126.003 1.721 . . . . 0.0 111.081 165.889 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 36.7 mt -92.64 -66.65 0.91 Allowed 'General case' 0 C--N 1.367 1.327 0 C-N-CA 127.396 2.278 . . . . 0.0 111.196 178.51 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -97.1 -7.29 33.04 Favored 'General case' 0 C--N 1.361 1.1 0 C-N-CA 128.283 2.633 . . . . 0.0 112.34 -167.565 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.56 -79.9 0.57 Allowed Glycine 0 C--N 1.364 2.123 0 C-N-CA 125.05 1.31 . . . . 0.0 113.72 164.83 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 74.9 m -147.51 -9.61 0.42 Allowed 'General case' 0 C--N 1.354 0.798 0 C-N-CA 125.854 1.661 . . . . 0.0 107.198 -175.684 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 19.7 t -105.79 69.0 0.8 Allowed 'General case' 0 C--N 1.365 1.247 0 C-N-CA 126.875 2.07 . . . . 0.0 106.031 177.37 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.49 124.83 39.28 Favored 'General case' 0 C--N 1.359 0.993 0 C-N-CA 125.736 1.614 . . . . 0.0 106.985 -174.155 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.513 ' HA3' HD22 ' A' ' 39' ' ' ASN . . . -102.24 89.91 0.78 Allowed Glycine 0 C--N 1.363 2.043 0 N-CA-C 107.091 -2.403 . . . . 0.0 107.091 170.065 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.42 111.88 23.82 Favored 'General case' 0 C--N 1.358 0.953 0 C-N-CA 125.303 1.441 . . . . 0.0 109.894 -169.719 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.9 mttp -125.54 140.26 52.91 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 104.102 -2.555 . . . . 0.0 104.102 -173.382 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -134.16 110.28 9.47 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.915 -1.513 . . . . 0.0 106.915 -174.78 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 97.7 mmm -122.34 129.57 52.28 Favored 'General case' 0 C--N 1.36 1.04 0 C-N-CA 126.592 1.957 . . . . 0.0 105.747 -172.539 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 29.2 m120 76.15 -7.25 1.85 Allowed 'General case' 0 C--N 1.382 1.98 0 C-N-CA 126.793 2.037 . . . . 0.0 115.342 168.972 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 96.27 42.0 3.58 Favored Glycine 0 C--N 1.362 2.017 0 C-N-CA 126.63 2.062 . . . . 0.0 111.082 -174.114 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -154.03 156.97 38.33 Favored 'General case' 0 C--N 1.365 1.268 0 N-CA-C 102.968 -2.975 . . . . 0.0 102.968 169.862 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 39.0 t -105.05 155.58 18.85 Favored 'General case' 0 C--N 1.358 0.949 0 C-N-CA 126.305 1.842 . . . . 0.0 109.896 -166.077 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -132.56 134.51 45.04 Favored 'General case' 0 CA--C 1.496 -1.114 0 N-CA-C 105.476 -2.046 . . . . 0.0 105.476 176.95 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 60.3 m -123.02 117.34 25.25 Favored 'General case' 0 CA--C 1.498 -1.025 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 -179.784 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -115.19 -165.59 1.04 Allowed 'General case' 0 N--CA 1.437 -1.084 0 C-N-CA 126.851 2.06 . . . . 0.0 106.21 -179.524 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.6 m-80 -127.25 91.02 3.24 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 -178.707 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.513 HD22 ' HA3' ' A' ' 26' ' ' GLY . 69.6 m-80 -137.9 94.7 2.92 Favored 'General case' 0 C--N 1.356 0.879 0 N-CA-C 105.24 -2.133 . . . . 0.0 105.24 177.089 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 40' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.368 1.404 0 CA-C-N 116.015 -0.539 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_