data_1d2l_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 1d2l _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 122.058 0.932 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -129.8 -174.59 0.39 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.171 3.388 . . . . 0.0 105.068 168.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -77.37 66.7 7.87 Favored 'Trans proline' 0 CA--C 1.549 1.269 0 CA-C-N 123.717 2.363 . . . . 0.0 112.867 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.01 59.89 0.04 OUTLIER Glycine 0 C--N 1.345 1.064 0 C-N-CA 124.345 0.974 . . . . 0.0 115.065 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -133.29 -158.9 0.92 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.069 1.348 . . . . 0.0 111.495 -166.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -121.86 127.81 50.92 Favored 'General case' 0 CA--C 1.569 1.703 1 CA-C-O 129.295 4.379 . . . . 0.0 117.879 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.33 111.63 23.96 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 117.154 -3.466 . . . . 0.0 112.275 171.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 38.1 t -87.35 127.98 35.19 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.971 1.708 . . . . 0.0 111.017 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.64 -11.45 4.95 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -63.38 -28.37 69.94 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.858 1.663 . . . . 0.0 112.032 163.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.7 m 126.55 45.42 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.425 1 C-N-CA 132.239 4.215 . . . . 0.0 110.885 166.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.8 mmm-85 -126.53 135.94 51.95 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 123.706 1.717 . . . . 0.0 114.641 -158.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.99 116.46 30.25 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 119.791 -1.818 . . . . 0.0 110.519 166.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.07 176.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 115.381 -2.247 . . . . 0.0 105.733 174.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -103.15 149.4 24.68 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 128.501 3.626 . . . . 0.0 112.429 -162.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.426 ' HA ' ' HE2' ' A' ' 24' ' ' LYS . 10.0 tt0 -53.16 -19.36 2.9 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 127.714 3.134 . . . . 0.0 113.942 -167.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.38 -42.0 9.69 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.668 1.576 . . . . 0.0 109.632 169.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.944 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 9.3 m0 -73.49 -17.58 61.21 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 123.928 1.823 . . . . 0.0 108.386 -163.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HE2' ' HA ' ' A' ' 21' ' ' GLU . 46.1 mtmt -80.47 110.1 15.61 Favored 'General case' 0 C--N 1.357 0.917 0 O-C-N 119.879 -1.763 . . . . 0.0 108.881 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 m 71.85 24.35 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.63 1.172 . . . . 0.0 112.376 -170.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.433 ' OD1' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -77.57 -30.36 52.55 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.667 -1.271 . . . . 0.0 110.752 173.118 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.79 -1.41 71.3 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 117.609 -1.662 . . . . 0.0 114.137 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -96.09 150.58 20.34 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 125.944 2.783 . . . . 0.0 111.891 162.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -48.92 -42.42 37.11 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 111.842 -2.436 . . . . 0.0 113.018 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.433 ' OD2' ' OD1' ' A' ' 26' ' ' ASP . 17.1 t0 59.61 -60.89 0.05 Allowed 'General case' 0 N--CA 1.477 0.904 1 C-N-CA 133.174 4.59 . . . . 0.0 110.914 151.398 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.6 t -52.11 -20.33 2.44 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 128.146 2.579 . . . . 0.0 116.942 150.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -34.03 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.646 1.978 . . . . 0.0 113.035 -172.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -12.1 53.53 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.885 1.674 . . . . 0.0 110.816 172.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.79 63.86 1.92 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.862 1.665 . . . . 0.0 109.951 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 m -85.68 -56.1 3.66 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.944 ' OD2' ' O ' ' A' ' 23' ' ' TRP . 16.7 p-10 -55.8 -47.26 77.43 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 126.411 3.005 . . . . 0.0 110.655 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.499 ' OE2' ' OD2' ' A' ' 36' ' ' ASP 0.261 8.9 mm-40 -83.6 17.89 2.08 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 119.13 -2.231 . . . . 0.0 113.468 -178.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -106.44 132.85 20.56 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-O 116.76 -1.59 . . . . 0.0 108.06 150.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.89 20.99 0.18 Allowed 'Trans proline' 0 CA--C 1.542 0.878 1 C-N-CA 126.177 4.585 . . . . 0.0 114.334 -169.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.441 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -68.28 -22.22 64.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.314 0.646 . . . . 0.0 110.378 152.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tt -120.61 -74.39 0.61 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.471 1.508 . . . . 0.0 108.935 177.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.0 t -139.92 -70.12 0.4 Allowed 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 116.311 1.967 . . . . 0.0 116.311 176.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.684 0 C-N-CA 126.532 1.933 . . . . 0.0 114.197 -164.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -145.01 167.7 13.96 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 128.162 2.585 . . . . 0.0 107.33 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.44 70.66 4.79 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.154 2.57 . . . . 0.0 112.913 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.18 46.02 0.03 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.898 1.237 . . . . 0.0 113.756 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -133.3 -172.69 3.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.606 1.162 . . . . 0.0 112.155 -166.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -109.86 124.55 51.53 Favored 'General case' 0 CA--C 1.56 1.354 1 CA-C-O 128.681 4.086 . . . . 0.0 116.449 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.4 108.11 20.73 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 118.421 -2.674 . . . . 0.0 112.627 170.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.0 t -85.55 125.01 32.76 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.51 1.524 . . . . 0.0 111.233 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.71 -16.63 4.51 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 173.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -68.5 -24.45 64.67 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 120.635 1.561 . . . . 0.0 112.031 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.7 m 126.28 50.75 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 131.84 4.056 . . . . 0.0 111.221 165.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -128.38 135.72 49.93 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 124.231 1.967 . . . . 0.0 115.53 -166.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.18 121.12 38.72 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 119.353 -2.092 . . . . 0.0 110.413 160.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.34 167.69 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 114.087 -2.863 . . . . 0.0 106.729 173.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -87.24 144.73 26.68 Favored 'General case' 0 N--CA 1.45 -0.469 1 O-C-N 129.395 4.185 . . . . 0.0 113.301 -170.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.54 -16.4 9.89 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 128.122 2.569 . . . . 0.0 114.249 -170.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.0 ttp85 -50.19 -27.13 5.4 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.587 -1.321 . . . . 0.0 112.614 165.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -93.9 -4.34 50.09 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-O 126.33 2.967 . . . . 0.0 109.579 -171.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -78.55 111.29 14.45 Favored 'General case' 0 C--N 1.355 0.814 0 O-C-N 116.471 -3.893 . . . . 0.0 109.029 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.283 8.1 p 41.75 53.27 4.01 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -166.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -76.8 -24.85 52.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 118.756 -0.64 . . . . 0.0 112.269 145.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.6 -8.49 40.31 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-O 117.063 -1.965 . . . . 0.0 115.339 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -98.1 144.77 27.23 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 125.987 2.803 . . . . 0.0 113.887 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.84 58.42 0.33 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 118.616 -2.552 . . . . 0.0 110.878 170.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -56.22 -30.66 62.63 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 127.206 2.202 . . . . 0.0 110.12 175.636 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 51.6 t -80.38 -15.38 56.96 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.69 1.996 . . . . 0.0 115.779 175.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.37 -36.55 0.13 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.321 2.248 . . . . 0.0 114.849 -170.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -19.22 61.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.19 2.596 . . . . 0.0 111.014 169.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.7 74.56 0.44 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.365 2.266 . . . . 0.0 111.003 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.1 m -102.24 -58.41 1.88 Allowed 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.728 0.811 . . . . 0.0 110.237 -177.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.0 OUTLIER -28.6 -67.65 0.07 Allowed 'General case' 0 C--O 1.247 0.923 0 CA-C-O 128.012 3.767 . . . . 0.0 111.631 158.026 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 20.4 mm-40 -86.77 21.0 2.35 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 112.151 -2.295 . . . . 0.0 112.863 -173.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.45 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -111.6 135.52 21.1 Favored Pre-proline 0 CA--C 1.542 0.658 0 CA-C-O 115.085 -2.388 . . . . 0.0 107.994 154.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -68.31 21.66 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.074 1 C-N-CA 125.735 4.29 . . . . 0.0 114.614 -173.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -73.05 -20.87 60.89 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.052 0.941 . . . . 0.0 110.293 153.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 tt -120.15 -80.5 0.62 Allowed 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.716 1.607 . . . . 0.0 108.576 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 38.8 t -141.74 -54.36 0.45 Allowed 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 32.2 t-80 . . . . . 0 N--CA 1.476 0.871 0 C-N-CA 125.536 1.534 . . . . 0.0 114.777 -171.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 110.477 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -150.13 167.83 12.22 Favored Pre-proline 0 CA--C 1.552 1.019 0 C-N-CA 128.883 2.873 . . . . 0.0 106.908 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.66 76.89 1.45 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 123.323 2.682 . . . . 0.0 113.461 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.7 43.8 0.07 OUTLIER Glycine 0 N--CA 1.473 1.115 0 C-N-CA 124.441 1.02 . . . . 0.0 114.577 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -128.25 -174.51 3.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.271 1.035 . . . . 0.0 113.181 -162.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -109.14 121.29 44.83 Favored 'General case' 0 CA--C 1.563 1.465 1 CA-C-O 128.964 4.221 . . . . 0.0 116.214 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.8 107.79 20.32 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 118.223 -2.798 . . . . 0.0 112.75 172.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.5 t -82.59 124.09 29.82 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.302 1.441 . . . . 0.0 111.508 175.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.83 -12.53 3.18 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 173.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -67.38 -30.62 70.45 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.925 1.693 . . . . 0.0 111.684 165.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.9 m 128.03 53.78 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.273 1 C-N-CA 132.186 4.194 . . . . 0.0 110.741 170.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -129.28 132.16 47.12 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-O 124.341 2.02 . . . . 0.0 114.835 -167.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -101.49 117.57 35.19 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 118.739 -2.476 . . . . 0.0 110.212 167.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.18 169.41 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 114.961 -2.447 . . . . 0.0 105.987 172.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.98 154.45 18.15 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.547 3.029 . . . . 0.0 113.704 -171.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.05 -15.38 31.74 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 127.162 2.789 . . . . 0.0 114.196 -168.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -43.27 -33.52 0.99 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.545 -1.347 . . . . 0.0 112.82 160.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -95.41 -0.29 52.64 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 125.704 2.669 . . . . 0.0 111.825 -171.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -79.44 101.06 7.96 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 117.398 -3.314 . . . . 0.0 108.807 173.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.337 21.2 p 49.76 57.84 6.09 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -165.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.1 p30 -75.61 -23.03 56.38 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.679 137.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.87 9.71 65.71 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-O 117.668 -1.629 . . . . 0.0 113.932 -168.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -93.98 135.37 35.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.321 2.06 . . . . 0.0 110.949 171.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -29.29 -13.81 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 1 C-N-CA 132.344 4.258 . . . . 0.0 119.523 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.553 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 3.0 p30 -80.13 -23.86 40.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 123.591 1.663 . . . . 0.0 109.566 -85.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.408 ' C ' ' H ' ' A' ' 33' ' ' ASP . 45.5 t -56.11 -21.62 23.37 Favored 'General case' 0 N--CA 1.429 -1.494 1 C-N-CA 132.272 4.229 . . . . 0.0 116.176 164.014 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 69.66 -29.77 0.18 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.663 2.385 . . . . 0.0 113.494 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -71.59 -16.66 62.3 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.637 1.975 . . . . 0.0 110.545 157.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.19 64.24 1.93 Allowed 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 126.17 1.788 . . . . 0.0 110.233 -176.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.5 m -73.56 -64.85 0.91 Allowed 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 176.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.553 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.1 OUTLIER -39.29 -63.8 0.52 Allowed 'General case' 0 N--CA 1.441 -0.884 2 C-N-CA 132.752 4.421 . . . . 0.0 110.524 -177.998 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -84.81 21.34 1.58 Allowed 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 111.036 -2.802 . . . . 0.0 112.544 -172.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.458 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -117.68 139.52 26.42 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 116.136 -1.888 . . . . 0.0 108.428 153.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -69.12 20.72 0.15 Allowed 'Trans proline' 0 CA--C 1.542 0.886 1 C-N-CA 125.875 4.383 . . . . 0.0 114.596 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.458 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -69.65 -21.29 63.55 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.213 0.605 . . . . 0.0 110.388 152.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.1 tt -123.66 -76.07 0.59 Allowed 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.917 1.687 . . . . 0.0 108.786 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.4 t -139.74 -67.12 0.44 Allowed 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.6 t60 . . . . . 0 N--CA 1.474 0.739 0 C-N-CA 126.626 1.97 . . . . 0.0 115.043 -161.097 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -139.25 168.96 13.53 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 128.471 2.708 . . . . 0.0 107.454 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.2 73.31 4.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.816 2.344 . . . . 0.0 113.082 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.41 46.58 0.02 OUTLIER Glycine 0 CA--C 1.528 0.904 0 C-N-CA 125.305 1.431 . . . . 0.0 112.988 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -134.99 -176.83 4.38 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.663 1.185 . . . . 0.0 112.47 -165.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -105.75 121.96 45.1 Favored 'General case' 0 CA--C 1.56 1.349 1 CA-C-O 128.689 4.09 . . . . 0.0 116.268 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.38 107.37 19.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 118.353 -2.717 . . . . 0.0 112.58 171.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.5 t -86.97 126.59 34.82 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.832 1.653 . . . . 0.0 111.725 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.48 -13.18 3.3 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 115.866 1.802 . . . . 0.0 115.866 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -66.77 -28.59 68.52 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.759 1.618 . . . . 0.0 111.744 165.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.4 m 128.36 48.49 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.382 1 C-N-CA 132.133 4.173 . . . . 0.0 110.912 166.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -126.85 136.04 51.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 124.265 1.983 . . . . 0.0 115.069 -162.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 120.01 37.34 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 119.406 -2.059 . . . . 0.0 110.326 163.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.6 170.82 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 114.501 -2.666 . . . . 0.0 106.341 172.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -94.07 147.44 23.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 128.439 3.587 . . . . 0.0 113.407 -168.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -53.59 -20.57 5.3 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 127.603 3.064 . . . . 0.0 113.809 -169.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -50.46 -28.52 8.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.948 0.899 . . . . 0.0 112.265 167.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -92.82 -5.41 51.12 Favored 'General case' 0 CA--C 1.565 1.52 0 CA-C-O 126.751 3.167 . . . . 0.0 109.237 -170.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -80.16 102.5 9.44 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 116.368 -3.958 . . . . 0.0 108.493 171.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.294 21.1 p 45.99 60.04 3.4 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -165.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -71.07 -26.91 63.27 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.444 -1.253 . . . . 0.0 112.482 133.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.0 19.73 20.75 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-O 116.238 -2.423 . . . . 0.0 115.248 -172.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -128.74 152.46 48.4 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 126.726 3.155 . . . . 0.0 115.139 169.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.23 52.83 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 O-C-N 118.567 -2.583 . . . . 0.0 111.765 171.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.629 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -55.63 -29.54 59.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.368 1.867 . . . . 0.0 110.033 176.11 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.408 ' C ' ' H ' ' A' ' 33' ' ' ASP . 47.3 t -78.72 -13.55 59.75 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 127.572 2.349 . . . . 0.0 116.129 175.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.6 -34.51 0.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.991 2.116 . . . . 0.0 114.837 -172.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -74.63 -22.14 59.08 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 128.275 2.63 . . . . 0.0 111.074 170.118 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 56.97 86.41 0.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.358 2.263 . . . . 0.0 111.31 -168.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -105.05 -61.77 1.43 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.174 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.629 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -29.97 -67.46 0.08 Allowed 'General case' 0 C--O 1.246 0.873 1 CA-C-O 128.699 4.095 . . . . 0.0 111.763 166.634 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -86.18 17.87 3.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.069 -2.332 . . . . 0.0 112.906 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.494 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -107.94 139.35 20.57 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.032 156.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -68.09 20.69 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.864 1 C-N-CA 126.323 4.682 . . . . 0.0 114.27 -173.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -74.36 -20.7 59.99 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.127 0.971 . . . . 0.0 110.421 155.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 tt -125.76 -76.62 0.58 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.94 1.296 . . . . 0.0 109.218 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 47.6 t -138.53 -71.23 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 171.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 24.1 t60 . . . . . 0 CA--C 1.545 0.781 0 C-N-CA 125.83 1.652 . . . . 0.0 113.721 -162.579 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 122.247 1.022 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -132.09 -179.65 1.12 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.394 3.478 . . . . 0.0 105.033 171.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -74.88 69.42 5.45 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.23 2.189 . . . . 0.0 113.165 -174.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.08 54.29 0.05 OUTLIER Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.94 1.257 . . . . 0.0 114.814 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -133.28 -165.94 1.69 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.766 1.283 . . . . 0.0 112.723 -166.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -117.41 125.08 50.36 Favored 'General case' 0 CA--C 1.564 1.502 1 CA-C-O 128.848 4.166 . . . . 0.0 118.205 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.3 107.09 18.35 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 117.725 -3.109 . . . . 0.0 112.678 171.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.35 127.02 31.96 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.851 1.26 . . . . 0.0 109.927 170.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.54 -21.91 19.11 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 170.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -7.3 38.02 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 119.849 1.204 . . . . 0.0 112.416 168.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.5 m 106.91 53.45 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.893 1 C-N-CA 132.059 4.144 . . . . 0.0 110.392 160.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.6 mmm-85 -130.76 131.26 44.62 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 123.063 1.411 . . . . 0.0 114.526 -166.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.332 0.1 OUTLIER -101.56 115.08 29.71 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 119.65 -1.906 . . . . 0.0 111.706 168.471 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -136.41 170.68 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 115.553 -2.165 . . . . 0.0 105.635 174.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -97.76 155.38 17.05 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 128.167 3.417 . . . . 0.0 112.958 -167.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -58.63 -16.9 18.12 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 127.271 2.857 . . . . 0.0 114.626 -163.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.54 -41.11 4.31 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.089 1.768 . . . . 0.0 110.787 163.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -84.58 -7.95 59.07 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 125.97 2.795 . . . . 0.0 108.61 -164.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -77.98 123.39 26.75 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 117.107 -3.496 . . . . 0.0 107.401 164.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 m 78.97 11.63 1.46 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.864 1.665 . . . . 0.0 114.862 168.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.575 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 34.2 p-10 -83.79 -3.61 57.98 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.07 -1.644 . . . . 0.0 112.239 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 77.38 10.33 86.31 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-O 117.762 -1.577 . . . . 0.0 114.35 -175.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -103.86 125.69 50.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 124.188 1.947 . . . . 0.0 112.347 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.563 ' ND2' HD21 ' A' ' 34' ' ' ASN . 0.0 OUTLIER -67.77 56.93 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 118.828 -2.42 . . . . 0.0 110.801 163.661 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.581 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -57.06 -31.75 65.53 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.972 2.509 . . . . 0.0 109.459 175.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.402 ' C ' ' H ' ' A' ' 33' ' ' ASP . 45.0 t -75.7 -14.49 60.34 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.734 2.414 . . . . 0.0 115.619 174.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.16 -35.75 0.17 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.325 2.25 . . . . 0.0 114.485 -172.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -71.95 -21.66 61.57 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 128.206 2.602 . . . . 0.0 110.774 171.445 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.563 HD21 ' ND2' ' A' ' 29' ' ' ASN . 22.2 t-20 54.58 80.75 0.12 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.824 2.05 . . . . 0.0 110.413 -164.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 m -86.12 -76.45 0.34 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 115.335 -2.269 . . . . 0.0 105.334 170.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.581 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -22.49 -70.68 0.02 OUTLIER 'General case' 0 N--CA 1.441 -0.889 2 C-N-CA 134.074 4.95 . . . . 0.0 111.411 175.331 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.575 ' OE2' ' OD1' ' A' ' 26' ' ' ASP . 28.4 mm-40 -80.74 16.27 1.47 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 111.871 -2.422 . . . . 0.0 113.228 -167.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -120.52 140.5 30.48 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 116.257 -1.83 . . . . 0.0 108.148 164.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.67 19.99 0.26 Allowed 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.66 4.24 . . . . 0.0 114.224 -168.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.416 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -71.29 -20.47 62.2 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.015 0.526 . . . . 0.0 110.189 153.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tt -125.57 -77.09 0.58 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.417 1.487 . . . . 0.0 109.538 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 11.9 t -133.28 -61.52 0.82 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 75.3 t60 . . . . . 0 N--CA 1.474 0.768 0 C-N-CA 125.144 1.377 . . . . 0.0 114.199 -162.91 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.471 0.575 0 CA-C-O 121.098 0.475 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -144.74 169.81 9.33 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 129.1 2.96 . . . . 0.0 106.463 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.86 70.0 4.45 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 122.355 2.037 . . . . 0.0 113.336 -174.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.16 40.36 0.03 OUTLIER Glycine 0 CA--C 1.533 1.185 0 C-N-CA 125.318 1.437 . . . . 0.0 115.282 178.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -125.58 -163.42 1.2 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 119.031 1.416 . . . . 0.0 113.145 -164.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -124.17 125.33 44.26 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 128.479 3.99 . . . . 0.0 117.803 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.15 111.35 22.87 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 117.288 -3.383 . . . . 0.0 113.615 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.6 t -82.07 125.03 30.36 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.121 1.769 . . . . 0.0 111.035 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.4 -10.9 3.58 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 174.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -66.22 -30.08 70.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 120.883 1.674 . . . . 0.0 111.635 164.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.8 m 128.11 51.79 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.343 1 C-N-CA 132.076 4.15 . . . . 0.0 110.803 168.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -128.13 134.41 49.11 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 123.839 1.781 . . . . 0.0 114.772 -166.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.272 0.5 OUTLIER -97.89 117.9 33.25 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 119.067 -2.271 . . . . 0.0 110.697 162.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.42 169.74 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-O 114.749 -2.548 . . . . 0.0 106.141 173.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -93.78 146.92 23.52 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 129.04 3.963 . . . . 0.0 112.964 -170.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.32 -16.13 31.9 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 126.926 2.641 . . . . 0.0 113.708 -166.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.3 ttt180 -46.16 -27.88 1.09 Allowed 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.143 -1.598 . . . . 0.0 113.026 162.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -97.47 -9.38 27.32 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 126.244 2.926 . . . . 0.0 110.117 -172.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -75.44 136.24 40.7 Favored 'General case' 0 C--N 1.353 0.735 1 O-C-N 115.92 -4.237 . . . . 0.0 107.916 166.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.1 m 63.75 13.58 7.55 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.74 -35.19 52.14 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.642 -173.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.42 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 106.53 -3.26 36.85 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 117.094 -1.948 . . . . 0.0 114.615 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -105.69 145.28 31.28 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 126.073 2.844 . . . . 0.0 112.487 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.64 60.85 0.35 Allowed 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.43 -2.044 . . . . 0.0 109.23 168.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.737 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 1.2 p30 -59.0 -25.68 63.86 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.352 1.861 . . . . 0.0 110.144 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.8 t -78.08 -16.7 57.79 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 129.107 2.963 . . . . 0.0 116.258 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.38 -33.9 0.15 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.796 2.038 . . . . 0.0 115.06 -172.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -20.38 60.43 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.01 2.124 . . . . 0.0 111.057 168.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 51.6 t30 59.23 83.41 0.13 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.837 2.455 . . . . 0.0 112.213 -168.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -103.93 -61.78 1.39 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.737 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.8 OUTLIER -31.1 -67.99 0.09 Allowed 'General case' 0 C--O 1.242 0.702 0 CA-C-O 127.12 3.343 . . . . 0.0 110.529 163.601 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 27' ' ' GLY 0.326 3.7 mm-40 -92.02 25.84 2.69 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 119.245 -2.159 . . . . 0.0 112.122 -170.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -108.86 126.84 28.51 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 114.961 -2.447 . . . . 0.0 107.189 151.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.78 19.87 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 125.984 4.456 . . . . 0.0 114.801 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.47 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -71.75 -21.61 61.72 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.934 0.893 . . . . 0.0 110.457 154.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -114.95 -79.5 0.59 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.82 1.648 . . . . 0.0 108.362 173.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 3.7 t -137.28 -60.38 0.67 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 24.8 t-80 . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 125.491 1.517 . . . . 0.0 113.149 -165.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -145.99 167.99 12.82 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.955 2.502 . . . . 0.0 107.427 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 75.34 1.83 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.317 2.678 . . . . 0.0 112.797 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.16 46.73 0.06 OUTLIER Glycine 0 N--CA 1.469 0.885 0 C-N-CA 124.284 0.945 . . . . 0.0 114.064 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -133.75 -172.23 2.92 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.421 1.088 . . . . 0.0 111.861 -168.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -110.38 121.95 46.53 Favored 'General case' 0 CA--C 1.56 1.362 1 CA-C-O 128.882 4.182 . . . . 0.0 116.568 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.16 108.51 21.23 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 118.29 -2.756 . . . . 0.0 112.81 172.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 28.3 t -82.49 122.95 28.71 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 125.822 1.649 . . . . 0.0 111.226 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.49 -19.84 2.51 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -70.98 -22.65 62.16 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.006 1.275 . . . . 0.0 112.366 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.4 m 125.59 51.82 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 1 C-N-CA 131.87 4.068 . . . . 0.0 111.425 166.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -130.46 134.95 47.49 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 124.304 2.002 . . . . 0.0 116.291 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.24 121.36 39.04 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.032 -2.293 . . . . 0.0 110.445 160.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.82 169.2 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 115.064 -2.398 . . . . 0.0 105.836 169.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -95.88 151.03 19.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 127.954 3.284 . . . . 0.0 112.918 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -61.15 -15.8 37.57 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 126.662 2.476 . . . . 0.0 114.096 -166.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -45.65 -25.65 0.5 Allowed 'General case' 0 CA--C 1.55 0.978 0 O-C-N 119.991 -1.693 . . . . 0.0 113.366 160.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -101.67 -4.2 26.95 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 126.265 2.936 . . . . 0.0 110.873 -172.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -78.24 114.41 17.1 Favored 'General case' 0 C--N 1.354 0.78 1 O-C-N 116.082 -4.136 . . . . 0.0 109.028 170.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.25 8.8 p 41.02 55.76 3.09 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -167.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -82.53 -29.63 30.28 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.694 145.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.68 -11.62 42.19 Favored Glycine 0 CA--C 1.534 1.272 0 CA-C-O 117.422 -1.766 . . . . 0.0 115.444 -175.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -81.31 142.33 33.19 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 125.371 2.51 . . . . 0.0 111.535 172.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -45.55 -2.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 130.296 3.438 . . . . 0.0 118.653 -169.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.61 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 3.0 p30 -75.5 -21.42 58.03 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 120.189 -1.569 . . . . 0.0 109.891 -91.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 33' ' ' ASP . 47.8 t -61.02 -13.67 18.09 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 130.726 3.61 . . . . 0.0 116.085 164.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.28 -34.1 0.27 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 128.666 2.786 . . . . 0.0 113.248 -174.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -68.61 -28.42 66.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.655 1.982 . . . . 0.0 110.125 164.716 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 65.4 81.59 0.2 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.326 2.65 . . . . 0.0 109.689 -169.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.4 m -98.27 -60.84 1.47 Allowed 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.61 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.7 p-10 -28.57 -66.31 0.08 Allowed 'General case' 0 C--O 1.247 0.957 0 CA-C-O 127.551 3.548 . . . . 0.0 112.076 157.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 22.2 mm-40 -87.18 17.76 4.1 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.953 -171.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.448 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -109.25 135.34 20.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 CA-C-O 115.214 -2.327 . . . . 0.0 108.047 155.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -68.68 22.98 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.993 1 C-N-CA 125.757 4.305 . . . . 0.0 114.556 -173.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.448 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -73.96 -20.32 60.4 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.997 0.919 . . . . 0.0 110.165 153.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -120.46 -82.51 0.65 Allowed 'General case' 0 C--N 1.344 0.346 0 C-N-CA 125.664 1.585 . . . . 0.0 108.868 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 36.4 t -144.47 -47.91 0.26 Allowed 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 177.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 11.7 t-160 . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 121.968 0.89 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -133.34 179.6 1.33 Allowed Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 130.128 3.371 . . . . 0.0 105.081 170.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -74.81 68.91 5.51 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.423 2.258 . . . . 0.0 113.208 -175.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.73 46.14 0.04 OUTLIER Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.636 1.112 . . . . 0.0 115.702 177.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -128.69 -162.34 1.18 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.119 1.46 . . . . 0.0 112.782 -164.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -121.54 125.98 48.09 Favored 'General case' 0 CA--C 1.563 1.444 1 CA-C-O 128.547 4.022 . . . . 0.0 118.669 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.08 107.35 18.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 117.801 -3.062 . . . . 0.0 113.074 170.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.7 t -74.25 122.87 23.52 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 168.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.48 -22.91 8.83 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 177.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -60.42 -25.83 66.24 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.755 1.622 . . . . 0.0 113.089 170.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.1 m 129.9 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 131.633 3.973 . . . . 0.0 112.317 161.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -125.91 128.58 47.79 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 -164.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.337 0.1 OUTLIER -98.31 116.6 30.88 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 120.237 -1.54 . . . . 0.0 111.951 167.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.25 165.32 31.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 115.249 -2.31 . . . . 0.0 105.768 171.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -88.82 146.56 24.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.922 3.888 . . . . 0.0 112.061 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.4 -21.29 62.05 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 126.805 2.566 . . . . 0.0 113.755 -165.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -40.99 -28.89 0.09 Allowed 'General case' 0 CA--C 1.547 0.849 0 O-C-N 120.394 -1.441 . . . . 0.0 113.359 161.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -102.77 -5.35 23.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 111.853 -3.927 . . . . 0.0 113.622 -171.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -72.43 143.2 48.59 Favored 'General case' 0 C--N 1.363 1.165 1 O-C-N 130.505 4.878 . . . . 0.0 109.168 166.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.7 p 31.57 56.89 0.3 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.547 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 3.7 p30 -89.26 -8.95 52.4 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.689 1.196 . . . . 0.0 111.84 157.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.97 10.48 75.29 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 117.099 -1.945 . . . . 0.0 112.975 -163.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.517 ' C ' ' H ' ' A' ' 30' ' ' ASP . 12.8 t0 -115.87 132.49 56.63 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 126.562 3.077 . . . . 0.0 114.591 -172.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.65 39.55 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 O-C-N 119.797 -1.815 . . . . 0.0 115.137 152.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.517 ' H ' ' C ' ' A' ' 28' ' ' ASP . 0.0 OUTLIER -42.28 -47.47 4.79 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.223 2.209 . . . . 0.0 108.602 146.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.7 t -81.7 113.03 19.41 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 154.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.41 -20.7 0.74 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.537 1.535 . . . . 0.0 114.615 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -102.29 -2.99 27.94 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.569 1.077 . . . . 0.0 113.297 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 51.51 68.55 0.78 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.395 1.878 . . . . 0.0 110.245 -166.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 m -77.65 -67.06 0.76 Allowed 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -60.1 -47.21 86.86 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-O 125.796 2.712 . . . . 0.0 113.232 -170.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.547 ' OE2' ' OD1' ' A' ' 26' ' ' ASP . 58.8 mm-40 -61.18 2.41 0.14 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 112.62 -2.082 . . . . 0.0 114.605 172.389 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.409 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -117.92 141.61 29.5 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 120.178 1.354 . . . . 0.0 109.541 165.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -72.17 21.83 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.823 1 C-N-CA 125.919 4.412 . . . . 0.0 114.192 -168.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -69.09 -21.07 64.09 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.814 -0.554 . . . . 0.0 110.089 151.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.0 tt -127.21 -77.19 0.57 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 126.257 1.823 . . . . 0.0 108.732 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.2 t -138.13 -61.99 0.59 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 t60 . . . . . 0 CA--C 1.552 1.055 0 C-N-CA 125.743 1.617 . . . . 0.0 114.474 -165.79 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -142.2 -170.69 0.25 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.3 3.44 . . . . 0.0 106.396 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -78.35 70.8 7.06 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 CA-C-N 123.791 2.39 . . . . 0.0 111.464 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 134.73 53.36 0.07 OUTLIER Glycine 0 C--N 1.347 1.145 0 N-CA-C 118.203 2.041 . . . . 0.0 118.203 171.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -127.91 -159.0 0.91 Allowed 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.913 1.857 . . . . 0.0 111.626 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -111.85 124.25 51.96 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 127.911 3.719 . . . . 0.0 116.727 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.84 108.83 21.21 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 118.015 -2.928 . . . . 0.0 113.442 167.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.2 t -81.56 128.3 33.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.646 2.378 . . . . 0.0 111.515 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.93 -11.93 3.93 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 174.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -66.63 -25.83 66.78 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 120.884 1.674 . . . . 0.0 111.911 164.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m 126.77 44.05 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 1 C-N-CA 132.168 4.187 . . . . 0.0 111.281 165.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.4 mmm-85 -128.41 136.41 50.85 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.708 1.718 . . . . 0.0 114.967 -156.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.379 0.6 OUTLIER -104.04 114.51 28.81 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 119.133 -2.23 . . . . 0.0 112.538 170.418 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.55 167.34 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 114.074 -2.87 . . . . 0.0 106.46 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -87.38 145.57 26.25 Favored 'General case' 0 N--CA 1.449 -0.524 1 O-C-N 129.466 4.229 . . . . 0.0 113.235 -171.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.12 -17.18 16.56 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 126.988 2.68 . . . . 0.0 114.212 -167.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.54 -37.75 8.43 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.726 1.603 . . . . 0.0 110.217 165.068 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -83.4 -10.52 58.37 Favored 'General case' 0 CA--C 1.565 1.526 0 CA-C-O 125.849 2.738 . . . . 0.0 108.685 -165.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.2 mttt -76.34 126.91 31.85 Favored 'General case' 0 C--N 1.355 0.82 0 O-C-N 116.67 -3.768 . . . . 0.0 107.786 166.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.2 m 66.94 15.59 10.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -18.66 51.39 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 120.319 -1.488 . . . . 0.0 112.578 -175.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.436 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 93.63 -0.17 67.48 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 116.992 -2.004 . . . . 0.0 114.6 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.408 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 38.1 t0 -118.23 150.94 38.59 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 126.871 3.224 . . . . 0.0 113.901 170.526 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.95 53.48 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.741 2.417 . . . . 0.0 110.956 162.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.748 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -55.93 -28.97 59.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.754 1.622 . . . . 0.0 109.981 175.318 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.401 ' C ' ' H ' ' A' ' 33' ' ' ASP . 40.0 t -78.25 -14.03 59.61 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.91 2.884 . . . . 0.0 115.778 174.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.98 -32.68 0.13 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.115 2.166 . . . . 0.0 114.879 -172.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.401 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -76.4 -22.14 55.12 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.542 2.337 . . . . 0.0 110.964 169.238 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 57.31 85.72 0.08 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.085 2.154 . . . . 0.0 111.491 -166.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.9 m -101.83 -62.82 1.21 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.748 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -29.58 -68.95 0.07 Allowed 'General case' 0 C--O 1.242 0.692 0 C-N-CA 130.571 3.549 . . . . 0.0 111.004 166.814 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 11.8 mm-40 -86.31 19.19 2.83 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 119.384 -2.073 . . . . 0.0 112.679 -170.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.452 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -110.6 130.64 22.68 Favored Pre-proline 0 CA--C 1.543 0.71 0 CA-C-O 115.538 -2.172 . . . . 0.0 107.406 157.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -68.82 21.04 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.97 1 C-N-CA 125.845 4.363 . . . . 0.0 114.656 -170.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.452 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -72.94 -21.14 60.93 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.858 0.863 . . . . 0.0 110.395 154.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -118.36 -79.37 0.59 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.584 1.554 . . . . 0.0 108.595 175.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 14.8 t -134.79 -66.38 0.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.6 t60 . . . . . 0 N--CA 1.471 0.608 0 C-N-CA 125.577 1.551 . . . . 0.0 113.612 -163.924 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -135.69 -167.54 0.15 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.144 3.378 . . . . 0.0 106.023 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -77.09 81.13 2.69 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 CA-C-N 123.734 2.369 . . . . 0.0 110.183 170.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 115.83 56.74 0.34 Allowed Glycine 0 C--N 1.347 1.18 0 N-CA-C 117.923 1.929 . . . . 0.0 117.923 173.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -124.55 -154.49 0.62 Allowed 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.783 . . . . 0.0 111.204 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -117.31 125.3 50.84 Favored 'General case' 0 CA--C 1.56 1.337 0 CA-C-O 128.349 3.928 . . . . 0.0 116.95 177.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.86 110.77 23.12 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 117.95 -2.969 . . . . 0.0 113.269 171.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 20.4 t -80.94 124.18 28.92 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 127.552 2.341 . . . . 0.0 110.733 175.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.33 -16.93 3.94 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 174.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -68.47 -26.85 65.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.363 1.438 . . . . 0.0 111.922 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.4 m 126.23 53.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.315 1 C-N-CA 131.929 4.092 . . . . 0.0 110.907 168.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.91 135.04 48.51 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 123.622 1.677 . . . . 0.0 115.525 -170.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.368 0.5 OUTLIER -104.1 116.95 33.13 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 119.132 -2.23 . . . . 0.0 112.09 163.048 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -133.01 160.88 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 115.139 -2.362 . . . . 0.0 104.838 176.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.86 153.42 30.61 Favored 'General case' 0 N--CA 1.442 -0.853 0 O-C-N 128.847 3.842 . . . . 0.0 112.567 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -59.68 -17.49 34.65 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 127.785 3.178 . . . . 0.0 113.863 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.05 -20.67 1.02 Allowed 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.452 -2.03 . . . . 0.0 113.969 162.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -98.99 -4.3 32.9 Favored 'General case' 0 CA--C 1.564 1.491 0 CA-C-O 125.597 2.618 . . . . 0.0 112.403 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -78.33 121.61 24.69 Favored 'General case' 0 C--N 1.352 0.714 0 O-C-N 116.935 -3.603 . . . . 0.0 109.425 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.261 4.2 p 39.14 58.66 1.81 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -89.79 -16.79 29.45 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 159.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 107.69 -12.67 38.82 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-O 115.74 -2.7 . . . . 0.0 116.502 -170.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -119.27 146.98 44.79 Favored 'General case' 0 N--CA 1.477 0.917 1 CA-C-O 129.343 4.401 . . . . 0.0 117.601 -176.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.96 52.91 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 O-C-N 118.031 -2.918 . . . . 0.0 111.37 172.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.668 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.5 OUTLIER -51.63 -31.97 27.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.572 1.949 . . . . 0.0 110.075 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.41 ' C ' ' H ' ' A' ' 33' ' ' ASP . 46.8 t -79.43 -13.36 59.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 127.66 2.384 . . . . 0.0 115.894 177.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.81 -34.27 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 127.391 2.276 . . . . 0.0 114.876 -171.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -73.39 -20.33 60.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 128.15 2.58 . . . . 0.0 110.765 171.379 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 51.63 81.15 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.552 1.941 . . . . 0.0 110.035 -162.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.5 m -85.62 -81.89 0.2 Allowed 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.814 -2.291 . . . . 0.0 104.814 168.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.668 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.1 OUTLIER -16.12 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.062 2 C-N-CA 135.422 5.489 . . . . 0.0 112.129 175.891 . . . . . . . . 4 4 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -74.84 1.68 12.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.759 -2.019 . . . . 0.0 114.451 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.481 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -105.51 131.64 21.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 115.527 -2.178 . . . . 0.0 107.668 169.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -69.76 19.79 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.937 1 C-N-CA 126.639 4.892 . . . . 0.0 114.481 -167.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.481 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -71.45 -23.51 61.85 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.105 0.962 . . . . 0.0 110.507 154.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -117.48 -81.48 0.62 Allowed 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.366 1.866 . . . . 0.0 107.93 170.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 t -142.33 -171.53 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.313 0.506 . . . . 0.0 110.494 170.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 N--CA 1.467 0.425 0 O-C-N 120.032 -1.668 . . . . 0.0 108.977 168.824 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 122.134 0.968 . . . . 0.0 109.046 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -138.85 171.75 7.67 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 130.473 3.509 . . . . 0.0 105.164 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.33 79.96 2.02 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.431 2.088 . . . . 0.0 112.146 -177.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.78 50.76 0.1 OUTLIER Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.407 1.003 . . . . 0.0 114.317 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -134.41 -166.47 1.81 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.508 1.123 . . . . 0.0 111.337 -169.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -115.84 122.66 46.06 Favored 'General case' 0 CA--C 1.558 1.283 1 CA-C-O 128.66 4.076 . . . . 0.0 117.115 177.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.22 106.67 18.37 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 118.355 -2.716 . . . . 0.0 111.707 171.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.8 t -85.47 129.6 34.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 126.217 1.807 . . . . 0.0 112.082 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.87 -22.22 2.09 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -65.48 -25.21 67.39 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 120.256 1.389 . . . . 0.0 112.288 169.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m 125.57 44.91 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.441 1 C-N-CA 132.145 4.178 . . . . 0.0 111.056 166.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 mmm-85 -127.63 134.4 49.66 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-O 123.628 1.68 . . . . 0.0 114.943 -157.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.312 0.5 OUTLIER -102.54 115.22 30.14 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 119.422 -2.049 . . . . 0.0 111.147 167.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -135.92 169.0 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 114.637 -2.602 . . . . 0.0 106.073 174.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -93.95 149.09 21.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 128.595 3.685 . . . . 0.0 113.105 -168.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -59.66 -17.29 32.71 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 126.882 2.614 . . . . 0.0 114.008 -167.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -46.09 -26.68 0.79 Allowed 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.172 -1.58 . . . . 0.0 113.247 162.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -99.91 -10.75 21.34 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-O 126.081 2.848 . . . . 0.0 110.19 -172.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.5 mtpt -72.03 139.75 48.69 Favored 'General case' 0 C--N 1.355 0.837 1 O-C-N 115.537 -4.477 . . . . 0.0 107.153 165.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 m 64.35 10.1 5.42 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -41.34 50.99 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.768 1.627 . . . . 0.0 110.622 -170.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.16 -1.39 14.59 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-O 116.553 -2.248 . . . . 0.0 115.444 -179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . 0.531 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 36.2 t0 -118.23 151.32 37.87 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 127.398 3.475 . . . . 0.0 113.965 166.544 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 63.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 O-C-N 119.43 -2.044 . . . . 0.0 109.388 163.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.659 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 1.3 p30 -65.82 -24.57 66.93 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 120.631 -1.293 . . . . 0.0 109.47 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.7 t -67.33 -13.0 61.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.54 2.736 . . . . 0.0 115.705 166.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 65.06 -38.42 0.24 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.147 2.579 . . . . 0.0 114.56 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -86.65 -9.82 55.18 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.175 2.19 . . . . 0.0 111.028 174.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.0 t30 62.86 128.4 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 129.211 3.004 . . . . 0.0 112.546 -167.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.5 m -147.47 -52.15 0.2 Allowed 'General case' 0 C--O 1.212 -0.873 0 O-C-N 120.214 -1.554 . . . . 0.0 111.925 164.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.659 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.1 p-10 -28.41 -69.46 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 CA-C-O 127.912 3.72 . . . . 0.0 111.84 157.428 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -92.99 23.17 4.4 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.434 -2.666 . . . . 0.0 112.244 -173.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.474 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -102.99 119.62 54.89 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-O 114.458 -2.687 . . . . 0.0 106.045 152.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.52 19.63 0.08 OUTLIER 'Trans proline' 0 CA--C 1.543 0.926 1 C-N-CA 126.488 4.792 . . . . 0.0 115.497 -168.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.474 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -76.38 -21.08 56.51 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.567 1.147 . . . . 0.0 110.319 156.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tt -108.11 -81.2 0.57 Allowed 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.179 1.392 . . . . 0.0 108.559 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 5.4 t -138.86 -59.03 0.61 Allowed 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 . . . . . 0 N--CA 1.473 0.722 0 C-N-CA 125.62 1.568 . . . . 0.0 114.395 -170.832 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.9 t . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 122.181 0.991 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -135.01 178.6 1.69 Allowed Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 131.085 3.754 . . . . 0.0 104.951 171.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.76 71.39 4.84 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 CA-C-N 123.331 2.225 . . . . 0.0 113.297 -173.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.81 50.4 0.06 OUTLIER Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.855 1.217 . . . . 0.0 114.871 177.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -129.37 -166.03 1.6 Allowed 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.885 1.342 . . . . 0.0 112.914 -165.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -117.09 123.54 47.04 Favored 'General case' 0 CA--C 1.561 1.367 1 CA-C-O 128.542 4.02 . . . . 0.0 117.166 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.57 108.17 20.71 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 117.871 -3.018 . . . . 0.0 112.374 168.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 13.5 t -79.78 126.39 30.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.31 1.844 . . . . 0.0 110.471 176.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -17.4 2.76 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 173.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.07 -24.33 64.15 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 120.459 1.481 . . . . 0.0 111.733 168.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.7 m 122.94 51.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 C-N-CA 131.897 4.079 . . . . 0.0 110.171 167.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -127.59 136.06 51.14 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 123.605 1.669 . . . . 0.0 115.445 -167.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.283 0.2 OUTLIER -99.17 115.87 30.06 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 119.455 -2.028 . . . . 0.0 111.068 165.004 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.67 163.31 37.8 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 115.096 -2.383 . . . . 0.0 105.81 173.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -85.48 142.06 29.48 Favored 'General case' 0 N--CA 1.442 -0.849 1 O-C-N 130.105 4.628 . . . . 0.0 111.799 -174.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -58.2 -16.86 15.25 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 127.295 2.872 . . . . 0.0 113.909 -169.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -52.87 -19.85 2.85 Favored 'General case' 0 CA--C 1.553 1.062 0 O-C-N 119.591 -1.943 . . . . 0.0 113.253 163.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -92.7 -10.29 37.69 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 126.077 2.846 . . . . 0.0 112.001 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -75.96 120.68 21.63 Favored 'General case' 0 C--N 1.353 0.731 1 O-C-N 116.009 -4.182 . . . . 0.0 108.343 171.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.257 1.6 p 42.83 57.76 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -164.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.83 -26.5 22.78 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.105 162.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.412 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 104.84 -3.17 41.62 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 116.966 -2.019 . . . . 0.0 114.712 -174.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -123.99 152.39 42.61 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 127.862 3.696 . . . . 0.0 114.471 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -64.09 55.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 127.877 2.471 . . . . 0.0 110.472 168.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.757 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 1.0 OUTLIER -57.49 -27.7 62.77 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.704 1.601 . . . . 0.0 110.139 176.652 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.5 t -80.52 -13.69 58.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 128.263 2.625 . . . . 0.0 115.897 173.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.0 -32.62 0.11 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.479 2.312 . . . . 0.0 115.06 -172.093 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -22.39 59.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 127.69 2.396 . . . . 0.0 110.903 169.106 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 58.6 87.06 0.08 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.352 2.261 . . . . 0.0 111.044 -168.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -106.44 -62.89 1.33 Allowed 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.162 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.757 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -28.86 -67.9 0.07 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-O 127.369 3.462 . . . . 0.0 111.569 164.104 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 26.9 mm-40 -82.37 11.82 5.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 112.676 -2.056 . . . . 0.0 113.752 -170.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -107.46 131.67 21.54 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-O 115.183 -2.341 . . . . 0.0 107.074 163.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -68.51 22.1 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 126.073 4.516 . . . . 0.0 114.498 -171.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.464 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -74.83 -20.6 59.69 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.141 0.976 . . . . 0.0 110.227 154.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -119.83 -82.05 0.64 Allowed 'General case' 0 C--N 1.344 0.333 0 C-N-CA 125.614 1.566 . . . . 0.0 108.977 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 15.1 t -140.02 -50.61 0.48 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 37.1 t-80 . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -173.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -152.1 174.29 3.76 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 130.989 3.716 . . . . 0.0 105.605 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.08 84.41 0.44 Allowed 'Trans proline' 0 CA--C 1.545 1.069 0 CA-C-N 123.275 2.205 . . . . 0.0 113.981 -174.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.16 2.08 1.41 Allowed Glycine 0 CA--C 1.534 1.265 0 N-CA-C 117.168 1.627 . . . . 0.0 117.168 171.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.2 -162.12 0.76 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.597 1.199 . . . . 0.0 113.764 -153.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -113.71 124.11 51.5 Favored 'General case' 0 CA--C 1.559 1.299 1 CA-C-O 128.671 4.081 . . . . 0.0 117.157 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.77 110.85 23.39 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 117.958 -2.964 . . . . 0.0 113.071 166.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.6 t -79.14 122.8 26.7 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 125.515 1.526 . . . . 0.0 110.682 171.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.2 -13.57 5.28 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 173.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.99 -27.23 67.27 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.523 1.51 . . . . 0.0 111.996 166.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.7 m 128.31 52.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.389 1 C-N-CA 132.01 4.124 . . . . 0.0 111.319 166.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -130.27 132.18 45.8 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 123.615 1.674 . . . . 0.0 115.497 -168.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.314 0.5 OUTLIER -100.42 117.67 35.07 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 118.911 -2.368 . . . . 0.0 111.015 165.428 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.83 165.48 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 115.146 -2.359 . . . . 0.0 106.059 174.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -91.23 152.1 20.66 Favored 'General case' 0 N--CA 1.446 -0.633 1 O-C-N 129.16 4.037 . . . . 0.0 112.909 -170.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -60.63 -16.83 42.65 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 126.831 2.582 . . . . 0.0 114.123 -167.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -44.09 -27.06 0.35 Allowed 'General case' 0 CA--C 1.552 1.022 0 O-C-N 119.655 -1.903 . . . . 0.0 113.562 160.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.618 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 2.6 m0 -101.47 -6.67 23.66 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 126.354 2.978 . . . . 0.0 110.693 -172.669 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -76.4 118.33 18.97 Favored 'General case' 0 C--N 1.356 0.855 1 O-C-N 116.189 -4.07 . . . . 0.0 108.045 172.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.251 2.0 p 46.98 46.42 15.8 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -174.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -75.76 -23.58 55.98 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.145 -0.972 . . . . 0.0 111.693 151.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.56 5.0 65.36 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 117.262 -1.854 . . . . 0.0 114.101 -165.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -90.65 128.28 36.57 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 124.383 2.039 . . . . 0.0 110.094 175.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -44.26 -36.85 2.92 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-O 116.549 -1.691 . . . . 0.0 113.561 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 34.74 -50.1 0.0 OUTLIER 'General case' 0 C--N 1.35 0.624 1 C-N-CA 138.681 6.792 . . . . 0.0 114.72 173.479 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.415 ' C ' ' H ' ' A' ' 33' ' ' ASP . 39.5 t -69.92 -20.6 63.35 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.513 2.725 . . . . 0.0 115.601 166.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.63 -39.0 0.42 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.927 2.091 . . . . 0.0 112.419 -173.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -73.45 -14.38 61.24 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.946 2.098 . . . . 0.0 110.311 170.422 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 52.41 65.44 1.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.296 2.239 . . . . 0.0 110.086 -174.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 m -78.93 -60.7 2.27 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 -176.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.618 ' OD2' ' O ' ' A' ' 23' ' ' TRP . 18.5 p-10 -57.82 -49.93 74.98 Favored 'General case' 0 C--O 1.246 0.869 0 CA-C-O 126.577 3.084 . . . . 0.0 111.478 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -71.01 9.75 0.66 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 112.631 -2.077 . . . . 0.0 114.144 176.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.458 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -113.58 137.69 22.28 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-O 116.411 -1.757 . . . . 0.0 108.659 157.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -69.76 21.04 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 126.145 4.563 . . . . 0.0 114.308 -171.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.458 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -68.36 -22.14 64.68 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.097 0.559 . . . . 0.0 110.276 151.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 tt -121.28 -76.56 0.58 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.015 1.726 . . . . 0.0 108.977 176.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 34.1 t -139.71 -68.5 0.42 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.2 t60 . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 127.383 2.273 . . . . 0.0 114.768 -164.927 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -139.14 -172.83 0.33 Allowed Pre-proline 0 CA--C 1.555 1.16 0 C-N-CA 130.862 3.665 . . . . 0.0 106.187 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.62 79.62 2.76 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 CA-C-N 123.388 2.246 . . . . 0.0 110.761 171.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 119.47 57.16 0.25 Allowed Glycine 0 C--N 1.346 1.12 0 N-CA-C 117.285 1.674 . . . . 0.0 117.285 173.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -127.39 -160.62 1.02 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 119.737 1.768 . . . . 0.0 111.504 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -108.89 122.95 48.28 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 127.915 3.721 . . . . 0.0 115.962 176.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.05 110.48 23.05 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 118.239 -2.788 . . . . 0.0 113.314 166.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.3 t -77.74 124.1 27.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.121 1.768 . . . . 0.0 110.68 171.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.04 -19.72 2.03 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 172.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -70.4 -24.25 62.9 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 120.279 1.399 . . . . 0.0 112.297 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m 125.59 52.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 131.666 3.987 . . . . 0.0 110.822 166.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.48 132.97 48.37 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 123.472 1.606 . . . . 0.0 115.141 -169.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.375 0.5 OUTLIER -105.09 117.05 33.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.022 -2.299 . . . . 0.0 112.45 167.206 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.68 166.14 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 114.203 -2.808 . . . . 0.0 106.318 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -88.81 144.41 26.24 Favored 'General case' 0 N--CA 1.449 -0.476 1 O-C-N 129.311 4.132 . . . . 0.0 113.103 -170.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -58.3 -15.22 9.45 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 127.12 2.763 . . . . 0.0 114.318 -167.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.7 ttp85 -50.64 -28.12 8.23 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.218 -1.551 . . . . 0.0 112.449 164.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -91.99 -4.3 54.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 126.146 2.879 . . . . 0.0 110.132 -172.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.8 mttt -78.82 105.91 10.46 Favored 'General case' 0 C--N 1.351 0.672 0 O-C-N 116.425 -3.922 . . . . 0.0 108.265 170.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 12.8 p 48.08 57.16 6.38 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -168.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -81.06 -37.78 28.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.231 145.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.14 -19.96 8.12 Favored Glycine 0 CA--C 1.537 1.457 0 CA-C-O 117.09 -1.95 . . . . 0.0 116.036 -173.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -78.95 139.82 38.16 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 125.941 2.782 . . . . 0.0 111.864 173.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -54.79 8.45 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 118.536 -2.603 . . . . 0.0 117.572 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 2.1 p30 -55.18 -24.18 25.58 Favored 'General case' 0 C--N 1.325 -0.487 1 C-N-CA 133.002 4.521 . . . . 0.0 112.728 -120.746 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.411 ' C ' ' H ' ' A' ' 33' ' ' ASP . 53.2 t -61.63 -20.68 63.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 130.192 3.397 . . . . 0.0 117.894 166.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 66.45 -32.28 0.17 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 128.106 2.563 . . . . 0.0 113.777 -171.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.411 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -71.98 -15.98 62.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.395 1.878 . . . . 0.0 110.649 160.553 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.83 63.49 2.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.285 1.834 . . . . 0.0 110.336 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -79.33 -59.02 2.93 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.2 OUTLIER -38.93 -66.0 0.32 Allowed 'General case' 0 C--O 1.249 1.039 1 CA-C-O 128.55 4.024 . . . . 0.0 110.974 177.216 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -82.08 19.66 1.12 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 110.473 -3.058 . . . . 0.0 112.909 -175.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -116.2 136.64 23.06 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 115.449 -2.215 . . . . 0.0 108.076 153.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -67.61 19.69 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.987 1 C-N-CA 125.911 4.407 . . . . 0.0 114.688 -173.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.464 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -70.62 -21.86 62.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.863 0.865 . . . . 0.0 110.64 154.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 tt -119.19 -75.98 0.58 Allowed 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 126.02 1.728 . . . . 0.0 108.23 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 50.9 t -145.92 -59.83 0.32 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 t60 . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 -160.132 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 119.537 -0.268 . . . . 0.0 110.789 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -150.35 167.03 13.81 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.787 2.035 . . . . 0.0 108.808 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.14 78.19 0.81 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.154 2.569 . . . . 0.0 112.194 173.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.72 38.96 0.11 Allowed Glycine 0 N--CA 1.47 0.91 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -132.26 -170.46 2.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.657 1.183 . . . . 0.0 111.537 -171.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -111.93 121.64 45.57 Favored 'General case' 0 CA--C 1.56 1.359 1 CA-C-O 128.844 4.164 . . . . 0.0 116.675 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.23 107.48 19.96 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 118.216 -2.802 . . . . 0.0 112.824 170.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.6 t -83.55 123.56 29.88 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.752 1.621 . . . . 0.0 111.334 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.36 -12.76 4.1 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -66.74 -29.6 69.62 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 120.858 1.663 . . . . 0.0 111.775 165.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m 127.95 55.92 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 1 C-N-CA 132.052 4.141 . . . . 0.0 110.732 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -132.51 132.46 42.67 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 124.19 1.948 . . . . 0.0 115.344 -168.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.255 0.3 OUTLIER -98.66 119.38 37.3 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 118.863 -2.398 . . . . 0.0 110.493 161.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.24 168.47 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 115.028 -2.415 . . . . 0.0 105.993 171.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -93.84 150.81 20.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 128.366 3.541 . . . . 0.0 112.979 -169.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.2 -16.1 30.19 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 126.756 2.535 . . . . 0.0 114.305 -166.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -45.92 -26.82 0.76 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.117 -1.614 . . . . 0.0 113.297 161.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.8 m0 -99.03 -5.44 30.37 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-O 126.844 3.211 . . . . 0.0 110.377 -172.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -76.99 109.94 11.21 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 115.683 -4.385 . . . . 0.0 109.255 171.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 p 42.47 53.88 4.53 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 115.983 1.845 . . . . 0.0 115.983 -169.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -68.05 -25.87 65.57 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.251 140.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.37 14.38 51.05 Favored Glycine 0 CA--C 1.53 0.976 0 CA-C-O 117.179 -1.901 . . . . 0.0 113.313 -167.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -110.35 139.32 45.66 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-O 126.555 3.074 . . . . 0.0 113.68 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -40.59 -40.3 1.23 Allowed 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.706 2.402 . . . . 0.0 114.363 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.617 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.0 OUTLIER 30.42 -47.52 0.0 OUTLIER 'General case' 0 C--N 1.348 0.504 1 C-N-CA 139.146 6.978 . . . . 0.0 114.857 178.611 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.405 ' C ' ' H ' ' A' ' 33' ' ' ASP . 44.0 t -73.88 -24.81 59.78 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.982 3.313 . . . . 0.0 116.29 169.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.0 -27.52 0.16 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 126.994 2.118 . . . . 0.0 113.941 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -78.2 -13.96 59.64 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.87 2.068 . . . . 0.0 110.788 158.763 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 49.82 58.12 5.79 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.376 2.27 . . . . 0.0 110.793 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -69.78 -58.61 3.69 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.617 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -36.66 -65.11 0.3 Allowed 'General case' 0 C--O 1.248 0.987 1 C-N-CA 131.798 4.039 . . . . 0.0 110.669 173.069 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.27 16.58 1.96 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 111.035 -2.802 . . . . 0.0 113.513 -173.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -113.68 136.53 22.02 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-O 115.689 -2.1 . . . . 0.0 108.174 155.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -68.89 20.9 0.15 Allowed 'Trans proline' 0 CA--C 1.543 0.959 1 C-N-CA 125.768 4.312 . . . . 0.0 114.552 -173.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.464 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -70.34 -21.35 62.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.629 0.772 . . . . 0.0 110.403 152.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -120.42 -76.86 0.58 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 125.78 1.632 . . . . 0.0 108.828 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.2 t -142.38 -61.5 0.44 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.8 t60 . . . . . 0 CA--C 1.541 0.619 0 C-N-CA 126.726 2.01 . . . . 0.0 115.565 -166.281 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 119.635 -0.221 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -150.48 166.11 15.88 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 126.986 2.114 . . . . 0.0 108.78 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.22 78.95 1.13 Allowed 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.05 2.5 . . . . 0.0 112.547 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.26 37.55 0.09 OUTLIER Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.685 1.136 . . . . 0.0 115.209 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -131.03 -170.14 2.3 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.0 1.32 . . . . 0.0 111.598 -168.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -113.75 122.41 47.0 Favored 'General case' 0 CA--C 1.56 1.33 1 CA-C-O 128.987 4.232 . . . . 0.0 116.546 -178.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.88 109.6 22.28 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 118.233 -2.792 . . . . 0.0 112.394 170.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 36.5 t -83.48 124.24 30.52 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.352 1.861 . . . . 0.0 111.307 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.53 -12.91 4.5 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 174.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.5 -29.34 69.42 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.871 1.669 . . . . 0.0 111.84 165.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 m 128.02 52.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.354 1 C-N-CA 132.186 4.194 . . . . 0.0 110.901 169.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -130.08 134.83 47.63 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 124.419 2.057 . . . . 0.0 115.66 -167.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 121.39 39.58 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 118.77 -2.456 . . . . 0.0 110.428 162.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.22 164.15 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 114.765 -2.541 . . . . 0.0 105.964 169.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -88.84 151.21 22.5 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.541 3.65 . . . . 0.0 112.721 -172.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -61.21 -16.0 40.4 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 126.39 2.306 . . . . 0.0 114.697 -166.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.39 -38.14 2.62 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.692 1.587 . . . . 0.0 110.792 161.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.807 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 5.7 m95 -88.87 -5.5 57.98 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 124.788 2.232 . . . . 0.0 108.982 -164.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.3 mttt -77.97 134.91 37.76 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 117.983 -2.948 . . . . 0.0 109.443 165.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.8 m 60.33 15.29 5.29 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -175.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -11.15 58.65 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.263 1.825 . . . . 0.0 112.104 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.41 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 72.96 -3.51 28.24 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-O 116.997 -2.001 . . . . 0.0 114.481 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -91.16 133.97 34.93 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 126.479 3.037 . . . . 0.0 111.18 165.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -35.3 -44.92 0.29 Allowed 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 128.368 2.667 . . . . 0.0 112.872 169.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 35.64 -49.87 0.0 OUTLIER 'General case' 0 C--N 1.349 0.546 1 C-N-CA 138.746 6.818 . . . . 0.0 114.288 175.498 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.437 ' C ' ' H ' ' A' ' 33' ' ' ASP . 25.5 t -65.09 -23.87 67.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.469 3.108 . . . . 0.0 115.518 163.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.62 -25.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.997 2.119 . . . . 0.0 113.881 -178.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.437 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -83.7 -11.89 56.59 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.223 2.209 . . . . 0.0 110.762 163.175 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.0 m120 51.1 64.06 1.99 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 127.191 2.196 . . . . 0.0 109.891 -174.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 m -77.13 -60.86 2.19 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 -176.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.807 ' OD2' ' O ' ' A' ' 23' ' ' TRP . 17.4 p-10 -57.03 -52.0 67.0 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 126.111 2.863 . . . . 0.0 111.234 -175.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.465 ' OE2' ' OD2' ' A' ' 36' ' ' ASP . 12.1 mm-40 -75.09 15.58 0.4 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 113.091 -1.868 . . . . 0.0 113.31 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.432 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -118.09 143.44 32.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-O 117.06 -1.448 . . . . 0.0 109.634 155.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -71.05 21.66 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.847 1 C-N-CA 125.823 4.349 . . . . 0.0 114.25 -171.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -68.65 -21.42 64.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 110.235 151.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -128.72 -75.97 0.56 Allowed 'General case' 0 C--N 1.343 0.295 0 C-N-CA 125.743 1.617 . . . . 0.0 108.792 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 35.5 t -132.41 -76.42 0.5 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.6 t60 . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 127.118 2.167 . . . . 0.0 115.0 -160.289 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.483 1.197 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -143.43 168.02 14.06 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.694 2.398 . . . . 0.0 107.276 175.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -72.91 72.14 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.99 2.46 . . . . 0.0 112.187 178.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.53 41.7 0.04 OUTLIER Glycine 0 CA--C 1.531 1.035 0 C-N-CA 124.8 1.19 . . . . 0.0 114.652 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -136.2 -172.1 3.05 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.158 1.383 . . . . 0.0 111.578 -168.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -127.13 141.95 51.63 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 111.819 -3.943 . . . . 0.0 112.715 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.8 140.36 52.46 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 128.301 3.501 . . . . 0.0 114.861 166.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.6 t -86.16 126.9 34.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.266 3.426 . . . . 0.0 110.674 -175.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.91 -15.69 5.36 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 173.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -67.88 -26.22 65.9 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 120.392 1.451 . . . . 0.0 112.069 167.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m 127.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.475 1 C-N-CA 131.938 4.095 . . . . 0.0 111.317 164.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -132.38 133.21 43.67 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -166.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 p -99.37 123.74 43.9 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 117.623 -3.173 . . . . 0.0 111.043 169.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.66 169.37 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-O 115.286 -2.292 . . . . 0.0 111.183 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.518 ' H ' ' NE2' ' A' ' 20' ' ' GLN . 1.8 pm0 -88.23 147.39 24.86 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.195 2.809 . . . . 0.0 114.279 -173.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -53.25 -18.33 2.31 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 129.045 2.938 . . . . 0.0 115.224 -169.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.75 -33.8 3.25 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 121.215 1.825 . . . . 0.0 110.963 163.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -85.87 -8.56 57.98 Favored 'General case' 0 CA--C 1.558 1.26 0 CA-C-O 124.761 2.219 . . . . 0.0 109.825 -167.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -76.23 108.02 8.88 Favored 'General case' 0 C--N 1.351 0.67 0 O-C-N 117.543 -3.223 . . . . 0.0 110.525 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.0 p 41.19 58.78 2.5 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -169.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -80.17 -27.0 39.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.891 143.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.6 4.37 67.9 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.103 -1.387 . . . . 0.0 113.555 -165.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.11 123.52 27.43 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 124.017 1.865 . . . . 0.0 108.139 168.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -52.71 -24.66 9.09 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 118.894 -2.379 . . . . 0.0 114.154 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.795 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.0 OUTLIER 28.54 -48.41 0.0 OUTLIER 'General case' 0 C--N 1.347 0.467 1 C-N-CA 139.61 7.164 . . . . 0.0 114.65 175.149 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.426 ' C ' ' H ' ' A' ' 33' ' ' ASP . 52.5 t -70.47 -20.92 62.84 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 127.444 2.297 . . . . 0.0 115.915 168.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 70.36 -30.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.939 2.096 . . . . 0.0 113.236 -176.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -79.27 -13.83 59.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 128.083 2.553 . . . . 0.0 111.415 170.69 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.9 m120 48.62 88.83 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.702 2.001 . . . . 0.0 110.814 -159.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.6 m -98.34 -68.24 0.81 Allowed 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.795 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.9 p-10 -26.65 -66.6 0.06 Allowed 'General case' 0 C--O 1.248 1.009 0 CA-C-O 127.734 3.635 . . . . 0.0 111.952 153.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.404 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 17.3 mm-40 -91.46 25.81 2.49 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.634 -172.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.446 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -112.93 139.94 23.51 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 115.268 -2.301 . . . . 0.0 108.799 148.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.75 21.76 0.14 Allowed 'Trans proline' 0 CA--C 1.545 1.026 1 C-N-CA 125.789 4.326 . . . . 0.0 114.356 -175.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.446 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -73.32 -20.59 60.76 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.107 0.963 . . . . 0.0 110.27 154.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 tt -121.58 -81.11 0.63 Allowed 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.268 1.427 . . . . 0.0 108.782 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.2 t -146.37 -43.0 0.2 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 4.2 t-80 . . . . . 0 N--CA 1.478 0.944 0 CA-C-N 121.167 1.803 . . . . 0.0 114.626 177.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -145.25 162.01 39.23 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 126.73 2.012 . . . . 0.0 108.759 177.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.93 75.18 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.349 2.699 . . . . 0.0 112.25 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.6 21.64 0.03 OUTLIER Glycine 0 CA--C 1.531 1.087 0 C-N-CA 125.006 1.289 . . . . 0.0 115.632 -176.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.53 -171.45 2.38 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.658 1.229 . . . . 0.0 112.318 -165.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -106.6 122.34 46.14 Favored 'General case' 0 CA--C 1.557 1.223 1 CA-C-O 128.768 4.127 . . . . 0.0 116.109 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.15 106.18 18.34 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 118.385 -2.697 . . . . 0.0 112.891 170.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 t -82.59 124.71 30.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.716 1.606 . . . . 0.0 111.173 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.08 -14.75 1.7 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -35.81 81.88 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.186 1.357 . . . . 0.0 111.079 166.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.9 m 132.45 49.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.282 1 C-N-CA 132.284 4.233 . . . . 0.0 111.488 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -125.11 135.8 53.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 116.037 1.866 . . . . 0.0 116.037 -167.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.96 120.12 37.8 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.688 -1.883 . . . . 0.0 110.944 163.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.09 171.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 114.532 -2.651 . . . . 0.0 106.37 171.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -94.7 147.04 23.72 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 128.502 3.626 . . . . 0.0 113.287 -168.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -59.38 -15.92 19.65 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 126.759 2.537 . . . . 0.0 114.333 -168.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -48.57 -25.89 1.95 Allowed 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.336 -1.477 . . . . 0.0 112.84 163.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -98.97 -2.84 36.42 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-O 126.227 2.917 . . . . 0.0 109.876 -171.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -79.38 121.92 25.75 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 116.209 -4.057 . . . . 0.0 109.45 168.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.271 1.9 p 45.07 51.56 8.84 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -172.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.8 -16.16 28.82 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 164.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.405 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 107.54 -11.54 39.14 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-O 115.721 -2.71 . . . . 0.0 116.484 -172.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -117.35 145.12 44.26 Favored 'General case' 0 N--CA 1.477 0.911 1 CA-C-O 129.27 4.367 . . . . 0.0 117.342 -178.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.407 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.78 55.59 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 O-C-N 118.044 -2.91 . . . . 0.0 111.145 170.104 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.538 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -55.72 -31.48 62.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.532 1.933 . . . . 0.0 109.857 173.467 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.406 ' C ' ' H ' ' A' ' 33' ' ' ASP . 42.5 t -76.12 -15.05 60.16 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 127.928 2.491 . . . . 0.0 115.662 174.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.2 -39.2 0.14 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.653 2.381 . . . . 0.0 113.732 -167.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.406 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -70.67 -16.64 62.82 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.26 2.224 . . . . 0.0 111.256 175.77 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 49.7 78.76 0.09 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.359 2.264 . . . . 0.0 110.297 -166.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.6 m -84.75 -76.49 0.31 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 115.386 -2.245 . . . . 0.0 105.421 167.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.538 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -22.55 -71.02 0.02 OUTLIER 'General case' 0 C--O 1.247 0.956 2 C-N-CA 134.936 5.294 . . . . 0.0 112.698 179.963 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.405 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 41.4 mm-40 -73.44 7.01 2.55 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 110.761 -2.927 . . . . 0.0 114.248 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.419 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -119.68 143.18 34.34 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 116.483 -1.722 . . . . 0.0 108.419 167.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.73 20.72 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.907 1 C-N-CA 125.904 4.403 . . . . 0.0 114.149 -170.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.419 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -70.25 -21.14 63.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.104 0.562 . . . . 0.0 110.132 152.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tt -126.64 -77.79 0.58 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 125.61 1.564 . . . . 0.0 109.414 176.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 49.0 t -136.25 -62.94 0.65 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 . . . . . 0 N--CA 1.481 1.109 0 C-N-CA 126.621 1.968 . . . . 0.0 115.584 -166.536 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -141.74 -166.2 0.12 Allowed Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.07 3.348 . . . . 0.0 105.889 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.94 79.99 3.09 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 CA-C-N 123.99 2.461 . . . . 0.0 110.404 170.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 126.64 45.95 0.22 Allowed Glycine 0 C--N 1.348 1.206 0 N-CA-C 119.224 2.45 . . . . 0.0 119.224 169.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -125.83 -156.96 0.76 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.194 1.997 . . . . 0.0 111.228 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -114.93 126.84 55.25 Favored 'General case' 0 CA--C 1.558 1.288 1 CA-C-O 128.975 4.226 . . . . 0.0 116.785 174.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -103.93 111.68 24.33 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 117.995 -2.941 . . . . 0.0 111.92 173.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.2 t -84.39 125.56 32.43 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 128.626 2.77 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.02 -13.47 2.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 174.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -66.4 -30.51 70.9 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.764 1.62 . . . . 0.0 111.768 165.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m 127.56 51.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.322 1 C-N-CA 132.258 4.223 . . . . 0.0 110.558 169.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -130.12 138.03 50.47 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 123.71 1.719 . . . . 0.0 115.389 -165.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.444 0.5 OUTLIER -111.3 119.83 40.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 118.577 -2.577 . . . . 0.0 114.12 168.439 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.75 162.36 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 128.527 2.731 . . . . 0.0 105.418 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -86.35 147.13 26.18 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 128.579 3.674 . . . . 0.0 112.906 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -60.41 -13.81 15.49 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 128.102 2.561 . . . . 0.0 113.987 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -35.83 3.01 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 119.75 -1.844 . . . . 0.0 111.336 160.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -90.26 -3.72 57.62 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-O 124.864 2.269 . . . . 0.0 108.883 -166.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -79.49 124.47 28.51 Favored 'General case' 0 C--N 1.358 0.948 0 O-C-N 117.765 -3.084 . . . . 0.0 109.509 165.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.5 p 37.88 65.62 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.942 2.097 . . . . 0.0 116.234 -163.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.739 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 19.5 p30 -99.2 -4.21 32.59 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 160.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 75.84 12.71 83.71 Favored Glycine 0 CA--C 1.538 1.531 0 CA-C-O 116.55 -2.25 . . . . 0.0 115.089 -162.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -105.76 122.79 46.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.769 2.785 . . . . 0.0 112.908 177.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -24.59 -50.02 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 127.52 2.328 . . . . 0.0 113.633 162.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 30.75 -49.55 0.0 OUTLIER 'General case' 0 C--N 1.352 0.682 1 C-N-CA 139.109 6.964 . . . . 0.0 114.621 -179.56 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.412 ' C ' ' H ' ' A' ' 33' ' ' ASP . 35.0 t -66.21 -23.19 66.39 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 129.42 3.088 . . . . 0.0 115.384 167.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.46 -29.55 0.18 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.638 1.975 . . . . 0.0 113.563 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.412 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -72.74 -19.4 61.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.177 1.791 . . . . 0.0 110.494 164.456 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.7 t30 45.61 87.55 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.808 1.643 . . . . 0.0 110.812 -155.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.6 m -86.26 -73.86 0.44 Allowed 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 114.44 -2.695 . . . . 0.0 104.157 163.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -44.51 94.01 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 128.029 3.33 . . . . 0.0 111.137 -154.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.739 ' OE2' ' OD1' ' A' ' 26' ' ' ASP . 34.1 mm-40 -74.94 6.15 4.39 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 119.27 -2.143 . . . . 0.0 111.907 -173.602 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.475 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -104.12 135.62 19.31 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 116.656 -1.64 . . . . 0.0 108.044 161.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.79 20.28 0.15 Allowed 'Trans proline' 0 C--N 1.356 0.957 1 C-N-CA 126.459 4.772 . . . . 0.0 114.303 -171.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.475 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -66.86 -23.16 65.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.298 0.639 . . . . 0.0 110.308 152.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -125.89 -79.98 0.61 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.99 1.716 . . . . 0.0 108.936 177.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 21.3 t -157.26 118.3 3.62 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 . . . . . 0 N--CA 1.466 0.361 0 O-C-N 120.539 -1.351 . . . . 0.0 109.039 172.605 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.496 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -149.76 158.74 37.09 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.931 2.092 . . . . 0.0 108.0 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -64.14 92.8 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.443 2.762 . . . . 0.0 112.225 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.61 -17.97 2.62 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 126.033 1.778 . . . . 0.0 114.482 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -78.68 -167.94 1.25 Allowed 'General case' 0 C--O 1.239 0.525 0 C-N-CA 125.435 1.494 . . . . 0.0 111.753 -171.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -113.43 120.94 42.78 Favored 'General case' 0 CA--C 1.561 1.368 1 CA-C-O 129.143 4.306 . . . . 0.0 116.323 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.93 109.18 20.62 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 117.955 -2.965 . . . . 0.0 112.642 167.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.01 29.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.898 1.679 . . . . 0.0 110.888 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -12.05 3.55 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -65.29 -31.56 72.76 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.739 1.609 . . . . 0.0 111.845 164.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.5 m 128.55 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 C-N-CA 132.131 4.172 . . . . 0.0 110.61 170.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -129.19 134.8 48.17 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 124.079 1.895 . . . . 0.0 115.311 -168.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.37 119.8 36.57 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 119.044 -2.285 . . . . 0.0 110.731 161.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.71 160.82 39.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 115.019 -2.42 . . . . 0.0 105.979 170.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -83.1 150.47 26.27 Favored 'General case' 0 N--CA 1.448 -0.532 1 O-C-N 129.379 4.174 . . . . 0.0 112.515 -173.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -49.73 -24.56 2.38 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 127.42 2.95 . . . . 0.0 115.119 -171.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -38.55 7.23 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 121.441 1.928 . . . . 0.0 110.183 169.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -83.6 -7.99 59.4 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-O 124.781 2.229 . . . . 0.0 108.089 -163.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -77.02 131.44 38.43 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 118.006 -2.934 . . . . 0.0 110.381 166.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 m 63.4 17.59 10.41 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.031 2.132 . . . . 0.0 114.457 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.43 -11.19 59.92 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 128.193 2.597 . . . . 0.0 113.382 -165.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.435 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 84.37 6.59 85.88 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 116.45 -2.306 . . . . 0.0 114.908 -173.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.88 146.6 43.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 128.438 3.97 . . . . 0.0 117.061 175.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -64.65 48.42 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.43 2.692 . . . . 0.0 111.363 165.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -45.31 -34.71 3.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.958 2.503 . . . . 0.0 110.247 164.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.432 ' C ' ' H ' ' A' ' 33' ' ' ASP . 29.2 t -78.99 -14.89 58.93 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 128.4 2.68 . . . . 0.0 115.097 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.19 -30.16 0.08 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.386 2.275 . . . . 0.0 114.945 -172.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -79.53 -20.87 46.1 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 127.542 2.337 . . . . 0.0 110.601 171.206 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 52.83 82.31 0.07 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.123 1.769 . . . . 0.0 109.909 -163.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -88.56 -72.49 0.54 Allowed 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 113.814 -2.994 . . . . 0.0 103.885 168.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -45.04 93.01 Favored 'General case' 0 C--O 1.241 0.618 0 O-C-N 127.921 3.263 . . . . 0.0 111.654 -156.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.435 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 40.4 mm-40 -70.97 5.41 2.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.29 -176.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -113.78 140.72 25.05 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 117.016 -1.469 . . . . 0.0 108.941 165.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -71.13 21.45 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.859 1 C-N-CA 126.034 4.489 . . . . 0.0 114.162 -170.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.434 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -67.51 -22.25 65.45 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.956 -0.465 . . . . 0.0 110.231 151.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.9 tt -129.15 -76.19 0.55 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 125.983 1.713 . . . . 0.0 109.201 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.3 t -134.57 -65.76 0.63 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 116.056 1.872 . . . . 0.0 116.056 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 . . . . . 0 CA--C 1.554 1.105 0 C-N-CA 124.606 1.162 . . . . 0.0 113.121 -160.797 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.223 0 CA-C-O 119.725 -0.486 . . . . 0.0 114.043 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.8 t -134.25 85.58 38.46 Favored Pre-proline 0 CA--C 1.539 0.545 0 C-N-CA 125.262 1.425 . . . . 0.0 109.761 175.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -82.85 110.1 1.81 Allowed 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 124.087 3.191 . . . . 0.0 112.301 -176.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.68 -62.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.263 1.975 . . . . 0.0 111.003 174.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 81.48 -11.48 1.08 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.755 2.822 . . . . 0.0 117.288 168.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.8 t -162.94 -50.05 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 126.059 1.744 . . . . 0.0 109.764 165.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.6 mt-30 -129.8 -174.59 0.39 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.171 3.388 . . . . 0.0 105.068 168.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -77.37 66.7 7.87 Favored 'Trans proline' 0 CA--C 1.549 1.269 0 CA-C-N 123.717 2.363 . . . . 0.0 112.867 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.01 59.89 0.04 OUTLIER Glycine 0 C--N 1.345 1.064 0 C-N-CA 124.345 0.974 . . . . 0.0 115.065 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -133.29 -158.9 0.92 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.069 1.348 . . . . 0.0 111.495 -166.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -121.86 127.81 50.92 Favored 'General case' 0 CA--C 1.569 1.703 1 CA-C-O 129.295 4.379 . . . . 0.0 117.879 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.33 111.63 23.96 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 117.154 -3.466 . . . . 0.0 112.275 171.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 38.1 t -87.35 127.98 35.19 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.971 1.708 . . . . 0.0 111.017 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.64 -11.45 4.95 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -63.38 -28.37 69.94 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.858 1.663 . . . . 0.0 112.032 163.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.7 m 126.55 45.42 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.425 1 C-N-CA 132.239 4.215 . . . . 0.0 110.885 166.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.8 mmm-85 -126.53 135.94 51.95 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 123.706 1.717 . . . . 0.0 114.641 -158.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.99 116.46 30.25 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 119.791 -1.818 . . . . 0.0 110.519 166.08 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -139.07 176.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 115.381 -2.247 . . . . 0.0 105.733 174.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -103.15 149.4 24.68 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 128.501 3.626 . . . . 0.0 112.429 -162.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.426 ' HA ' ' HE2' ' A' ' 24' ' ' LYS . 10.0 tt0 -53.16 -19.36 2.9 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 127.714 3.134 . . . . 0.0 113.942 -167.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.38 -42.0 9.69 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.668 1.576 . . . . 0.0 109.632 169.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -73.49 -17.58 61.21 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 123.928 1.823 . . . . 0.0 108.386 -163.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HE2' ' HA ' ' A' ' 21' ' ' GLU . 46.1 mtmt -80.47 110.1 15.61 Favored 'General case' 0 C--N 1.357 0.917 0 O-C-N 119.879 -1.763 . . . . 0.0 108.881 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 m 71.85 24.35 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.63 1.172 . . . . 0.0 112.376 -170.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.57 -30.36 52.55 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.667 -1.271 . . . . 0.0 110.752 173.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.79 -1.41 71.3 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 117.609 -1.662 . . . . 0.0 114.137 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -96.09 150.58 20.34 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 125.944 2.783 . . . . 0.0 111.891 162.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -48.92 -42.42 37.11 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 111.842 -2.436 . . . . 0.0 113.018 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 17.1 t0 59.61 -60.89 0.05 Allowed 'General case' 0 N--CA 1.477 0.904 1 C-N-CA 133.174 4.59 . . . . 0.0 110.914 151.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.6 t -52.11 -20.33 2.44 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 128.146 2.579 . . . . 0.0 116.942 150.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -34.03 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.646 1.978 . . . . 0.0 113.035 -172.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -12.1 53.53 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.885 1.674 . . . . 0.0 110.816 172.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.79 63.86 1.92 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.862 1.665 . . . . 0.0 109.951 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 m -85.68 -56.1 3.66 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -55.8 -47.26 77.43 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 126.411 3.005 . . . . 0.0 110.655 179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.407 ' HA ' ' HA ' ' A' ' 43' ' ' HIS 0.261 8.9 mm-40 -83.6 17.89 2.08 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 119.13 -2.231 . . . . 0.0 113.468 -178.37 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.441 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -106.44 132.85 20.56 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-O 116.76 -1.59 . . . . 0.0 108.06 150.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.89 20.99 0.18 Allowed 'Trans proline' 0 CA--C 1.542 0.878 1 C-N-CA 126.177 4.585 . . . . 0.0 114.334 -169.819 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.441 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -68.28 -22.22 64.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.314 0.646 . . . . 0.0 110.378 152.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tt -120.61 -74.39 0.61 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.471 1.508 . . . . 0.0 108.935 177.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.0 t -139.92 -70.12 0.4 Allowed 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 116.311 1.967 . . . . 0.0 116.311 176.262 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER 63.87 86.19 0.12 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.532 1.933 . . . . 0.0 114.197 -164.463 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -70.43 142.89 51.96 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.257 151.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 . . . . . 0 CA--C 1.534 0.363 0 C-N-CA 124.733 1.213 . . . . 0.0 109.671 -179.32 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.078 0 CA-C-O 118.875 -0.958 . . . . 0.0 114.533 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.9 m 105.66 -36.27 0.0 OUTLIER Pre-proline 0 N--CA 1.479 1.004 0 C-N-CA 130.69 3.596 . . . . 0.0 117.299 169.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.97 159.96 43.89 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 CA-C-N 123.892 2.426 . . . . 0.0 112.534 -175.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -76.88 54.69 4.63 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 125.09 3.86 . . . . 0.0 111.793 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -66.41 -19.64 65.85 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.526 1.931 . . . . 0.0 114.756 -161.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.93 -55.5 1.98 Allowed 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 126.051 1.74 . . . . 0.0 109.294 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -145.01 167.7 13.96 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 128.162 2.585 . . . . 0.0 107.33 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.44 70.66 4.79 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.154 2.57 . . . . 0.0 112.913 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.18 46.02 0.03 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.898 1.237 . . . . 0.0 113.756 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -133.3 -172.69 3.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.606 1.162 . . . . 0.0 112.155 -166.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -109.86 124.55 51.53 Favored 'General case' 0 CA--C 1.56 1.354 1 CA-C-O 128.681 4.086 . . . . 0.0 116.449 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.4 108.11 20.73 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 118.421 -2.674 . . . . 0.0 112.627 170.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.0 t -85.55 125.01 32.76 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.51 1.524 . . . . 0.0 111.233 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.71 -16.63 4.51 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 173.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -68.5 -24.45 64.67 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 120.635 1.561 . . . . 0.0 112.031 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.7 m 126.28 50.75 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 131.84 4.056 . . . . 0.0 111.221 165.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -128.38 135.72 49.93 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 124.231 1.967 . . . . 0.0 115.53 -166.263 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.18 121.12 38.72 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 119.353 -2.092 . . . . 0.0 110.413 160.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.34 167.69 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 114.087 -2.863 . . . . 0.0 106.729 173.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -87.24 144.73 26.68 Favored 'General case' 0 N--CA 1.45 -0.469 1 O-C-N 129.395 4.185 . . . . 0.0 113.301 -170.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.54 -16.4 9.89 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 128.122 2.569 . . . . 0.0 114.249 -170.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.0 ttp85 -50.19 -27.13 5.4 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.587 -1.321 . . . . 0.0 112.614 165.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -93.9 -4.34 50.09 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-O 126.33 2.967 . . . . 0.0 109.579 -171.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -78.55 111.29 14.45 Favored 'General case' 0 C--N 1.355 0.814 0 O-C-N 116.471 -3.893 . . . . 0.0 109.029 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.283 8.1 p 41.75 53.27 4.01 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -166.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -76.8 -24.85 52.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 118.756 -0.64 . . . . 0.0 112.269 145.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.6 -8.49 40.31 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-O 117.063 -1.965 . . . . 0.0 115.339 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -98.1 144.77 27.23 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 125.987 2.803 . . . . 0.0 113.887 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.84 58.42 0.33 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 118.616 -2.552 . . . . 0.0 110.878 170.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.22 -30.66 62.63 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 127.206 2.202 . . . . 0.0 110.12 175.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 51.6 t -80.38 -15.38 56.96 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.69 1.996 . . . . 0.0 115.779 175.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.37 -36.55 0.13 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.321 2.248 . . . . 0.0 114.849 -170.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -19.22 61.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.19 2.596 . . . . 0.0 111.014 169.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.7 74.56 0.44 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.365 2.266 . . . . 0.0 111.003 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.1 m -102.24 -58.41 1.88 Allowed 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.728 0.811 . . . . 0.0 110.237 -177.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -28.6 -67.65 0.07 Allowed 'General case' 0 C--O 1.247 0.923 0 CA-C-O 128.012 3.767 . . . . 0.0 111.631 158.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 20.4 mm-40 -86.77 21.0 2.35 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 112.151 -2.295 . . . . 0.0 112.863 -173.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.45 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -111.6 135.52 21.1 Favored Pre-proline 0 CA--C 1.542 0.658 0 CA-C-O 115.085 -2.388 . . . . 0.0 107.994 154.469 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -68.31 21.66 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.074 1 C-N-CA 125.735 4.29 . . . . 0.0 114.614 -173.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.45 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -73.05 -20.87 60.89 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.052 0.941 . . . . 0.0 110.293 153.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 tt -120.15 -80.5 0.62 Allowed 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.716 1.607 . . . . 0.0 108.576 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 38.8 t -141.74 -54.36 0.45 Allowed 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.411 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 32.2 t-80 57.15 99.25 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.536 1.534 . . . . 0.0 114.777 -171.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -62.22 109.5 1.34 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.833 -0.542 . . . . 0.0 111.312 175.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 83.7 t60 . . . . . 0 N--CA 1.466 0.355 0 C-N-CA 125.374 1.47 . . . . 0.0 112.11 -173.615 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.064 0 CA-C-O 119.182 -0.788 . . . . 0.0 113.651 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.7 m 110.55 -58.47 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.867 0 C-N-CA 131.609 3.964 . . . . 0.0 114.399 173.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -72.29 159.38 49.68 Favored 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 122.226 1.951 . . . . 0.0 114.706 -168.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -78.42 60.31 7.47 Favored 'Trans proline' 0 CA--C 1.544 1.022 1 C-N-CA 125.393 4.062 . . . . 0.0 113.972 -169.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -19.18 63.19 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -176.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.89 -58.54 1.96 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.227 1.011 . . . . 0.0 110.477 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -150.13 167.83 12.22 Favored Pre-proline 0 CA--C 1.552 1.019 0 C-N-CA 128.883 2.873 . . . . 0.0 106.908 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.66 76.89 1.45 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 123.323 2.682 . . . . 0.0 113.461 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.7 43.8 0.07 OUTLIER Glycine 0 N--CA 1.473 1.115 0 C-N-CA 124.441 1.02 . . . . 0.0 114.577 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -128.25 -174.51 3.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.271 1.035 . . . . 0.0 113.181 -162.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -109.14 121.29 44.83 Favored 'General case' 0 CA--C 1.563 1.465 1 CA-C-O 128.964 4.221 . . . . 0.0 116.214 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.8 107.79 20.32 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 118.223 -2.798 . . . . 0.0 112.75 172.383 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.5 t -82.59 124.09 29.82 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.302 1.441 . . . . 0.0 111.508 175.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.83 -12.53 3.18 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 173.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -67.38 -30.62 70.45 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.925 1.693 . . . . 0.0 111.684 165.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.9 m 128.03 53.78 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.273 1 C-N-CA 132.186 4.194 . . . . 0.0 110.741 170.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -129.28 132.16 47.12 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-O 124.341 2.02 . . . . 0.0 114.835 -167.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -101.49 117.57 35.19 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 118.739 -2.476 . . . . 0.0 110.212 167.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.18 169.41 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 114.961 -2.447 . . . . 0.0 105.987 172.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.98 154.45 18.15 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.547 3.029 . . . . 0.0 113.704 -171.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.05 -15.38 31.74 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 127.162 2.789 . . . . 0.0 114.196 -168.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -43.27 -33.52 0.99 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.545 -1.347 . . . . 0.0 112.82 160.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -95.41 -0.29 52.64 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 125.704 2.669 . . . . 0.0 111.825 -171.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.6 mttt -79.44 101.06 7.96 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 117.398 -3.314 . . . . 0.0 108.807 173.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.337 21.2 p 49.76 57.84 6.09 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -165.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.1 p30 -75.61 -23.03 56.38 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.679 137.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.87 9.71 65.71 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-O 117.668 -1.629 . . . . 0.0 113.932 -168.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -93.98 135.37 35.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.321 2.06 . . . . 0.0 110.949 171.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -29.29 -13.81 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 1 C-N-CA 132.344 4.258 . . . . 0.0 119.523 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.13 -23.86 40.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 123.591 1.663 . . . . 0.0 109.566 -85.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.408 ' C ' ' H ' ' A' ' 33' ' ' ASP . 45.5 t -56.11 -21.62 23.37 Favored 'General case' 0 N--CA 1.429 -1.494 1 C-N-CA 132.272 4.229 . . . . 0.0 116.176 164.014 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 69.66 -29.77 0.18 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.663 2.385 . . . . 0.0 113.494 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -71.59 -16.66 62.3 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.637 1.975 . . . . 0.0 110.545 157.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.19 64.24 1.93 Allowed 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 126.17 1.788 . . . . 0.0 110.233 -176.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.5 m -73.56 -64.85 0.91 Allowed 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 176.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -39.29 -63.8 0.52 Allowed 'General case' 0 N--CA 1.441 -0.884 2 C-N-CA 132.752 4.421 . . . . 0.0 110.524 -177.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -84.81 21.34 1.58 Allowed 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 111.036 -2.802 . . . . 0.0 112.544 -172.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.458 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -117.68 139.52 26.42 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 116.136 -1.888 . . . . 0.0 108.428 153.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -69.12 20.72 0.15 Allowed 'Trans proline' 0 CA--C 1.542 0.886 1 C-N-CA 125.875 4.383 . . . . 0.0 114.596 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.458 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -69.65 -21.29 63.55 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.213 0.605 . . . . 0.0 110.388 152.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.1 tt -123.66 -76.07 0.59 Allowed 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.917 1.687 . . . . 0.0 108.786 178.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.4 t -139.74 -67.12 0.44 Allowed 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.6 t60 56.95 -59.41 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.626 1.97 . . . . 0.0 115.043 -161.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 59.45 -65.59 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 128.116 2.566 . . . . 0.0 113.043 -168.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 . . . . . 0 CA--C 1.54 0.579 0 C-N-CA 125.67 1.588 . . . . 0.0 109.728 171.11 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.469 ' N ' ' H ' ' A' ' 12' ' ' ALA . . . . . . . . 0 CA--C 1.531 1.085 0 CA-C-O 120.117 -0.269 . . . . 0.0 113.354 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.1 m -167.27 -56.17 0.01 OUTLIER Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 126.785 2.034 . . . . 0.0 111.267 172.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.72 160.01 50.82 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 121.583 1.522 . . . . 0.0 111.326 169.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -77.77 58.65 6.53 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 124.451 3.434 . . . . 0.0 111.546 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.5 tp60 -69.28 -23.91 63.89 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -155.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.44 -57.18 2.01 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.412 1.885 . . . . 0.0 108.079 173.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -139.25 168.96 13.53 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 128.471 2.708 . . . . 0.0 107.454 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.2 73.31 4.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.816 2.344 . . . . 0.0 113.082 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.41 46.58 0.02 OUTLIER Glycine 0 CA--C 1.528 0.904 0 C-N-CA 125.305 1.431 . . . . 0.0 112.988 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -134.99 -176.83 4.38 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.663 1.185 . . . . 0.0 112.47 -165.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -105.75 121.96 45.1 Favored 'General case' 0 CA--C 1.56 1.349 1 CA-C-O 128.689 4.09 . . . . 0.0 116.268 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.469 ' H ' ' N ' ' A' ' 1' ' ' GLY . . . -97.38 107.37 19.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 118.353 -2.717 . . . . 0.0 112.58 171.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.5 t -86.97 126.59 34.82 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.832 1.653 . . . . 0.0 111.725 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.48 -13.18 3.3 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 115.866 1.802 . . . . 0.0 115.866 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -66.77 -28.59 68.52 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.759 1.618 . . . . 0.0 111.744 165.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.4 m 128.36 48.49 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.382 1 C-N-CA 132.133 4.173 . . . . 0.0 110.912 166.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -126.85 136.04 51.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 124.265 1.983 . . . . 0.0 115.069 -162.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 120.01 37.34 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 119.406 -2.059 . . . . 0.0 110.326 163.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.6 170.82 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 114.501 -2.666 . . . . 0.0 106.341 172.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -94.07 147.44 23.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 128.439 3.587 . . . . 0.0 113.407 -168.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -53.59 -20.57 5.3 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 127.603 3.064 . . . . 0.0 113.809 -169.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -50.46 -28.52 8.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.948 0.899 . . . . 0.0 112.265 167.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -92.82 -5.41 51.12 Favored 'General case' 0 CA--C 1.565 1.52 0 CA-C-O 126.751 3.167 . . . . 0.0 109.237 -170.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.7 mtpt -80.16 102.5 9.44 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 116.368 -3.958 . . . . 0.0 108.493 171.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.294 21.1 p 45.99 60.04 3.4 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -165.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -71.07 -26.91 63.27 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.444 -1.253 . . . . 0.0 112.482 133.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.0 19.73 20.75 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-O 116.238 -2.423 . . . . 0.0 115.248 -172.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -128.74 152.46 48.4 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 126.726 3.155 . . . . 0.0 115.139 169.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -65.23 52.83 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 O-C-N 118.567 -2.583 . . . . 0.0 111.765 171.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.63 -29.54 59.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.368 1.867 . . . . 0.0 110.033 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.408 ' C ' ' H ' ' A' ' 33' ' ' ASP . 47.3 t -78.72 -13.55 59.75 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 127.572 2.349 . . . . 0.0 116.129 175.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.6 -34.51 0.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.991 2.116 . . . . 0.0 114.837 -172.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.408 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -74.63 -22.14 59.08 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 128.275 2.63 . . . . 0.0 111.074 170.118 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 56.97 86.41 0.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.358 2.263 . . . . 0.0 111.31 -168.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -105.05 -61.77 1.43 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.174 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -29.97 -67.46 0.08 Allowed 'General case' 0 C--O 1.246 0.873 1 CA-C-O 128.699 4.095 . . . . 0.0 111.763 166.634 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -86.18 17.87 3.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.069 -2.332 . . . . 0.0 112.906 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.494 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -107.94 139.35 20.57 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.032 156.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -68.09 20.69 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.864 1 C-N-CA 126.323 4.682 . . . . 0.0 114.27 -173.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -74.36 -20.7 59.99 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.127 0.971 . . . . 0.0 110.421 155.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 tt -125.76 -76.62 0.58 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.94 1.296 . . . . 0.0 109.218 -176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 47.6 t -138.53 -71.23 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 171.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 24.1 t60 58.19 96.07 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.83 1.652 . . . . 0.0 113.721 -162.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -153.58 68.57 0.79 Allowed 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.131 -0.981 . . . . 0.0 111.793 171.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 17.5 t60 . . . . . 0 CA--C 1.536 0.42 0 C-N-CA 123.708 0.803 . . . . 0.0 111.725 177.832 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.256 0 CA-C-O 119.532 -0.593 . . . . 0.0 114.215 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.4 p -145.31 157.68 52.54 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 125.529 1.532 . . . . 0.0 110.973 177.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -76.47 121.61 6.1 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 122.695 2.264 . . . . 0.0 111.05 178.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -72.31 -42.8 1.25 Allowed 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.972 2.448 . . . . 0.0 112.509 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 85.41 -27.38 0.09 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 129.694 3.198 . . . . 0.0 116.524 166.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.2 t -152.93 -52.52 0.11 Allowed 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 120.564 1.529 . . . . 0.0 110.606 172.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -132.09 -179.65 1.12 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.394 3.478 . . . . 0.0 105.033 171.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -74.88 69.42 5.45 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.23 2.189 . . . . 0.0 113.165 -174.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.08 54.29 0.05 OUTLIER Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.94 1.257 . . . . 0.0 114.814 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -133.28 -165.94 1.69 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.766 1.283 . . . . 0.0 112.723 -166.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -117.41 125.08 50.36 Favored 'General case' 0 CA--C 1.564 1.502 1 CA-C-O 128.848 4.166 . . . . 0.0 118.205 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.3 107.09 18.35 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 117.725 -3.109 . . . . 0.0 112.678 171.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.35 127.02 31.96 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.851 1.26 . . . . 0.0 109.927 170.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.54 -21.91 19.11 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 170.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -7.3 38.02 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 119.849 1.204 . . . . 0.0 112.416 168.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.5 m 106.91 53.45 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.893 1 C-N-CA 132.059 4.144 . . . . 0.0 110.392 160.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.6 mmm-85 -130.76 131.26 44.62 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 123.063 1.411 . . . . 0.0 114.526 -166.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.332 0.1 OUTLIER -101.56 115.08 29.71 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 119.65 -1.906 . . . . 0.0 111.706 168.471 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -136.41 170.68 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 115.553 -2.165 . . . . 0.0 105.635 174.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -97.76 155.38 17.05 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 128.167 3.417 . . . . 0.0 112.958 -167.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -58.63 -16.9 18.12 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 127.271 2.857 . . . . 0.0 114.626 -163.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.54 -41.11 4.31 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.089 1.768 . . . . 0.0 110.787 163.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -84.58 -7.95 59.07 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 125.97 2.795 . . . . 0.0 108.61 -164.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -77.98 123.39 26.75 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 117.107 -3.496 . . . . 0.0 107.401 164.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 m 78.97 11.63 1.46 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.864 1.665 . . . . 0.0 114.862 168.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -83.79 -3.61 57.98 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.07 -1.644 . . . . 0.0 112.239 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 77.38 10.33 86.31 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-O 117.762 -1.577 . . . . 0.0 114.35 -175.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -103.86 125.69 50.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 124.188 1.947 . . . . 0.0 112.347 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.563 ' ND2' HD21 ' A' ' 34' ' ' ASN . 0.0 OUTLIER -67.77 56.93 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 118.828 -2.42 . . . . 0.0 110.801 163.661 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -31.75 65.53 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.972 2.509 . . . . 0.0 109.459 175.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.402 ' C ' ' H ' ' A' ' 33' ' ' ASP . 45.0 t -75.7 -14.49 60.34 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.734 2.414 . . . . 0.0 115.619 174.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.16 -35.75 0.17 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.325 2.25 . . . . 0.0 114.485 -172.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -71.95 -21.66 61.57 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 128.206 2.602 . . . . 0.0 110.774 171.445 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.563 HD21 ' ND2' ' A' ' 29' ' ' ASN . 22.2 t-20 54.58 80.75 0.12 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.824 2.05 . . . . 0.0 110.413 -164.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 m -86.12 -76.45 0.34 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 115.335 -2.269 . . . . 0.0 105.334 170.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -22.49 -70.68 0.02 OUTLIER 'General case' 0 N--CA 1.441 -0.889 2 C-N-CA 134.074 4.95 . . . . 0.0 111.411 175.331 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -80.74 16.27 1.47 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 111.871 -2.422 . . . . 0.0 113.228 -167.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.416 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -120.52 140.5 30.48 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 116.257 -1.83 . . . . 0.0 108.148 164.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.67 19.99 0.26 Allowed 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.66 4.24 . . . . 0.0 114.224 -168.355 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.416 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -71.29 -20.47 62.2 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.015 0.526 . . . . 0.0 110.189 153.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tt -125.57 -77.09 0.58 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.417 1.487 . . . . 0.0 109.538 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 11.9 t -133.28 -61.52 0.82 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 75.3 t60 57.48 87.7 0.06 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.144 1.377 . . . . 0.0 114.199 -162.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 65.97 140.77 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.458 1.903 . . . . 0.0 115.001 170.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 17.5 p80 . . . . . 0 CA--C 1.542 0.663 0 C-N-CA 125.687 1.595 . . . . 0.0 112.122 -178.014 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.222 0 CA-C-O 119.626 -0.541 . . . . 0.0 114.118 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 t -139.58 92.69 10.12 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 125.473 1.509 . . . . 0.0 110.182 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -74.9 135.53 19.4 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.467 2.111 . . . . 0.0 111.0 -177.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.4 -44.49 2.29 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.394 2.062 . . . . 0.0 111.996 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 76.1 -47.98 0.57 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 127.034 2.133 . . . . 0.0 112.394 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -129.91 -55.65 1.13 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.908 1.683 . . . . 0.0 110.368 176.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -144.74 169.81 9.33 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 129.1 2.96 . . . . 0.0 106.463 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.86 70.0 4.45 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 122.355 2.037 . . . . 0.0 113.336 -174.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.16 40.36 0.03 OUTLIER Glycine 0 CA--C 1.533 1.185 0 C-N-CA 125.318 1.437 . . . . 0.0 115.282 178.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -125.58 -163.42 1.2 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 119.031 1.416 . . . . 0.0 113.145 -164.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -124.17 125.33 44.26 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 128.479 3.99 . . . . 0.0 117.803 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.15 111.35 22.87 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 117.288 -3.383 . . . . 0.0 113.615 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.6 t -82.07 125.03 30.36 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.121 1.769 . . . . 0.0 111.035 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.4 -10.9 3.58 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 174.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -66.22 -30.08 70.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 120.883 1.674 . . . . 0.0 111.635 164.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.8 m 128.11 51.79 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.343 1 C-N-CA 132.076 4.15 . . . . 0.0 110.803 168.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -128.13 134.41 49.11 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 123.839 1.781 . . . . 0.0 114.772 -166.488 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.272 0.5 OUTLIER -97.89 117.9 33.25 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 119.067 -2.271 . . . . 0.0 110.697 162.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.42 169.74 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-O 114.749 -2.548 . . . . 0.0 106.141 173.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -93.78 146.92 23.52 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 129.04 3.963 . . . . 0.0 112.964 -170.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.32 -16.13 31.9 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 126.926 2.641 . . . . 0.0 113.708 -166.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.3 ttt180 -46.16 -27.88 1.09 Allowed 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.143 -1.598 . . . . 0.0 113.026 162.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -97.47 -9.38 27.32 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 126.244 2.926 . . . . 0.0 110.117 -172.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -75.44 136.24 40.7 Favored 'General case' 0 C--N 1.353 0.735 1 O-C-N 115.92 -4.237 . . . . 0.0 107.916 166.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.1 m 63.75 13.58 7.55 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.74 -35.19 52.14 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.642 -173.644 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.42 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 106.53 -3.26 36.85 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 117.094 -1.948 . . . . 0.0 114.615 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -105.69 145.28 31.28 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 126.073 2.844 . . . . 0.0 112.487 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.64 60.85 0.35 Allowed 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.43 -2.044 . . . . 0.0 109.23 168.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -59.0 -25.68 63.86 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.352 1.861 . . . . 0.0 110.144 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.8 t -78.08 -16.7 57.79 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 129.107 2.963 . . . . 0.0 116.258 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.38 -33.9 0.15 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.796 2.038 . . . . 0.0 115.06 -172.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -20.38 60.43 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.01 2.124 . . . . 0.0 111.057 168.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 51.6 t30 59.23 83.41 0.13 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.837 2.455 . . . . 0.0 112.213 -168.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -103.93 -61.78 1.39 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -31.1 -67.99 0.09 Allowed 'General case' 0 C--O 1.242 0.702 0 CA-C-O 127.12 3.343 . . . . 0.0 110.529 163.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.42 ' CD ' ' H ' ' A' ' 27' ' ' GLY 0.326 3.7 mm-40 -92.02 25.84 2.69 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 119.245 -2.159 . . . . 0.0 112.122 -170.887 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.47 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -108.86 126.84 28.51 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 114.961 -2.447 . . . . 0.0 107.189 151.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.78 19.87 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 125.984 4.456 . . . . 0.0 114.801 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.47 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -71.75 -21.61 61.72 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.934 0.893 . . . . 0.0 110.457 154.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -114.95 -79.5 0.59 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.82 1.648 . . . . 0.0 108.362 173.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 3.7 t -137.28 -60.38 0.67 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 24.8 t-80 57.59 86.7 0.07 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.491 1.517 . . . . 0.0 113.149 -165.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 60.91 -177.96 0.11 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.13 1.372 . . . . 0.0 112.587 178.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 . . . . . 0 CA--C 1.543 0.686 0 O-C-N 120.234 -1.541 . . . . 0.0 109.932 174.488 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.022 0 CA-C-O 118.878 -0.957 . . . . 0.0 114.243 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 t 128.94 -60.82 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 131.198 3.799 . . . . 0.0 112.878 178.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -67.88 150.1 78.24 Favored 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 121.721 1.614 . . . . 0.0 113.903 -168.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -78.74 55.26 5.45 Favored 'Trans proline' 0 CA--C 1.539 0.745 1 C-N-CA 125.539 4.159 . . . . 0.0 112.666 -174.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -65.26 -9.16 21.64 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.012 1.725 . . . . 0.0 115.607 -172.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.22 -59.53 1.83 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.294 1.438 . . . . 0.0 109.696 176.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -145.99 167.99 12.82 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.955 2.502 . . . . 0.0 107.427 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 75.34 1.83 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.317 2.678 . . . . 0.0 112.797 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.16 46.73 0.06 OUTLIER Glycine 0 N--CA 1.469 0.885 0 C-N-CA 124.284 0.945 . . . . 0.0 114.064 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -133.75 -172.23 2.92 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.421 1.088 . . . . 0.0 111.861 -168.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -110.38 121.95 46.53 Favored 'General case' 0 CA--C 1.56 1.362 1 CA-C-O 128.882 4.182 . . . . 0.0 116.568 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.16 108.51 21.23 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 118.29 -2.756 . . . . 0.0 112.81 172.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 28.3 t -82.49 122.95 28.71 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 125.822 1.649 . . . . 0.0 111.226 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.49 -19.84 2.51 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -70.98 -22.65 62.16 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.006 1.275 . . . . 0.0 112.366 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.4 m 125.59 51.82 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 1 C-N-CA 131.87 4.068 . . . . 0.0 111.425 166.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -130.46 134.95 47.49 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 124.304 2.002 . . . . 0.0 116.291 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.24 121.36 39.04 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.032 -2.293 . . . . 0.0 110.445 160.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.82 169.2 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 115.064 -2.398 . . . . 0.0 105.836 169.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -95.88 151.03 19.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 127.954 3.284 . . . . 0.0 112.918 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -61.15 -15.8 37.57 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 126.662 2.476 . . . . 0.0 114.096 -166.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -45.65 -25.65 0.5 Allowed 'General case' 0 CA--C 1.55 0.978 0 O-C-N 119.991 -1.693 . . . . 0.0 113.366 160.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -101.67 -4.2 26.95 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 126.265 2.936 . . . . 0.0 110.873 -172.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -78.24 114.41 17.1 Favored 'General case' 0 C--N 1.354 0.78 1 O-C-N 116.082 -4.136 . . . . 0.0 109.028 170.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.25 8.8 p 41.02 55.76 3.09 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -167.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -82.53 -29.63 30.28 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.694 145.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.68 -11.62 42.19 Favored Glycine 0 CA--C 1.534 1.272 0 CA-C-O 117.422 -1.766 . . . . 0.0 115.444 -175.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -81.31 142.33 33.19 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 125.371 2.51 . . . . 0.0 111.535 172.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -45.55 -2.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 130.296 3.438 . . . . 0.0 118.653 -169.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -75.5 -21.42 58.03 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 120.189 -1.569 . . . . 0.0 109.891 -91.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.4 ' C ' ' H ' ' A' ' 33' ' ' ASP . 47.8 t -61.02 -13.67 18.09 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 130.726 3.61 . . . . 0.0 116.085 164.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.28 -34.1 0.27 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 128.666 2.786 . . . . 0.0 113.248 -174.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -68.61 -28.42 66.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.655 1.982 . . . . 0.0 110.125 164.716 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 65.4 81.59 0.2 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.326 2.65 . . . . 0.0 109.689 -169.148 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.4 m -98.27 -60.84 1.47 Allowed 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -28.57 -66.31 0.08 Allowed 'General case' 0 C--O 1.247 0.957 0 CA-C-O 127.551 3.548 . . . . 0.0 112.076 157.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 22.2 mm-40 -87.18 17.76 4.1 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.953 -171.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.448 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -109.25 135.34 20.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 CA-C-O 115.214 -2.327 . . . . 0.0 108.047 155.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -68.68 22.98 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.993 1 C-N-CA 125.757 4.305 . . . . 0.0 114.556 -173.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.448 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -73.96 -20.32 60.4 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.997 0.919 . . . . 0.0 110.165 153.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -120.46 -82.51 0.65 Allowed 'General case' 0 C--N 1.344 0.346 0 C-N-CA 125.664 1.585 . . . . 0.0 108.868 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 36.4 t -144.47 -47.91 0.26 Allowed 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 177.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 11.7 t-160 56.74 95.81 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -179.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -68.03 84.33 0.23 Allowed 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.841 0.829 . . . . 0.0 112.428 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.3 t-80 . . . . . 0 CA--C 1.54 0.56 0 C-N-CA 125.835 1.654 . . . . 0.0 109.553 -179.421 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.243 0 CA-C-O 119.603 -0.554 . . . . 0.0 114.164 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.5 p -145.58 158.61 49.93 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 125.656 1.582 . . . . 0.0 110.893 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.98 118.97 5.19 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 122.87 2.38 . . . . 0.0 110.744 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -72.36 -47.59 0.39 Allowed 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.904 2.403 . . . . 0.0 112.195 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 84.4 -30.51 0.07 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 129.022 2.929 . . . . 0.0 115.976 168.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t -149.89 -50.79 0.14 Allowed 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 120.393 1.452 . . . . 0.0 110.92 173.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -133.34 179.6 1.33 Allowed Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 130.128 3.371 . . . . 0.0 105.081 170.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -74.81 68.91 5.51 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.423 2.258 . . . . 0.0 113.208 -175.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.73 46.14 0.04 OUTLIER Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.636 1.112 . . . . 0.0 115.702 177.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -128.69 -162.34 1.18 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.119 1.46 . . . . 0.0 112.782 -164.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -121.54 125.98 48.09 Favored 'General case' 0 CA--C 1.563 1.444 1 CA-C-O 128.547 4.022 . . . . 0.0 118.669 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.08 107.35 18.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 117.801 -3.062 . . . . 0.0 113.074 170.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.7 t -74.25 122.87 23.52 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 168.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.48 -22.91 8.83 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 177.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -60.42 -25.83 66.24 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.755 1.622 . . . . 0.0 113.089 170.298 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.1 m 129.9 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 131.633 3.973 . . . . 0.0 112.317 161.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -125.91 128.58 47.79 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 -164.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.337 0.1 OUTLIER -98.31 116.6 30.88 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 120.237 -1.54 . . . . 0.0 111.951 167.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.25 165.32 31.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 115.249 -2.31 . . . . 0.0 105.768 171.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -88.82 146.56 24.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.922 3.888 . . . . 0.0 112.061 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.4 -21.29 62.05 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 126.805 2.566 . . . . 0.0 113.755 -165.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -40.99 -28.89 0.09 Allowed 'General case' 0 CA--C 1.547 0.849 0 O-C-N 120.394 -1.441 . . . . 0.0 113.359 161.548 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -102.77 -5.35 23.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 111.853 -3.927 . . . . 0.0 113.622 -171.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -72.43 143.2 48.59 Favored 'General case' 0 C--N 1.363 1.165 1 O-C-N 130.505 4.878 . . . . 0.0 109.168 166.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.7 p 31.57 56.89 0.3 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -89.26 -8.95 52.4 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.689 1.196 . . . . 0.0 111.84 157.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.97 10.48 75.29 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 117.099 -1.945 . . . . 0.0 112.975 -163.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.517 ' C ' ' H ' ' A' ' 30' ' ' ASP . 12.8 t0 -115.87 132.49 56.63 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 126.562 3.077 . . . . 0.0 114.591 -172.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.65 39.55 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 O-C-N 119.797 -1.815 . . . . 0.0 115.137 152.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.517 ' H ' ' C ' ' A' ' 28' ' ' ASP . 0.0 OUTLIER -42.28 -47.47 4.79 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.223 2.209 . . . . 0.0 108.602 146.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.7 t -81.7 113.03 19.41 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 154.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.41 -20.7 0.74 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.537 1.535 . . . . 0.0 114.615 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -102.29 -2.99 27.94 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.569 1.077 . . . . 0.0 113.297 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 51.51 68.55 0.78 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.395 1.878 . . . . 0.0 110.245 -166.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 m -77.65 -67.06 0.76 Allowed 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -60.1 -47.21 86.86 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-O 125.796 2.712 . . . . 0.0 113.232 -170.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -61.18 2.41 0.14 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 112.62 -2.082 . . . . 0.0 114.605 172.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.409 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -117.92 141.61 29.5 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 120.178 1.354 . . . . 0.0 109.541 165.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -72.17 21.83 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.823 1 C-N-CA 125.919 4.412 . . . . 0.0 114.192 -168.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -69.09 -21.07 64.09 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.814 -0.554 . . . . 0.0 110.089 151.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.0 tt -127.21 -77.19 0.57 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 126.257 1.823 . . . . 0.0 108.732 -178.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.2 t -138.13 -61.99 0.59 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.437 ' CG ' ' H ' ' A' ' 44' ' ' GLN . 83.6 t60 58.42 173.3 0.06 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.743 1.617 . . . . 0.0 114.474 -165.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.437 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 15.1 tt0 39.88 85.55 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 128.761 2.824 . . . . 0.0 116.087 171.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 61.3 t60 . . . . . 0 N--CA 1.469 0.496 0 C-N-CA 125.028 1.331 . . . . 0.0 112.02 173.82 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.242 0 N-CA-C 112.242 -0.343 . . . . 0.0 112.242 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.8 m 65.21 160.35 0.12 Allowed Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 127.477 2.311 . . . . 0.0 113.859 -174.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.1 111.0 3.07 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 123.035 2.49 . . . . 0.0 110.229 172.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -67.92 -54.82 0.3 Allowed 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.237 2.624 . . . . 0.0 112.788 -169.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 68.74 114.21 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 127.084 2.154 . . . . 0.0 111.323 173.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 67.36 -60.68 0.37 Allowed 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 126.696 1.998 . . . . 0.0 113.476 -176.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -142.2 -170.69 0.25 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.3 3.44 . . . . 0.0 106.396 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -78.35 70.8 7.06 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 CA-C-N 123.791 2.39 . . . . 0.0 111.464 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 134.73 53.36 0.07 OUTLIER Glycine 0 C--N 1.347 1.145 0 N-CA-C 118.203 2.041 . . . . 0.0 118.203 171.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -127.91 -159.0 0.91 Allowed 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.913 1.857 . . . . 0.0 111.626 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -111.85 124.25 51.96 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 127.911 3.719 . . . . 0.0 116.727 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.84 108.83 21.21 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 118.015 -2.928 . . . . 0.0 113.442 167.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.2 t -81.56 128.3 33.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.646 2.378 . . . . 0.0 111.515 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.93 -11.93 3.93 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 174.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -66.63 -25.83 66.78 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 120.884 1.674 . . . . 0.0 111.911 164.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m 126.77 44.05 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 1 C-N-CA 132.168 4.187 . . . . 0.0 111.281 165.876 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.4 mmm-85 -128.41 136.41 50.85 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.708 1.718 . . . . 0.0 114.967 -156.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.379 0.6 OUTLIER -104.04 114.51 28.81 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 119.133 -2.23 . . . . 0.0 112.538 170.418 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.55 167.34 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 114.074 -2.87 . . . . 0.0 106.46 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -87.38 145.57 26.25 Favored 'General case' 0 N--CA 1.449 -0.524 1 O-C-N 129.466 4.229 . . . . 0.0 113.235 -171.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.12 -17.18 16.56 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 126.988 2.68 . . . . 0.0 114.212 -167.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.54 -37.75 8.43 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.726 1.603 . . . . 0.0 110.217 165.068 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -83.4 -10.52 58.37 Favored 'General case' 0 CA--C 1.565 1.526 0 CA-C-O 125.849 2.738 . . . . 0.0 108.685 -165.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.2 mttt -76.34 126.91 31.85 Favored 'General case' 0 C--N 1.355 0.82 0 O-C-N 116.67 -3.768 . . . . 0.0 107.786 166.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.2 m 66.94 15.59 10.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -18.66 51.39 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 120.319 -1.488 . . . . 0.0 112.578 -175.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.436 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 93.63 -0.17 67.48 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 116.992 -2.004 . . . . 0.0 114.6 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -118.23 150.94 38.59 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 126.871 3.224 . . . . 0.0 113.901 170.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.95 53.48 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.741 2.417 . . . . 0.0 110.956 162.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.93 -28.97 59.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.754 1.622 . . . . 0.0 109.981 175.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.401 ' C ' ' H ' ' A' ' 33' ' ' ASP . 40.0 t -78.25 -14.03 59.61 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.91 2.884 . . . . 0.0 115.778 174.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.98 -32.68 0.13 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.115 2.166 . . . . 0.0 114.879 -172.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.401 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -76.4 -22.14 55.12 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.542 2.337 . . . . 0.0 110.964 169.238 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 57.31 85.72 0.08 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.085 2.154 . . . . 0.0 111.491 -166.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.9 m -101.83 -62.82 1.21 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -29.58 -68.95 0.07 Allowed 'General case' 0 C--O 1.242 0.692 0 C-N-CA 130.571 3.549 . . . . 0.0 111.004 166.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 11.8 mm-40 -86.31 19.19 2.83 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 119.384 -2.073 . . . . 0.0 112.679 -170.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.452 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -110.6 130.64 22.68 Favored Pre-proline 0 CA--C 1.543 0.71 0 CA-C-O 115.538 -2.172 . . . . 0.0 107.406 157.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -68.82 21.04 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.97 1 C-N-CA 125.845 4.363 . . . . 0.0 114.656 -170.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.452 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -72.94 -21.14 60.93 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.858 0.863 . . . . 0.0 110.395 154.187 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -118.36 -79.37 0.59 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.584 1.554 . . . . 0.0 108.595 175.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 14.8 t -134.79 -66.38 0.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.6 t60 54.92 91.57 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.577 1.551 . . . . 0.0 113.612 -163.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -74.13 -41.21 61.93 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.112 161.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 . . . . . 0 CA--C 1.535 0.385 0 C-N-CA 123.737 0.815 . . . . 0.0 110.601 175.775 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.248 0 N-CA-C 113.911 0.325 . . . . 0.0 113.911 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.1 m -167.75 160.9 9.98 Favored Pre-proline 0 N--CA 1.468 0.473 0 C-N-CA 126.439 1.896 . . . . 0.0 110.01 174.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -68.91 133.7 27.84 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 121.952 1.768 . . . . 0.0 110.119 173.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.76 -38.52 7.69 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.952 2.435 . . . . 0.0 112.035 177.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.407 HE21 ' HB2' ' A' ' 12' ' ' ALA . 55.4 mt-30 63.67 111.15 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.757 2.023 . . . . 0.0 110.892 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 60.9 -58.2 0.09 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 128.85 2.86 . . . . 0.0 116.192 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -135.69 -167.54 0.15 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.144 3.378 . . . . 0.0 106.023 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -77.09 81.13 2.69 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 CA-C-N 123.734 2.369 . . . . 0.0 110.183 170.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 115.83 56.74 0.34 Allowed Glycine 0 C--N 1.347 1.18 0 N-CA-C 117.923 1.929 . . . . 0.0 117.923 173.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -124.55 -154.49 0.62 Allowed 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.783 . . . . 0.0 111.204 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -117.31 125.3 50.84 Favored 'General case' 0 CA--C 1.56 1.337 0 CA-C-O 128.349 3.928 . . . . 0.0 116.95 177.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.407 ' HB2' HE21 ' A' ' 5' ' ' GLN . . . -99.86 110.77 23.12 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 117.95 -2.969 . . . . 0.0 113.269 171.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 20.4 t -80.94 124.18 28.92 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 127.552 2.341 . . . . 0.0 110.733 175.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.33 -16.93 3.94 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 174.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -68.47 -26.85 65.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.363 1.438 . . . . 0.0 111.922 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.4 m 126.23 53.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.315 1 C-N-CA 131.929 4.092 . . . . 0.0 110.907 168.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.91 135.04 48.51 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 123.622 1.677 . . . . 0.0 115.525 -170.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.368 0.5 OUTLIER -104.1 116.95 33.13 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 119.132 -2.23 . . . . 0.0 112.09 163.048 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -133.01 160.88 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 115.139 -2.362 . . . . 0.0 104.838 176.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.86 153.42 30.61 Favored 'General case' 0 N--CA 1.442 -0.853 0 O-C-N 128.847 3.842 . . . . 0.0 112.567 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -59.68 -17.49 34.65 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 127.785 3.178 . . . . 0.0 113.863 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.05 -20.67 1.02 Allowed 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.452 -2.03 . . . . 0.0 113.969 162.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -98.99 -4.3 32.9 Favored 'General case' 0 CA--C 1.564 1.491 0 CA-C-O 125.597 2.618 . . . . 0.0 112.403 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -78.33 121.61 24.69 Favored 'General case' 0 C--N 1.352 0.714 0 O-C-N 116.935 -3.603 . . . . 0.0 109.425 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.261 4.2 p 39.14 58.66 1.81 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -89.79 -16.79 29.45 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 159.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 107.69 -12.67 38.82 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-O 115.74 -2.7 . . . . 0.0 116.502 -170.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -119.27 146.98 44.79 Favored 'General case' 0 N--CA 1.477 0.917 1 CA-C-O 129.343 4.401 . . . . 0.0 117.601 -176.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.96 52.91 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 O-C-N 118.031 -2.918 . . . . 0.0 111.37 172.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.63 -31.97 27.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.572 1.949 . . . . 0.0 110.075 172.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.41 ' C ' ' H ' ' A' ' 33' ' ' ASP . 46.8 t -79.43 -13.36 59.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 127.66 2.384 . . . . 0.0 115.894 177.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.81 -34.27 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 127.391 2.276 . . . . 0.0 114.876 -171.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -73.39 -20.33 60.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 128.15 2.58 . . . . 0.0 110.765 171.379 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 51.63 81.15 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.552 1.941 . . . . 0.0 110.035 -162.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.5 m -85.62 -81.89 0.2 Allowed 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.814 -2.291 . . . . 0.0 104.814 168.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -16.12 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.062 2 C-N-CA 135.422 5.489 . . . . 0.0 112.129 175.891 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -74.84 1.68 12.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.759 -2.019 . . . . 0.0 114.451 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.481 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -105.51 131.64 21.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 115.527 -2.178 . . . . 0.0 107.668 169.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -69.76 19.79 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.937 1 C-N-CA 126.639 4.892 . . . . 0.0 114.481 -167.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.481 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -71.45 -23.51 61.85 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.105 0.962 . . . . 0.0 110.507 154.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -117.48 -81.48 0.62 Allowed 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.366 1.866 . . . . 0.0 107.93 170.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 t -142.33 -171.53 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.313 0.506 . . . . 0.0 110.494 170.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -168.28 122.14 0.9 Allowed 'General case' 0 N--CA 1.467 0.425 0 O-C-N 120.032 -1.668 . . . . 0.0 108.977 168.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.16 68.92 4.29 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 122.019 0.914 . . . . 0.0 111.876 -177.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 . . . . . 0 CA--C 1.539 0.541 0 C-N-CA 126.947 2.099 . . . . 0.0 112.441 -179.98 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.465 ' N ' HE21 ' A' ' 5' ' ' GLN . . . . . . . . 0 CA--C 1.534 1.233 0 N-CA-C 114.619 0.608 . . . . 0.0 114.619 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.8 m -168.37 -58.27 0.01 OUTLIER Pre-proline 0 N--CA 1.474 0.747 0 C-N-CA 126.385 1.874 . . . . 0.0 111.451 172.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -71.25 165.36 32.68 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.134 1.889 . . . . 0.0 111.7 171.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -72.67 69.4 3.58 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 125.029 3.819 . . . . 0.0 111.301 174.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.465 HE21 ' N ' ' A' ' 1' ' ' GLY . 20.9 mp0 -17.0 -53.36 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.594 1 C-N-CA 133.731 4.812 . . . . 0.0 117.497 -175.648 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.7 t -137.27 -45.43 0.56 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.627 2.371 . . . . 0.0 109.046 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -138.85 171.75 7.67 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 130.473 3.509 . . . . 0.0 105.164 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.33 79.96 2.02 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.431 2.088 . . . . 0.0 112.146 -177.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.78 50.76 0.1 OUTLIER Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.407 1.003 . . . . 0.0 114.317 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -134.41 -166.47 1.81 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.508 1.123 . . . . 0.0 111.337 -169.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -115.84 122.66 46.06 Favored 'General case' 0 CA--C 1.558 1.283 1 CA-C-O 128.66 4.076 . . . . 0.0 117.115 177.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.22 106.67 18.37 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 118.355 -2.716 . . . . 0.0 111.707 171.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 19.8 t -85.47 129.6 34.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 126.217 1.807 . . . . 0.0 112.082 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.87 -22.22 2.09 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 24.5 t-20 -65.48 -25.21 67.39 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 120.256 1.389 . . . . 0.0 112.288 169.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m 125.57 44.91 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.441 1 C-N-CA 132.145 4.178 . . . . 0.0 111.056 166.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 mmm-85 -127.63 134.4 49.66 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-O 123.628 1.68 . . . . 0.0 114.943 -157.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.312 0.5 OUTLIER -102.54 115.22 30.14 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 119.422 -2.049 . . . . 0.0 111.147 167.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -135.92 169.0 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 114.637 -2.602 . . . . 0.0 106.073 174.744 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -93.95 149.09 21.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 128.595 3.685 . . . . 0.0 113.105 -168.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -59.66 -17.29 32.71 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 126.882 2.614 . . . . 0.0 114.008 -167.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -46.09 -26.68 0.79 Allowed 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.172 -1.58 . . . . 0.0 113.247 162.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -99.91 -10.75 21.34 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-O 126.081 2.848 . . . . 0.0 110.19 -172.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.5 mtpt -72.03 139.75 48.69 Favored 'General case' 0 C--N 1.355 0.837 1 O-C-N 115.537 -4.477 . . . . 0.0 107.153 165.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 m 64.35 10.1 5.42 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -41.34 50.99 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.768 1.627 . . . . 0.0 110.622 -170.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.16 -1.39 14.59 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-O 116.553 -2.248 . . . . 0.0 115.444 -179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -118.23 151.32 37.87 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 127.398 3.475 . . . . 0.0 113.965 166.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -62.39 63.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 O-C-N 119.43 -2.044 . . . . 0.0 109.388 163.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -65.82 -24.57 66.93 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 120.631 -1.293 . . . . 0.0 109.47 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.7 t -67.33 -13.0 61.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.54 2.736 . . . . 0.0 115.705 166.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 65.06 -38.42 0.24 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.147 2.579 . . . . 0.0 114.56 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -86.65 -9.82 55.18 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.175 2.19 . . . . 0.0 111.028 174.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.0 t30 62.86 128.4 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 129.211 3.004 . . . . 0.0 112.546 -167.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.5 m -147.47 -52.15 0.2 Allowed 'General case' 0 C--O 1.212 -0.873 0 O-C-N 120.214 -1.554 . . . . 0.0 111.925 164.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -28.41 -69.46 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 CA-C-O 127.912 3.72 . . . . 0.0 111.84 157.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -92.99 23.17 4.4 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.434 -2.666 . . . . 0.0 112.244 -173.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.474 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -102.99 119.62 54.89 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-O 114.458 -2.687 . . . . 0.0 106.045 152.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.52 19.63 0.08 OUTLIER 'Trans proline' 0 CA--C 1.543 0.926 1 C-N-CA 126.488 4.792 . . . . 0.0 115.497 -168.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.474 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -76.38 -21.08 56.51 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.567 1.147 . . . . 0.0 110.319 156.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tt -108.11 -81.2 0.57 Allowed 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.179 1.392 . . . . 0.0 108.559 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 5.4 t -138.86 -59.03 0.61 Allowed 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 56.21 93.47 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.62 1.568 . . . . 0.0 114.395 -170.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 56.69 90.26 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.7 1.6 . . . . 0.0 114.547 171.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 . . . . . 0 N--CA 1.469 0.494 0 C-N-CA 125.896 1.679 . . . . 0.0 112.724 -171.414 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.101 0 CA-C-O 121.425 0.458 . . . . 0.0 112.269 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.4 m -163.77 156.84 15.84 Favored Pre-proline 0 N--CA 1.469 0.523 0 C-N-CA 125.133 1.373 . . . . 0.0 110.062 172.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.42 121.5 6.83 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 122.922 2.415 . . . . 0.0 111.049 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -71.73 -44.34 1.03 Allowed 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.868 2.379 . . . . 0.0 112.207 178.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 87.0 -25.1 0.1 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 129.972 3.309 . . . . 0.0 116.019 168.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.9 t -155.82 -50.53 0.08 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.585 1.554 . . . . 0.0 110.524 171.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -135.01 178.6 1.69 Allowed Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 131.085 3.754 . . . . 0.0 104.951 171.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.76 71.39 4.84 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 CA-C-N 123.331 2.225 . . . . 0.0 113.297 -173.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.81 50.4 0.06 OUTLIER Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.855 1.217 . . . . 0.0 114.871 177.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -129.37 -166.03 1.6 Allowed 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.885 1.342 . . . . 0.0 112.914 -165.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -117.09 123.54 47.04 Favored 'General case' 0 CA--C 1.561 1.367 1 CA-C-O 128.542 4.02 . . . . 0.0 117.166 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.57 108.17 20.71 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 117.871 -3.018 . . . . 0.0 112.374 168.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 13.5 t -79.78 126.39 30.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.31 1.844 . . . . 0.0 110.471 176.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -17.4 2.76 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 173.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.07 -24.33 64.15 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 120.459 1.481 . . . . 0.0 111.733 168.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.7 m 122.94 51.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 C-N-CA 131.897 4.079 . . . . 0.0 110.171 167.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -127.59 136.06 51.14 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 123.605 1.669 . . . . 0.0 115.445 -167.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.283 0.2 OUTLIER -99.17 115.87 30.06 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 119.455 -2.028 . . . . 0.0 111.068 165.004 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.67 163.31 37.8 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 115.096 -2.383 . . . . 0.0 105.81 173.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -85.48 142.06 29.48 Favored 'General case' 0 N--CA 1.442 -0.849 1 O-C-N 130.105 4.628 . . . . 0.0 111.799 -174.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -58.2 -16.86 15.25 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 127.295 2.872 . . . . 0.0 113.909 -169.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -52.87 -19.85 2.85 Favored 'General case' 0 CA--C 1.553 1.062 0 O-C-N 119.591 -1.943 . . . . 0.0 113.253 163.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -92.7 -10.29 37.69 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 126.077 2.846 . . . . 0.0 112.001 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -75.96 120.68 21.63 Favored 'General case' 0 C--N 1.353 0.731 1 O-C-N 116.009 -4.182 . . . . 0.0 108.343 171.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.257 1.6 p 42.83 57.76 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -164.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.83 -26.5 22.78 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.105 162.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.412 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 104.84 -3.17 41.62 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 116.966 -2.019 . . . . 0.0 114.712 -174.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -123.99 152.39 42.61 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 127.862 3.696 . . . . 0.0 114.471 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -64.09 55.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 127.877 2.471 . . . . 0.0 110.472 168.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.49 -27.7 62.77 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.704 1.601 . . . . 0.0 110.139 176.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.5 t -80.52 -13.69 58.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 128.263 2.625 . . . . 0.0 115.897 173.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.0 -32.62 0.11 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.479 2.312 . . . . 0.0 115.06 -172.093 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -22.39 59.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 127.69 2.396 . . . . 0.0 110.903 169.106 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 58.6 87.06 0.08 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.352 2.261 . . . . 0.0 111.044 -168.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -106.44 -62.89 1.33 Allowed 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.162 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -28.86 -67.9 0.07 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-O 127.369 3.462 . . . . 0.0 111.569 164.104 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 26.9 mm-40 -82.37 11.82 5.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 112.676 -2.056 . . . . 0.0 113.752 -170.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -107.46 131.67 21.54 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-O 115.183 -2.341 . . . . 0.0 107.074 163.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -68.51 22.1 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 126.073 4.516 . . . . 0.0 114.498 -171.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.464 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -74.83 -20.6 59.69 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.141 0.976 . . . . 0.0 110.227 154.389 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -119.83 -82.05 0.64 Allowed 'General case' 0 C--N 1.344 0.333 0 C-N-CA 125.614 1.566 . . . . 0.0 108.977 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 15.1 t -140.02 -50.61 0.48 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 37.1 t-80 57.31 98.98 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -173.116 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -69.17 103.03 1.81 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.419 -0.8 . . . . 0.0 111.078 170.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 . . . . . 0 CA--C 1.538 0.507 0 C-N-CA 126.211 1.804 . . . . 0.0 113.126 -179.993 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.204 0 CA-C-O 119.201 -0.777 . . . . 0.0 114.083 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.6 m 32.78 66.43 1.12 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 128.427 2.691 . . . . 0.0 114.8 -178.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -59.63 163.58 12.92 Favored 'Trans proline' 0 CA--C 1.549 1.239 0 C-N-CA 122.958 2.438 . . . . 0.0 113.642 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -73.07 -23.49 18.23 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.79 2.993 . . . . 0.0 114.84 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 49.1 mm-40 79.34 -105.54 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.323 2.249 . . . . 0.0 112.323 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.31 -45.2 23.3 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.773 1.17 . . . . 0.0 112.63 -174.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -152.1 174.29 3.76 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 130.989 3.716 . . . . 0.0 105.605 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.08 84.41 0.44 Allowed 'Trans proline' 0 CA--C 1.545 1.069 0 CA-C-N 123.275 2.205 . . . . 0.0 113.981 -174.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.16 2.08 1.41 Allowed Glycine 0 CA--C 1.534 1.265 0 N-CA-C 117.168 1.627 . . . . 0.0 117.168 171.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.2 -162.12 0.76 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.597 1.199 . . . . 0.0 113.764 -153.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -113.71 124.11 51.5 Favored 'General case' 0 CA--C 1.559 1.299 1 CA-C-O 128.671 4.081 . . . . 0.0 117.157 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.77 110.85 23.39 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 117.958 -2.964 . . . . 0.0 113.071 166.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.6 t -79.14 122.8 26.7 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 125.515 1.526 . . . . 0.0 110.682 171.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.2 -13.57 5.28 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 173.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.99 -27.23 67.27 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.523 1.51 . . . . 0.0 111.996 166.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.7 m 128.31 52.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.389 1 C-N-CA 132.01 4.124 . . . . 0.0 111.319 166.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -130.27 132.18 45.8 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 123.615 1.674 . . . . 0.0 115.497 -168.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.314 0.5 OUTLIER -100.42 117.67 35.07 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 118.911 -2.368 . . . . 0.0 111.015 165.428 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.83 165.48 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 115.146 -2.359 . . . . 0.0 106.059 174.738 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -91.23 152.1 20.66 Favored 'General case' 0 N--CA 1.446 -0.633 1 O-C-N 129.16 4.037 . . . . 0.0 112.909 -170.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -60.63 -16.83 42.65 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 126.831 2.582 . . . . 0.0 114.123 -167.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -44.09 -27.06 0.35 Allowed 'General case' 0 CA--C 1.552 1.022 0 O-C-N 119.655 -1.903 . . . . 0.0 113.562 160.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 2.6 m0 -101.47 -6.67 23.66 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 126.354 2.978 . . . . 0.0 110.693 -172.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -76.4 118.33 18.97 Favored 'General case' 0 C--N 1.356 0.855 1 O-C-N 116.189 -4.07 . . . . 0.0 108.045 172.12 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.251 2.0 p 46.98 46.42 15.8 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -174.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -75.76 -23.58 55.98 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.145 -0.972 . . . . 0.0 111.693 151.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.56 5.0 65.36 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 117.262 -1.854 . . . . 0.0 114.101 -165.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -90.65 128.28 36.57 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 124.383 2.039 . . . . 0.0 110.094 175.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -44.26 -36.85 2.92 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-O 116.549 -1.691 . . . . 0.0 113.561 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 34.74 -50.1 0.0 OUTLIER 'General case' 0 C--N 1.35 0.624 1 C-N-CA 138.681 6.792 . . . . 0.0 114.72 173.479 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.415 ' C ' ' H ' ' A' ' 33' ' ' ASP . 39.5 t -69.92 -20.6 63.35 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.513 2.725 . . . . 0.0 115.601 166.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.63 -39.0 0.42 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.927 2.091 . . . . 0.0 112.419 -173.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.415 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -73.45 -14.38 61.24 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.946 2.098 . . . . 0.0 110.311 170.422 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 52.41 65.44 1.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.296 2.239 . . . . 0.0 110.086 -174.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 m -78.93 -60.7 2.27 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 -176.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.5 p-10 -57.82 -49.93 74.98 Favored 'General case' 0 C--O 1.246 0.869 0 CA-C-O 126.577 3.084 . . . . 0.0 111.478 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -71.01 9.75 0.66 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 112.631 -2.077 . . . . 0.0 114.144 176.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.458 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -113.58 137.69 22.28 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-O 116.411 -1.757 . . . . 0.0 108.659 157.286 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -69.76 21.04 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 126.145 4.563 . . . . 0.0 114.308 -171.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.458 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -68.36 -22.14 64.68 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.097 0.559 . . . . 0.0 110.276 151.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.7 tt -121.28 -76.56 0.58 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.015 1.726 . . . . 0.0 108.977 176.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 34.1 t -139.71 -68.5 0.42 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.2 t60 60.53 136.52 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 127.383 2.273 . . . . 0.0 114.768 -164.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -146.93 -63.33 0.29 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.693 0.797 . . . . 0.0 111.744 172.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 13.6 t60 . . . . . 0 N--CA 1.471 0.609 0 C-N-CA 125.754 1.622 . . . . 0.0 113.058 -176.952 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.253 0 CA-C-O 119.663 -0.52 . . . . 0.0 114.023 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.7 p -64.4 113.65 11.31 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 125.873 1.669 . . . . 0.0 111.146 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.48 114.35 3.24 Favored 'Trans proline' 0 CA--C 1.547 1.125 0 C-N-CA 123.118 2.545 . . . . 0.0 111.239 -177.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -70.53 -41.55 3.22 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.789 2.993 . . . . 0.0 113.188 -171.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 67.17 117.17 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 127.61 2.364 . . . . 0.0 111.819 173.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER 64.56 -58.94 0.23 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 127.739 2.416 . . . . 0.0 114.609 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -139.14 -172.83 0.33 Allowed Pre-proline 0 CA--C 1.555 1.16 0 C-N-CA 130.862 3.665 . . . . 0.0 106.187 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.62 79.62 2.76 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 CA-C-N 123.388 2.246 . . . . 0.0 110.761 171.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 119.47 57.16 0.25 Allowed Glycine 0 C--N 1.346 1.12 0 N-CA-C 117.285 1.674 . . . . 0.0 117.285 173.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -127.39 -160.62 1.02 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 119.737 1.768 . . . . 0.0 111.504 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -108.89 122.95 48.28 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 127.915 3.721 . . . . 0.0 115.962 176.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.05 110.48 23.05 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 118.239 -2.788 . . . . 0.0 113.314 166.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.3 t -77.74 124.1 27.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.121 1.768 . . . . 0.0 110.68 171.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.04 -19.72 2.03 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 172.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -70.4 -24.25 62.9 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 120.279 1.399 . . . . 0.0 112.297 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m 125.59 52.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 131.666 3.987 . . . . 0.0 110.822 166.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.48 132.97 48.37 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 123.472 1.606 . . . . 0.0 115.141 -169.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.375 0.5 OUTLIER -105.09 117.05 33.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.022 -2.299 . . . . 0.0 112.45 167.206 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.68 166.14 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 114.203 -2.808 . . . . 0.0 106.318 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -88.81 144.41 26.24 Favored 'General case' 0 N--CA 1.449 -0.476 1 O-C-N 129.311 4.132 . . . . 0.0 113.103 -170.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -58.3 -15.22 9.45 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 127.12 2.763 . . . . 0.0 114.318 -167.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.7 ttp85 -50.64 -28.12 8.23 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.218 -1.551 . . . . 0.0 112.449 164.436 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -91.99 -4.3 54.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 126.146 2.879 . . . . 0.0 110.132 -172.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.8 mttt -78.82 105.91 10.46 Favored 'General case' 0 C--N 1.351 0.672 0 O-C-N 116.425 -3.922 . . . . 0.0 108.265 170.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 12.8 p 48.08 57.16 6.38 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -168.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -81.06 -37.78 28.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.231 145.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.14 -19.96 8.12 Favored Glycine 0 CA--C 1.537 1.457 0 CA-C-O 117.09 -1.95 . . . . 0.0 116.036 -173.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -78.95 139.82 38.16 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 125.941 2.782 . . . . 0.0 111.864 173.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -54.79 8.45 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 118.536 -2.603 . . . . 0.0 117.572 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -55.18 -24.18 25.58 Favored 'General case' 0 C--N 1.325 -0.487 1 C-N-CA 133.002 4.521 . . . . 0.0 112.728 -120.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.411 ' C ' ' H ' ' A' ' 33' ' ' ASP . 53.2 t -61.63 -20.68 63.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 130.192 3.397 . . . . 0.0 117.894 166.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 66.45 -32.28 0.17 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 128.106 2.563 . . . . 0.0 113.777 -171.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.411 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -71.98 -15.98 62.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.395 1.878 . . . . 0.0 110.649 160.553 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.83 63.49 2.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.285 1.834 . . . . 0.0 110.336 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -79.33 -59.02 2.93 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -38.93 -66.0 0.32 Allowed 'General case' 0 C--O 1.249 1.039 1 CA-C-O 128.55 4.024 . . . . 0.0 110.974 177.216 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -82.08 19.66 1.12 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 110.473 -3.058 . . . . 0.0 112.909 -175.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -116.2 136.64 23.06 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 115.449 -2.215 . . . . 0.0 108.076 153.467 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -67.61 19.69 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.987 1 C-N-CA 125.911 4.407 . . . . 0.0 114.688 -173.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.464 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -70.62 -21.86 62.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.863 0.865 . . . . 0.0 110.64 154.097 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.1 tt -119.19 -75.98 0.58 Allowed 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 126.02 1.728 . . . . 0.0 108.23 177.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 50.9 t -145.92 -59.83 0.32 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 t60 49.06 -64.22 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 -160.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -91.9 93.19 8.69 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 120.88 -1.137 . . . . 0.0 110.617 -174.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.8 t60 . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.191 1.396 . . . . 0.0 112.503 -175.021 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.225 0 CA-C-O 119.664 -0.52 . . . . 0.0 114.184 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.7 m -60.59 128.81 88.9 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.858 1.263 . . . . 0.0 111.415 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -71.0 121.47 7.89 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 122.931 2.42 . . . . 0.0 112.318 -172.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -77.9 48.33 2.61 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 125.119 3.879 . . . . 0.0 112.519 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -63.93 141.86 58.62 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.973 1.709 . . . . 0.0 110.959 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 61.62 -71.36 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.841 1.656 . . . . 0.0 110.789 -155.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -150.35 167.03 13.81 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.787 2.035 . . . . 0.0 108.808 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.14 78.19 0.81 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.154 2.569 . . . . 0.0 112.194 173.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.72 38.96 0.11 Allowed Glycine 0 N--CA 1.47 0.91 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -132.26 -170.46 2.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.657 1.183 . . . . 0.0 111.537 -171.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -111.93 121.64 45.57 Favored 'General case' 0 CA--C 1.56 1.359 1 CA-C-O 128.844 4.164 . . . . 0.0 116.675 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.23 107.48 19.96 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 118.216 -2.802 . . . . 0.0 112.824 170.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.6 t -83.55 123.56 29.88 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.752 1.621 . . . . 0.0 111.334 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.36 -12.76 4.1 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -66.74 -29.6 69.62 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 120.858 1.663 . . . . 0.0 111.775 165.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m 127.95 55.92 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 1 C-N-CA 132.052 4.141 . . . . 0.0 110.732 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -132.51 132.46 42.67 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 124.19 1.948 . . . . 0.0 115.344 -168.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.255 0.3 OUTLIER -98.66 119.38 37.3 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 118.863 -2.398 . . . . 0.0 110.493 161.701 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.24 168.47 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 115.028 -2.415 . . . . 0.0 105.993 171.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -93.84 150.81 20.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 128.366 3.541 . . . . 0.0 112.979 -169.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.2 -16.1 30.19 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 126.756 2.535 . . . . 0.0 114.305 -166.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -45.92 -26.82 0.76 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.117 -1.614 . . . . 0.0 113.297 161.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.8 m0 -99.03 -5.44 30.37 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-O 126.844 3.211 . . . . 0.0 110.377 -172.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -76.99 109.94 11.21 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 115.683 -4.385 . . . . 0.0 109.255 171.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 p 42.47 53.88 4.53 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 115.983 1.845 . . . . 0.0 115.983 -169.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -68.05 -25.87 65.57 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.251 140.462 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.37 14.38 51.05 Favored Glycine 0 CA--C 1.53 0.976 0 CA-C-O 117.179 -1.901 . . . . 0.0 113.313 -167.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -110.35 139.32 45.66 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-O 126.555 3.074 . . . . 0.0 113.68 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -40.59 -40.3 1.23 Allowed 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.706 2.402 . . . . 0.0 114.363 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 30.42 -47.52 0.0 OUTLIER 'General case' 0 C--N 1.348 0.504 1 C-N-CA 139.146 6.978 . . . . 0.0 114.857 178.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.405 ' C ' ' H ' ' A' ' 33' ' ' ASP . 44.0 t -73.88 -24.81 59.78 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.982 3.313 . . . . 0.0 116.29 169.122 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.0 -27.52 0.16 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 126.994 2.118 . . . . 0.0 113.941 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.1 OUTLIER -78.2 -13.96 59.64 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.87 2.068 . . . . 0.0 110.788 158.763 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 49.82 58.12 5.79 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.376 2.27 . . . . 0.0 110.793 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -69.78 -58.61 3.69 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -36.66 -65.11 0.3 Allowed 'General case' 0 C--O 1.248 0.987 1 C-N-CA 131.798 4.039 . . . . 0.0 110.669 173.069 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.27 16.58 1.96 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 111.035 -2.802 . . . . 0.0 113.513 -173.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.464 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -113.68 136.53 22.02 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-O 115.689 -2.1 . . . . 0.0 108.174 155.69 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -68.89 20.9 0.15 Allowed 'Trans proline' 0 CA--C 1.543 0.959 1 C-N-CA 125.768 4.312 . . . . 0.0 114.552 -173.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.464 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -70.34 -21.35 62.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.629 0.772 . . . . 0.0 110.403 152.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -120.42 -76.86 0.58 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 125.78 1.632 . . . . 0.0 108.828 176.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.2 t -142.38 -61.5 0.44 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.8 t60 60.95 120.52 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.726 2.01 . . . . 0.0 115.565 -166.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -129.87 166.14 20.59 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.336 0.654 . . . . 0.0 110.879 157.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 6.3 p-80 . . . . . 0 CA--C 1.533 0.315 0 C-N-CA 125.013 1.325 . . . . 0.0 110.888 -179.648 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.252 0 CA-C-O 119.098 -0.834 . . . . 0.0 114.156 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.5 m 34.73 59.18 2.31 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 128.173 2.589 . . . . 0.0 114.676 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.84 124.08 10.32 Favored 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.924 2.416 . . . . 0.0 112.481 -170.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -77.27 47.02 2.13 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 125.049 3.833 . . . . 0.0 112.758 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -63.98 146.54 53.91 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.801 1.64 . . . . 0.0 110.778 172.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 61.68 -72.54 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.668 1.587 . . . . 0.0 110.85 -157.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -150.48 166.11 15.88 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 126.986 2.114 . . . . 0.0 108.78 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.22 78.95 1.13 Allowed 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.05 2.5 . . . . 0.0 112.547 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.26 37.55 0.09 OUTLIER Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.685 1.136 . . . . 0.0 115.209 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -131.03 -170.14 2.3 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.0 1.32 . . . . 0.0 111.598 -168.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -113.75 122.41 47.0 Favored 'General case' 0 CA--C 1.56 1.33 1 CA-C-O 128.987 4.232 . . . . 0.0 116.546 -178.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.88 109.6 22.28 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 118.233 -2.792 . . . . 0.0 112.394 170.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 36.5 t -83.48 124.24 30.52 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.352 1.861 . . . . 0.0 111.307 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.53 -12.91 4.5 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 174.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.5 -29.34 69.42 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.871 1.669 . . . . 0.0 111.84 165.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 m 128.02 52.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.354 1 C-N-CA 132.186 4.194 . . . . 0.0 110.901 169.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -130.08 134.83 47.63 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 124.419 2.057 . . . . 0.0 115.66 -167.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 121.39 39.58 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 118.77 -2.456 . . . . 0.0 110.428 162.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.22 164.15 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 114.765 -2.541 . . . . 0.0 105.964 169.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -88.84 151.21 22.5 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.541 3.65 . . . . 0.0 112.721 -172.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -61.21 -16.0 40.4 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 126.39 2.306 . . . . 0.0 114.697 -166.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.39 -38.14 2.62 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.692 1.587 . . . . 0.0 110.792 161.723 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -88.87 -5.5 57.98 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 124.788 2.232 . . . . 0.0 108.982 -164.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.3 mttt -77.97 134.91 37.76 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 117.983 -2.948 . . . . 0.0 109.443 165.624 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.8 m 60.33 15.29 5.29 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -175.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -11.15 58.65 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.263 1.825 . . . . 0.0 112.104 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.41 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 72.96 -3.51 28.24 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-O 116.997 -2.001 . . . . 0.0 114.481 -179.51 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -91.16 133.97 34.93 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 126.479 3.037 . . . . 0.0 111.18 165.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -35.3 -44.92 0.29 Allowed 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 128.368 2.667 . . . . 0.0 112.872 169.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 35.64 -49.87 0.0 OUTLIER 'General case' 0 C--N 1.349 0.546 1 C-N-CA 138.746 6.818 . . . . 0.0 114.288 175.498 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.437 ' C ' ' H ' ' A' ' 33' ' ' ASP . 25.5 t -65.09 -23.87 67.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.469 3.108 . . . . 0.0 115.518 163.292 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.62 -25.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.997 2.119 . . . . 0.0 113.881 -178.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.437 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -83.7 -11.89 56.59 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.223 2.209 . . . . 0.0 110.762 163.175 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.0 m120 51.1 64.06 1.99 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 127.191 2.196 . . . . 0.0 109.891 -174.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 m -77.13 -60.86 2.19 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 -176.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.4 p-10 -57.03 -52.0 67.0 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 126.111 2.863 . . . . 0.0 111.234 -175.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.41 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 12.1 mm-40 -75.09 15.58 0.4 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 113.091 -1.868 . . . . 0.0 113.31 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.432 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -118.09 143.44 32.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-O 117.06 -1.448 . . . . 0.0 109.634 155.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -71.05 21.66 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.847 1 C-N-CA 125.823 4.349 . . . . 0.0 114.25 -171.379 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -68.65 -21.42 64.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 110.235 151.699 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -128.72 -75.97 0.56 Allowed 'General case' 0 C--N 1.343 0.295 0 C-N-CA 125.743 1.617 . . . . 0.0 108.792 179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 35.5 t -132.41 -76.42 0.5 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.6 t60 58.32 -48.73 0.05 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.118 2.167 . . . . 0.0 115.0 -160.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -146.69 159.43 43.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.459 1.503 . . . . 0.0 111.094 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 . . . . . 0 CA--C 1.539 0.524 0 C-N-CA 123.78 0.832 . . . . 0.0 110.322 179.502 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.132 0 CA-C-O 119.767 -0.463 . . . . 0.0 114.039 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.3 m -71.93 145.48 89.16 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 117.969 0.885 . . . . 0.0 111.253 172.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -70.54 148.75 60.7 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 122.434 2.089 . . . . 0.0 112.839 -178.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.79 77.75 3.3 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 124.294 3.329 . . . . 0.0 110.561 174.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.5 mt-30 -69.02 63.01 0.12 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.626 1.97 . . . . 0.0 114.275 -174.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 121.84 -52.81 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.197 1 C-N-CA 134.884 5.274 . . . . 0.0 108.232 -177.493 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -143.43 168.02 14.06 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.694 2.398 . . . . 0.0 107.276 175.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -72.91 72.14 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.99 2.46 . . . . 0.0 112.187 178.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.53 41.7 0.04 OUTLIER Glycine 0 CA--C 1.531 1.035 0 C-N-CA 124.8 1.19 . . . . 0.0 114.652 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -136.2 -172.1 3.05 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.158 1.383 . . . . 0.0 111.578 -168.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -127.13 141.95 51.63 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 111.819 -3.943 . . . . 0.0 112.715 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.8 140.36 52.46 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 128.301 3.501 . . . . 0.0 114.861 166.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 27.6 t -86.16 126.9 34.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.266 3.426 . . . . 0.0 110.674 -175.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.91 -15.69 5.36 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 173.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -67.88 -26.22 65.9 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 120.392 1.451 . . . . 0.0 112.069 167.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m 127.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.475 1 C-N-CA 131.938 4.095 . . . . 0.0 111.317 164.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -132.38 133.21 43.67 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -166.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 p -99.37 123.74 43.9 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 117.623 -3.173 . . . . 0.0 111.043 169.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.66 169.37 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-O 115.286 -2.292 . . . . 0.0 111.183 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.518 ' H ' ' NE2' ' A' ' 20' ' ' GLN . 1.8 pm0 -88.23 147.39 24.86 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.195 2.809 . . . . 0.0 114.279 -173.147 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -53.25 -18.33 2.31 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 129.045 2.938 . . . . 0.0 115.224 -169.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.75 -33.8 3.25 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 121.215 1.825 . . . . 0.0 110.963 163.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -85.87 -8.56 57.98 Favored 'General case' 0 CA--C 1.558 1.26 0 CA-C-O 124.761 2.219 . . . . 0.0 109.825 -167.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -76.23 108.02 8.88 Favored 'General case' 0 C--N 1.351 0.67 0 O-C-N 117.543 -3.223 . . . . 0.0 110.525 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.0 p 41.19 58.78 2.5 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -169.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -80.17 -27.0 39.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.891 143.322 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.6 4.37 67.9 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.103 -1.387 . . . . 0.0 113.555 -165.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.11 123.52 27.43 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 124.017 1.865 . . . . 0.0 108.139 168.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -52.71 -24.66 9.09 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 118.894 -2.379 . . . . 0.0 114.154 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 28.54 -48.41 0.0 OUTLIER 'General case' 0 C--N 1.347 0.467 1 C-N-CA 139.61 7.164 . . . . 0.0 114.65 175.149 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.426 ' C ' ' H ' ' A' ' 33' ' ' ASP . 52.5 t -70.47 -20.92 62.84 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 127.444 2.297 . . . . 0.0 115.915 168.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 70.36 -30.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.939 2.096 . . . . 0.0 113.236 -176.365 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -79.27 -13.83 59.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 128.083 2.553 . . . . 0.0 111.415 170.69 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.9 m120 48.62 88.83 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.702 2.001 . . . . 0.0 110.814 -159.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.6 m -98.34 -68.24 0.81 Allowed 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -26.65 -66.6 0.06 Allowed 'General case' 0 C--O 1.248 1.009 0 CA-C-O 127.734 3.635 . . . . 0.0 111.952 153.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.404 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 17.3 mm-40 -91.46 25.81 2.49 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.634 -172.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.446 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -112.93 139.94 23.51 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 115.268 -2.301 . . . . 0.0 108.799 148.309 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.75 21.76 0.14 Allowed 'Trans proline' 0 CA--C 1.545 1.026 1 C-N-CA 125.789 4.326 . . . . 0.0 114.356 -175.173 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.446 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -73.32 -20.59 60.76 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.107 0.963 . . . . 0.0 110.27 154.14 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 tt -121.58 -81.11 0.63 Allowed 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.268 1.427 . . . . 0.0 108.782 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.2 t -146.37 -43.0 0.2 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 4.2 t-80 54.67 89.69 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 121.167 1.803 . . . . 0.0 114.626 177.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -63.71 -44.94 92.13 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 3.5 t60 . . . . . 0 N--CA 1.468 0.44 0 C-N-CA 125.858 1.663 . . . . 0.0 112.672 176.885 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.264 0 CA-C-O 119.863 -0.409 . . . . 0.0 114.073 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.0 p -62.27 121.45 66.56 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.148 1.379 . . . . 0.0 110.861 174.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -63.71 115.95 3.37 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 122.952 2.435 . . . . 0.0 110.419 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -68.85 -54.23 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.056 2.504 . . . . 0.0 112.432 -168.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 61.84 -43.51 0.15 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.384 2.674 . . . . 0.0 115.497 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.1 -68.17 0.85 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.982 1.713 . . . . 0.0 108.151 160.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -145.25 162.01 39.23 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 126.73 2.012 . . . . 0.0 108.759 177.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.93 75.18 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.349 2.699 . . . . 0.0 112.25 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.6 21.64 0.03 OUTLIER Glycine 0 CA--C 1.531 1.087 0 C-N-CA 125.006 1.289 . . . . 0.0 115.632 -176.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.53 -171.45 2.38 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.658 1.229 . . . . 0.0 112.318 -165.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -106.6 122.34 46.14 Favored 'General case' 0 CA--C 1.557 1.223 1 CA-C-O 128.768 4.127 . . . . 0.0 116.109 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.15 106.18 18.34 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 118.385 -2.697 . . . . 0.0 112.891 170.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 t -82.59 124.71 30.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.716 1.606 . . . . 0.0 111.173 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.08 -14.75 1.7 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -35.81 81.88 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.186 1.357 . . . . 0.0 111.079 166.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.9 m 132.45 49.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.282 1 C-N-CA 132.284 4.233 . . . . 0.0 111.488 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -125.11 135.8 53.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 116.037 1.866 . . . . 0.0 116.037 -167.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.96 120.12 37.8 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.688 -1.883 . . . . 0.0 110.944 163.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.09 171.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 114.532 -2.651 . . . . 0.0 106.37 171.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -94.7 147.04 23.72 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 128.502 3.626 . . . . 0.0 113.287 -168.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -59.38 -15.92 19.65 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 126.759 2.537 . . . . 0.0 114.333 -168.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -48.57 -25.89 1.95 Allowed 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.336 -1.477 . . . . 0.0 112.84 163.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -98.97 -2.84 36.42 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-O 126.227 2.917 . . . . 0.0 109.876 -171.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -79.38 121.92 25.75 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 116.209 -4.057 . . . . 0.0 109.45 168.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.271 1.9 p 45.07 51.56 8.84 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -172.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.8 -16.16 28.82 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 164.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.405 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 107.54 -11.54 39.14 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-O 115.721 -2.71 . . . . 0.0 116.484 -172.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -117.35 145.12 44.26 Favored 'General case' 0 N--CA 1.477 0.911 1 CA-C-O 129.27 4.367 . . . . 0.0 117.342 -178.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.407 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.78 55.59 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 O-C-N 118.044 -2.91 . . . . 0.0 111.145 170.104 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -31.48 62.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.532 1.933 . . . . 0.0 109.857 173.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.406 ' C ' ' H ' ' A' ' 33' ' ' ASP . 42.5 t -76.12 -15.05 60.16 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 127.928 2.491 . . . . 0.0 115.662 174.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.2 -39.2 0.14 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.653 2.381 . . . . 0.0 113.732 -167.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.406 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -70.67 -16.64 62.82 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.26 2.224 . . . . 0.0 111.256 175.77 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 49.7 78.76 0.09 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.359 2.264 . . . . 0.0 110.297 -166.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.6 m -84.75 -76.49 0.31 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 115.386 -2.245 . . . . 0.0 105.421 167.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -22.55 -71.02 0.02 OUTLIER 'General case' 0 C--O 1.247 0.956 2 C-N-CA 134.936 5.294 . . . . 0.0 112.698 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.405 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 41.4 mm-40 -73.44 7.01 2.55 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 110.761 -2.927 . . . . 0.0 114.248 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.419 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -119.68 143.18 34.34 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 116.483 -1.722 . . . . 0.0 108.419 167.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.73 20.72 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.907 1 C-N-CA 125.904 4.403 . . . . 0.0 114.149 -170.767 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.419 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -70.25 -21.14 63.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.104 0.562 . . . . 0.0 110.132 152.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tt -126.64 -77.79 0.58 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 125.61 1.564 . . . . 0.0 109.414 176.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 49.0 t -136.25 -62.94 0.65 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 57.86 -55.83 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 126.621 1.968 . . . . 0.0 115.584 -166.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 58.15 -23.79 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 129.935 3.294 . . . . 0.0 116.543 -175.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 24.6 t60 . . . . . 0 CA--C 1.532 0.282 0 C-N-CA 127.109 2.164 . . . . 0.0 112.939 175.686 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.077 0 N-CA-C 112.214 -0.354 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.0 t -150.32 143.13 16.22 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.16 1.384 . . . . 0.0 109.484 177.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.17 115.21 4.18 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.122 2.548 . . . . 0.0 110.763 177.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.83 -49.6 0.71 Allowed 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.807 2.338 . . . . 0.0 112.207 -176.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.43 ' NE2' ' H ' ' A' ' 12' ' ' ALA . 61.4 mt-30 63.93 110.89 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.042 2.137 . . . . 0.0 112.255 177.545 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 66.94 -59.49 0.38 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 128.134 2.574 . . . . 0.0 113.831 -176.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -141.74 -166.2 0.12 Allowed Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.07 3.348 . . . . 0.0 105.889 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.94 79.99 3.09 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 CA-C-N 123.99 2.461 . . . . 0.0 110.404 170.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 126.64 45.95 0.22 Allowed Glycine 0 C--N 1.348 1.206 0 N-CA-C 119.224 2.45 . . . . 0.0 119.224 169.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -125.83 -156.96 0.76 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.194 1.997 . . . . 0.0 111.228 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -114.93 126.84 55.25 Favored 'General case' 0 CA--C 1.558 1.288 1 CA-C-O 128.975 4.226 . . . . 0.0 116.785 174.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.43 ' H ' ' NE2' ' A' ' 5' ' ' GLN . . . -103.93 111.68 24.33 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 117.995 -2.941 . . . . 0.0 111.92 173.369 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.2 t -84.39 125.56 32.43 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 128.626 2.77 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.02 -13.47 2.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 174.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -66.4 -30.51 70.9 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.764 1.62 . . . . 0.0 111.768 165.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m 127.56 51.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.322 1 C-N-CA 132.258 4.223 . . . . 0.0 110.558 169.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -130.12 138.03 50.47 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 123.71 1.719 . . . . 0.0 115.389 -165.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.444 0.5 OUTLIER -111.3 119.83 40.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 118.577 -2.577 . . . . 0.0 114.12 168.439 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.75 162.36 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 128.527 2.731 . . . . 0.0 105.418 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -86.35 147.13 26.18 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 128.579 3.674 . . . . 0.0 112.906 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -60.41 -13.81 15.49 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 128.102 2.561 . . . . 0.0 113.987 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -35.83 3.01 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 119.75 -1.844 . . . . 0.0 111.336 160.223 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -90.26 -3.72 57.62 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-O 124.864 2.269 . . . . 0.0 108.883 -166.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -79.49 124.47 28.51 Favored 'General case' 0 C--N 1.358 0.948 0 O-C-N 117.765 -3.084 . . . . 0.0 109.509 165.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.5 p 37.88 65.62 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.942 2.097 . . . . 0.0 116.234 -163.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.5 p30 -99.2 -4.21 32.59 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 160.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 75.84 12.71 83.71 Favored Glycine 0 CA--C 1.538 1.531 0 CA-C-O 116.55 -2.25 . . . . 0.0 115.089 -162.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -105.76 122.79 46.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.769 2.785 . . . . 0.0 112.908 177.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -24.59 -50.02 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 127.52 2.328 . . . . 0.0 113.633 162.46 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 30.75 -49.55 0.0 OUTLIER 'General case' 0 C--N 1.352 0.682 1 C-N-CA 139.109 6.964 . . . . 0.0 114.621 -179.56 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.412 ' C ' ' H ' ' A' ' 33' ' ' ASP . 35.0 t -66.21 -23.19 66.39 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 129.42 3.088 . . . . 0.0 115.384 167.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.46 -29.55 0.18 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.638 1.975 . . . . 0.0 113.563 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.412 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -72.74 -19.4 61.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.177 1.791 . . . . 0.0 110.494 164.456 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.7 t30 45.61 87.55 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.808 1.643 . . . . 0.0 110.812 -155.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.6 m -86.26 -73.86 0.44 Allowed 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 114.44 -2.695 . . . . 0.0 104.157 163.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.83 -44.51 94.01 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 128.029 3.33 . . . . 0.0 111.137 -154.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -74.94 6.15 4.39 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 119.27 -2.143 . . . . 0.0 111.907 -173.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.475 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -104.12 135.62 19.31 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 116.656 -1.64 . . . . 0.0 108.044 161.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.79 20.28 0.15 Allowed 'Trans proline' 0 C--N 1.356 0.957 1 C-N-CA 126.459 4.772 . . . . 0.0 114.303 -171.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.475 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -66.86 -23.16 65.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.298 0.639 . . . . 0.0 110.308 152.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -125.89 -79.98 0.61 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.99 1.716 . . . . 0.0 108.936 177.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 21.3 t -157.26 118.3 3.62 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -128.64 108.03 10.17 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 120.539 -1.351 . . . . 0.0 109.039 172.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -142.28 114.55 8.31 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.679 0.792 . . . . 0.0 110.218 -174.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 23.9 m80 . . . . . 0 CA--C 1.534 0.346 0 C-N-CA 124.956 1.303 . . . . 0.0 111.519 175.922 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.171 0 N-CA-C 112.368 -0.293 . . . . 0.0 112.368 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 t 75.11 126.25 0.03 OUTLIER Pre-proline 0 N--CA 1.473 0.718 0 C-N-CA 127.781 2.433 . . . . 0.0 111.609 -170.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -68.49 111.74 2.63 Favored 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.151 1.901 . . . . 0.0 108.45 173.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -79.77 -63.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.594 2.196 . . . . 0.0 114.437 -155.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 57.62 -52.67 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.119 2.568 . . . . 0.0 115.623 -171.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.26 -64.64 1.09 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.345 1.458 . . . . 0.0 109.973 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -149.76 158.74 37.09 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.931 2.092 . . . . 0.0 108.0 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -64.14 92.8 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.443 2.762 . . . . 0.0 112.225 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.61 -17.97 2.62 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 126.033 1.778 . . . . 0.0 114.482 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -78.68 -167.94 1.25 Allowed 'General case' 0 C--O 1.239 0.525 0 C-N-CA 125.435 1.494 . . . . 0.0 111.753 -171.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -113.43 120.94 42.78 Favored 'General case' 0 CA--C 1.561 1.368 1 CA-C-O 129.143 4.306 . . . . 0.0 116.323 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.93 109.18 20.62 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 117.955 -2.965 . . . . 0.0 112.642 167.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.01 29.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.898 1.679 . . . . 0.0 110.888 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -12.05 3.55 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -65.29 -31.56 72.76 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.739 1.609 . . . . 0.0 111.845 164.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.5 m 128.55 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 C-N-CA 132.131 4.172 . . . . 0.0 110.61 170.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -129.19 134.8 48.17 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 124.079 1.895 . . . . 0.0 115.311 -168.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.37 119.8 36.57 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 119.044 -2.285 . . . . 0.0 110.731 161.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.71 160.82 39.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 115.019 -2.42 . . . . 0.0 105.979 170.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -83.1 150.47 26.27 Favored 'General case' 0 N--CA 1.448 -0.532 1 O-C-N 129.379 4.174 . . . . 0.0 112.515 -173.605 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -49.73 -24.56 2.38 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 127.42 2.95 . . . . 0.0 115.119 -171.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -38.55 7.23 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 121.441 1.928 . . . . 0.0 110.183 169.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -83.6 -7.99 59.4 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-O 124.781 2.229 . . . . 0.0 108.089 -163.306 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt -77.02 131.44 38.43 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 118.006 -2.934 . . . . 0.0 110.381 166.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 m 63.4 17.59 10.41 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.031 2.132 . . . . 0.0 114.457 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.43 -11.19 59.92 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 128.193 2.597 . . . . 0.0 113.382 -165.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.435 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 84.37 6.59 85.88 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 116.45 -2.306 . . . . 0.0 114.908 -173.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.88 146.6 43.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 128.438 3.97 . . . . 0.0 117.061 175.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -64.65 48.42 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.43 2.692 . . . . 0.0 111.363 165.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -45.31 -34.71 3.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.958 2.503 . . . . 0.0 110.247 164.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.432 ' C ' ' H ' ' A' ' 33' ' ' ASP . 29.2 t -78.99 -14.89 58.93 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 128.4 2.68 . . . . 0.0 115.097 179.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.19 -30.16 0.08 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.386 2.275 . . . . 0.0 114.945 -172.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.432 ' H ' ' C ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -79.53 -20.87 46.1 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 127.542 2.337 . . . . 0.0 110.601 171.206 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 52.83 82.31 0.07 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.123 1.769 . . . . 0.0 109.909 -163.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -88.56 -72.49 0.54 Allowed 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 113.814 -2.994 . . . . 0.0 103.885 168.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -59.57 -45.04 93.01 Favored 'General case' 0 C--O 1.241 0.618 0 O-C-N 127.921 3.263 . . . . 0.0 111.654 -156.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.435 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 40.4 mm-40 -70.97 5.41 2.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.29 -176.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.434 ' C ' ' H ' ' A' ' 40' ' ' ALA . . . -113.78 140.72 25.05 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 117.016 -1.469 . . . . 0.0 108.941 165.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -71.13 21.45 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.859 1 C-N-CA 126.034 4.489 . . . . 0.0 114.162 -170.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.434 ' H ' ' C ' ' A' ' 38' ' ' ALA . . . -67.51 -22.25 65.45 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.956 -0.465 . . . . 0.0 110.231 151.164 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.9 tt -129.15 -76.19 0.55 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 125.983 1.713 . . . . 0.0 109.201 179.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 7.3 t -134.57 -65.76 0.63 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 116.056 1.872 . . . . 0.0 116.056 -179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . 0.66 ' CG ' ' H ' ' A' ' 44' ' ' GLN . 12.8 t-80 56.78 -170.07 0.09 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.606 1.162 . . . . 0.0 113.121 -160.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.66 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 3.9 mm-40 22.87 87.49 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 130.877 3.671 . . . . 0.0 116.634 175.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 6.7 m170 . . . . . 0 CA--C 1.535 0.374 0 C-N-CA 126.067 1.747 . . . . 0.0 111.939 172.572 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 122.058 0.932 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.469 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 13.6 mt-30 -129.8 -174.59 0.39 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.171 3.388 . . . . 0.0 105.068 168.176 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -77.37 66.7 7.87 Favored 'Trans proline' 0 CA--C 1.549 1.269 0 CA-C-N 123.717 2.363 . . . . 0.0 112.867 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.01 59.89 0.04 OUTLIER Glycine 0 C--N 1.345 1.064 0 C-N-CA 124.345 0.974 . . . . 0.0 115.065 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.469 ' HG3' ' H ' ' A' ' 7' ' ' GLN . 6.2 mm-40 -133.29 -158.9 0.92 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.069 1.348 . . . . 0.0 111.495 -166.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -121.86 127.81 50.92 Favored 'General case' 0 CA--C 1.569 1.703 1 CA-C-O 129.295 4.379 . . . . 0.0 117.879 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.33 111.63 23.96 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 117.154 -3.466 . . . . 0.0 112.275 171.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 38.1 t -87.35 127.98 35.19 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.971 1.708 . . . . 0.0 111.017 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.64 -11.45 4.95 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -63.38 -28.37 69.94 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.858 1.663 . . . . 0.0 112.032 163.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.7 m 126.55 45.42 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.425 1 C-N-CA 132.239 4.215 . . . . 0.0 110.885 166.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.8 mmm-85 -126.53 135.94 51.95 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 123.706 1.717 . . . . 0.0 114.641 -158.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.99 116.46 30.25 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 119.791 -1.818 . . . . 0.0 110.519 166.08 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.42 HG21 ' CZ3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -139.07 176.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 115.381 -2.247 . . . . 0.0 105.733 174.486 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -103.15 149.4 24.68 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 128.501 3.626 . . . . 0.0 112.429 -162.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -53.16 -19.36 2.9 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 127.714 3.134 . . . . 0.0 113.942 -167.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.38 -42.0 9.69 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.668 1.576 . . . . 0.0 109.632 169.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.944 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 9.3 m0 -73.49 -17.58 61.21 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 123.928 1.823 . . . . 0.0 108.386 -163.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' HB2' ' A' ' 36' ' ' ASP . 46.1 mtmt -80.47 110.1 15.61 Favored 'General case' 0 C--N 1.357 0.917 0 O-C-N 119.879 -1.763 . . . . 0.0 108.881 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 m 71.85 24.35 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.63 1.172 . . . . 0.0 112.376 -170.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.433 ' OD1' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -77.57 -30.36 52.55 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.667 -1.271 . . . . 0.0 110.752 173.118 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.79 -1.41 71.3 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 117.609 -1.662 . . . . 0.0 114.137 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 30' ' ' ASP . 38.7 t70 -96.09 150.58 20.34 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 125.944 2.783 . . . . 0.0 111.891 162.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -48.92 -42.42 37.11 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 111.842 -2.436 . . . . 0.0 113.018 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 28' ' ' ASP . 17.1 t0 59.61 -60.89 0.05 Allowed 'General case' 0 N--CA 1.477 0.904 1 C-N-CA 133.174 4.59 . . . . 0.0 110.914 151.398 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.6 t -52.11 -20.33 2.44 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 128.146 2.579 . . . . 0.0 116.942 150.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -34.03 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.646 1.978 . . . . 0.0 113.035 -172.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -12.1 53.53 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.885 1.674 . . . . 0.0 110.816 172.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.79 63.86 1.92 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.862 1.665 . . . . 0.0 109.951 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 m -85.68 -56.1 3.66 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.944 ' OD2' ' O ' ' A' ' 23' ' ' TRP . 16.7 p-10 -55.8 -47.26 77.43 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 126.411 3.005 . . . . 0.0 110.655 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.499 ' OE2' ' OD2' ' A' ' 36' ' ' ASP 0.261 8.9 mm-40 -83.6 17.89 2.08 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 119.13 -2.231 . . . . 0.0 113.468 -178.37 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.44 132.85 20.56 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-O 116.76 -1.59 . . . . 0.0 108.06 150.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.89 20.99 0.18 Allowed 'Trans proline' 0 CA--C 1.542 0.878 1 C-N-CA 126.177 4.585 . . . . 0.0 114.334 -169.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.28 -22.22 64.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.314 0.646 . . . . 0.0 110.378 152.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 9.6 tt -120.61 -74.39 0.61 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.471 1.508 . . . . 0.0 108.935 177.69 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.0 t -139.92 -70.12 0.4 Allowed 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 116.311 1.967 . . . . 0.0 116.311 176.262 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.684 0 C-N-CA 126.532 1.933 . . . . 0.0 114.197 -164.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -145.01 167.7 13.96 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 128.162 2.585 . . . . 0.0 107.33 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.44 70.66 4.79 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.154 2.57 . . . . 0.0 112.913 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.18 46.02 0.03 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.898 1.237 . . . . 0.0 113.756 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -133.3 -172.69 3.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.606 1.162 . . . . 0.0 112.155 -166.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -109.86 124.55 51.53 Favored 'General case' 0 CA--C 1.56 1.354 1 CA-C-O 128.681 4.086 . . . . 0.0 116.449 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.4 108.11 20.73 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 118.421 -2.674 . . . . 0.0 112.627 170.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.0 t -85.55 125.01 32.76 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.51 1.524 . . . . 0.0 111.233 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.71 -16.63 4.51 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 173.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -68.5 -24.45 64.67 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 120.635 1.561 . . . . 0.0 112.031 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.7 m 126.28 50.75 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 131.84 4.056 . . . . 0.0 111.221 165.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -128.38 135.72 49.93 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 124.231 1.967 . . . . 0.0 115.53 -166.263 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.18 121.12 38.72 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 119.353 -2.092 . . . . 0.0 110.413 160.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.34 167.69 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 114.087 -2.863 . . . . 0.0 106.729 173.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -87.24 144.73 26.68 Favored 'General case' 0 N--CA 1.45 -0.469 1 O-C-N 129.395 4.185 . . . . 0.0 113.301 -170.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.54 -16.4 9.89 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 128.122 2.569 . . . . 0.0 114.249 -170.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.0 ttp85 -50.19 -27.13 5.4 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.587 -1.321 . . . . 0.0 112.614 165.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -93.9 -4.34 50.09 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-O 126.33 2.967 . . . . 0.0 109.579 -171.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -78.55 111.29 14.45 Favored 'General case' 0 C--N 1.355 0.814 0 O-C-N 116.471 -3.893 . . . . 0.0 109.029 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.283 8.1 p 41.75 53.27 4.01 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -166.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -76.8 -24.85 52.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 118.756 -0.64 . . . . 0.0 112.269 145.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.6 -8.49 40.31 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-O 117.063 -1.965 . . . . 0.0 115.339 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -98.1 144.77 27.23 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 125.987 2.803 . . . . 0.0 113.887 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.84 58.42 0.33 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 118.616 -2.552 . . . . 0.0 110.878 170.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -56.22 -30.66 62.63 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 127.206 2.202 . . . . 0.0 110.12 175.636 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 51.6 t -80.38 -15.38 56.96 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.69 1.996 . . . . 0.0 115.779 175.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.37 -36.55 0.13 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.321 2.248 . . . . 0.0 114.849 -170.006 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -19.22 61.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.19 2.596 . . . . 0.0 111.014 169.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.7 74.56 0.44 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.365 2.266 . . . . 0.0 111.003 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.1 m -102.24 -58.41 1.88 Allowed 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.728 0.811 . . . . 0.0 110.237 -177.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.0 OUTLIER -28.6 -67.65 0.07 Allowed 'General case' 0 C--O 1.247 0.923 0 CA-C-O 128.012 3.767 . . . . 0.0 111.631 158.026 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 20.4 mm-40 -86.77 21.0 2.35 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 112.151 -2.295 . . . . 0.0 112.863 -173.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.6 135.52 21.1 Favored Pre-proline 0 CA--C 1.542 0.658 0 CA-C-O 115.085 -2.388 . . . . 0.0 107.994 154.469 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -68.31 21.66 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.074 1 C-N-CA 125.735 4.29 . . . . 0.0 114.614 -173.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.05 -20.87 60.89 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.052 0.941 . . . . 0.0 110.293 153.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 tt -120.15 -80.5 0.62 Allowed 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.716 1.607 . . . . 0.0 108.576 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 38.8 t -141.74 -54.36 0.45 Allowed 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 32.2 t-80 . . . . . 0 N--CA 1.476 0.871 0 C-N-CA 125.536 1.534 . . . . 0.0 114.777 -171.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 110.477 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -150.13 167.83 12.22 Favored Pre-proline 0 CA--C 1.552 1.019 0 C-N-CA 128.883 2.873 . . . . 0.0 106.908 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.66 76.89 1.45 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 123.323 2.682 . . . . 0.0 113.461 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.7 43.8 0.07 OUTLIER Glycine 0 N--CA 1.473 1.115 0 C-N-CA 124.441 1.02 . . . . 0.0 114.577 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -128.25 -174.51 3.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.271 1.035 . . . . 0.0 113.181 -162.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -109.14 121.29 44.83 Favored 'General case' 0 CA--C 1.563 1.465 1 CA-C-O 128.964 4.221 . . . . 0.0 116.214 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.8 107.79 20.32 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 118.223 -2.798 . . . . 0.0 112.75 172.383 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.5 t -82.59 124.09 29.82 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.302 1.441 . . . . 0.0 111.508 175.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.83 -12.53 3.18 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 173.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -67.38 -30.62 70.45 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.925 1.693 . . . . 0.0 111.684 165.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.9 m 128.03 53.78 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.273 1 C-N-CA 132.186 4.194 . . . . 0.0 110.741 170.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -129.28 132.16 47.12 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-O 124.341 2.02 . . . . 0.0 114.835 -167.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -101.49 117.57 35.19 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 118.739 -2.476 . . . . 0.0 110.212 167.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.18 169.41 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 114.961 -2.447 . . . . 0.0 105.987 172.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.98 154.45 18.15 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.547 3.029 . . . . 0.0 113.704 -171.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.05 -15.38 31.74 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 127.162 2.789 . . . . 0.0 114.196 -168.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -43.27 -33.52 0.99 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.545 -1.347 . . . . 0.0 112.82 160.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -95.41 -0.29 52.64 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 125.704 2.669 . . . . 0.0 111.825 -171.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HG2' HD21 ' A' ' 41' ' ' LEU . 18.6 mttt -79.44 101.06 7.96 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 117.398 -3.314 . . . . 0.0 108.807 173.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.337 21.2 p 49.76 57.84 6.09 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -165.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.1 p30 -75.61 -23.03 56.38 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.679 137.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.87 9.71 65.71 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-O 117.668 -1.629 . . . . 0.0 113.932 -168.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -93.98 135.37 35.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.321 2.06 . . . . 0.0 110.949 171.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -29.29 -13.81 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 1 C-N-CA 132.344 4.258 . . . . 0.0 119.523 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.553 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 3.0 p30 -80.13 -23.86 40.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 123.591 1.663 . . . . 0.0 109.566 -85.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.5 t -56.11 -21.62 23.37 Favored 'General case' 0 N--CA 1.429 -1.494 1 C-N-CA 132.272 4.229 . . . . 0.0 116.176 164.014 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 69.66 -29.77 0.18 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.663 2.385 . . . . 0.0 113.494 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -16.66 62.3 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.637 1.975 . . . . 0.0 110.545 157.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.19 64.24 1.93 Allowed 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 126.17 1.788 . . . . 0.0 110.233 -176.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.5 m -73.56 -64.85 0.91 Allowed 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 176.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.765 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -39.29 -63.8 0.52 Allowed 'General case' 0 N--CA 1.441 -0.884 2 C-N-CA 132.752 4.421 . . . . 0.0 110.524 -177.998 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -84.81 21.34 1.58 Allowed 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 111.036 -2.802 . . . . 0.0 112.544 -172.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.68 139.52 26.42 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 116.136 -1.888 . . . . 0.0 108.428 153.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -69.12 20.72 0.15 Allowed 'Trans proline' 0 CA--C 1.542 0.886 1 C-N-CA 125.875 4.383 . . . . 0.0 114.596 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.65 -21.29 63.55 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.213 0.605 . . . . 0.0 110.388 152.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.765 HD22 ' HA ' ' A' ' 36' ' ' ASP . 8.1 tt -123.66 -76.07 0.59 Allowed 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.917 1.687 . . . . 0.0 108.786 178.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.4 t -139.74 -67.12 0.44 Allowed 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.6 t60 . . . . . 0 N--CA 1.474 0.739 0 C-N-CA 126.626 1.97 . . . . 0.0 115.043 -161.097 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -139.25 168.96 13.53 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 128.471 2.708 . . . . 0.0 107.454 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.2 73.31 4.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.816 2.344 . . . . 0.0 113.082 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.41 46.58 0.02 OUTLIER Glycine 0 CA--C 1.528 0.904 0 C-N-CA 125.305 1.431 . . . . 0.0 112.988 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -134.99 -176.83 4.38 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.663 1.185 . . . . 0.0 112.47 -165.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -105.75 121.96 45.1 Favored 'General case' 0 CA--C 1.56 1.349 1 CA-C-O 128.689 4.09 . . . . 0.0 116.268 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.38 107.37 19.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 118.353 -2.717 . . . . 0.0 112.58 171.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.5 t -86.97 126.59 34.82 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.832 1.653 . . . . 0.0 111.725 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.48 -13.18 3.3 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 115.866 1.802 . . . . 0.0 115.866 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -66.77 -28.59 68.52 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.759 1.618 . . . . 0.0 111.744 165.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.4 m 128.36 48.49 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.382 1 C-N-CA 132.133 4.173 . . . . 0.0 110.912 166.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -126.85 136.04 51.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 124.265 1.983 . . . . 0.0 115.069 -162.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 120.01 37.34 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 119.406 -2.059 . . . . 0.0 110.326 163.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.6 170.82 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 114.501 -2.666 . . . . 0.0 106.341 172.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -94.07 147.44 23.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 128.439 3.587 . . . . 0.0 113.407 -168.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -53.59 -20.57 5.3 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 127.603 3.064 . . . . 0.0 113.809 -169.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -50.46 -28.52 8.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.948 0.899 . . . . 0.0 112.265 167.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -92.82 -5.41 51.12 Favored 'General case' 0 CA--C 1.565 1.52 0 CA-C-O 126.751 3.167 . . . . 0.0 109.237 -170.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB3' HD21 ' A' ' 41' ' ' LEU . 34.7 mtpt -80.16 102.5 9.44 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 116.368 -3.958 . . . . 0.0 108.493 171.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.294 21.1 p 45.99 60.04 3.4 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -165.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -71.07 -26.91 63.27 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.444 -1.253 . . . . 0.0 112.482 133.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.0 19.73 20.75 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-O 116.238 -2.423 . . . . 0.0 115.248 -172.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -128.74 152.46 48.4 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 126.726 3.155 . . . . 0.0 115.139 169.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.497 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.23 52.83 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 O-C-N 118.567 -2.583 . . . . 0.0 111.765 171.168 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.629 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -55.63 -29.54 59.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.368 1.867 . . . . 0.0 110.033 176.11 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.3 t -78.72 -13.55 59.75 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 127.572 2.349 . . . . 0.0 116.129 175.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.6 -34.51 0.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.991 2.116 . . . . 0.0 114.837 -172.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.63 -22.14 59.08 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 128.275 2.63 . . . . 0.0 111.074 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 56.97 86.41 0.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.358 2.263 . . . . 0.0 111.31 -168.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -105.05 -61.77 1.43 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.174 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.696 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -29.97 -67.46 0.08 Allowed 'General case' 0 C--O 1.246 0.873 1 CA-C-O 128.699 4.095 . . . . 0.0 111.763 166.634 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -86.18 17.87 3.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.069 -2.332 . . . . 0.0 112.906 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.94 139.35 20.57 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.032 156.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -68.09 20.69 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.864 1 C-N-CA 126.323 4.682 . . . . 0.0 114.27 -173.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.36 -20.7 59.99 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.127 0.971 . . . . 0.0 110.421 155.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.696 HD22 ' HA ' ' A' ' 36' ' ' ASP . 9.3 tt -125.76 -76.62 0.58 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.94 1.296 . . . . 0.0 109.218 -176.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 47.6 t -138.53 -71.23 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 171.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 24.1 t60 . . . . . 0 CA--C 1.545 0.781 0 C-N-CA 125.83 1.652 . . . . 0.0 113.721 -162.579 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 122.247 1.022 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -132.09 -179.65 1.12 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.394 3.478 . . . . 0.0 105.033 171.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -74.88 69.42 5.45 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.23 2.189 . . . . 0.0 113.165 -174.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.08 54.29 0.05 OUTLIER Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.94 1.257 . . . . 0.0 114.814 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -133.28 -165.94 1.69 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.766 1.283 . . . . 0.0 112.723 -166.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -117.41 125.08 50.36 Favored 'General case' 0 CA--C 1.564 1.502 1 CA-C-O 128.848 4.166 . . . . 0.0 118.205 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.3 107.09 18.35 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 117.725 -3.109 . . . . 0.0 112.678 171.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.35 127.02 31.96 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.851 1.26 . . . . 0.0 109.927 170.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.54 -21.91 19.11 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 170.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -7.3 38.02 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 119.849 1.204 . . . . 0.0 112.416 168.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.5 m 106.91 53.45 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.893 1 C-N-CA 132.059 4.144 . . . . 0.0 110.392 160.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.6 mmm-85 -130.76 131.26 44.62 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 123.063 1.411 . . . . 0.0 114.526 -166.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.332 0.1 OUTLIER -101.56 115.08 29.71 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 119.65 -1.906 . . . . 0.0 111.706 168.471 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -136.41 170.68 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 115.553 -2.165 . . . . 0.0 105.635 174.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -97.76 155.38 17.05 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 128.167 3.417 . . . . 0.0 112.958 -167.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -58.63 -16.9 18.12 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 127.271 2.857 . . . . 0.0 114.626 -163.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.54 -41.11 4.31 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.089 1.768 . . . . 0.0 110.787 163.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -84.58 -7.95 59.07 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 125.97 2.795 . . . . 0.0 108.61 -164.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.562 ' HG2' HD21 ' A' ' 41' ' ' LEU . 13.8 mttt -77.98 123.39 26.75 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 117.107 -3.496 . . . . 0.0 107.401 164.026 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 m 78.97 11.63 1.46 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.864 1.665 . . . . 0.0 114.862 168.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.575 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 34.2 p-10 -83.79 -3.61 57.98 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.07 -1.644 . . . . 0.0 112.239 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 77.38 10.33 86.31 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-O 117.762 -1.577 . . . . 0.0 114.35 -175.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -103.86 125.69 50.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 124.188 1.947 . . . . 0.0 112.347 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.871 ' H ' HD21 ' A' ' 29' ' ' ASN . 0.0 OUTLIER -67.77 56.93 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 118.828 -2.42 . . . . 0.0 110.801 163.661 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.581 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -57.06 -31.75 65.53 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.972 2.509 . . . . 0.0 109.459 175.951 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.0 t -75.7 -14.49 60.34 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.734 2.414 . . . . 0.0 115.619 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.16 -35.75 0.17 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.325 2.25 . . . . 0.0 114.485 -172.227 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.66 61.57 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 128.206 2.602 . . . . 0.0 110.774 171.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 54.58 80.75 0.12 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.824 2.05 . . . . 0.0 110.413 -164.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 m -86.12 -76.45 0.34 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 115.335 -2.269 . . . . 0.0 105.334 170.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.692 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -22.49 -70.68 0.02 OUTLIER 'General case' 0 N--CA 1.441 -0.889 2 C-N-CA 134.074 4.95 . . . . 0.0 111.411 175.331 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.575 ' OE2' ' OD1' ' A' ' 26' ' ' ASP . 28.4 mm-40 -80.74 16.27 1.47 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 111.871 -2.422 . . . . 0.0 113.228 -167.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.52 140.5 30.48 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 116.257 -1.83 . . . . 0.0 108.148 164.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.67 19.99 0.26 Allowed 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.66 4.24 . . . . 0.0 114.224 -168.355 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.29 -20.47 62.2 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.015 0.526 . . . . 0.0 110.189 153.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.692 HD22 ' HA ' ' A' ' 36' ' ' ASP . 2.3 tt -125.57 -77.09 0.58 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.417 1.487 . . . . 0.0 109.538 174.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 11.9 t -133.28 -61.52 0.82 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 75.3 t60 . . . . . 0 N--CA 1.474 0.768 0 C-N-CA 125.144 1.377 . . . . 0.0 114.199 -162.91 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.471 0.575 0 CA-C-O 121.098 0.475 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -144.74 169.81 9.33 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 129.1 2.96 . . . . 0.0 106.463 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.86 70.0 4.45 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 122.355 2.037 . . . . 0.0 113.336 -174.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.16 40.36 0.03 OUTLIER Glycine 0 CA--C 1.533 1.185 0 C-N-CA 125.318 1.437 . . . . 0.0 115.282 178.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -125.58 -163.42 1.2 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 119.031 1.416 . . . . 0.0 113.145 -164.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -124.17 125.33 44.26 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 128.479 3.99 . . . . 0.0 117.803 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.15 111.35 22.87 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 117.288 -3.383 . . . . 0.0 113.615 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.6 t -82.07 125.03 30.36 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.121 1.769 . . . . 0.0 111.035 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.4 -10.9 3.58 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 174.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -66.22 -30.08 70.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 120.883 1.674 . . . . 0.0 111.635 164.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.8 m 128.11 51.79 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.343 1 C-N-CA 132.076 4.15 . . . . 0.0 110.803 168.03 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -128.13 134.41 49.11 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 123.839 1.781 . . . . 0.0 114.772 -166.488 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.272 0.5 OUTLIER -97.89 117.9 33.25 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 119.067 -2.271 . . . . 0.0 110.697 162.995 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.42 169.74 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-O 114.749 -2.548 . . . . 0.0 106.141 173.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -93.78 146.92 23.52 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 129.04 3.963 . . . . 0.0 112.964 -170.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.32 -16.13 31.9 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 126.926 2.641 . . . . 0.0 113.708 -166.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.3 ttt180 -46.16 -27.88 1.09 Allowed 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.143 -1.598 . . . . 0.0 113.026 162.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -97.47 -9.38 27.32 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 126.244 2.926 . . . . 0.0 110.117 -172.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -75.44 136.24 40.7 Favored 'General case' 0 C--N 1.353 0.735 1 O-C-N 115.92 -4.237 . . . . 0.0 107.916 166.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.1 m 63.75 13.58 7.55 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.74 -35.19 52.14 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.642 -173.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.468 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 106.53 -3.26 36.85 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 117.094 -1.948 . . . . 0.0 114.615 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -105.69 145.28 31.28 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 126.073 2.844 . . . . 0.0 112.487 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.64 60.85 0.35 Allowed 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.43 -2.044 . . . . 0.0 109.23 168.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.737 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 1.2 p30 -59.0 -25.68 63.86 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.352 1.861 . . . . 0.0 110.144 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.8 t -78.08 -16.7 57.79 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 129.107 2.963 . . . . 0.0 116.258 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.38 -33.9 0.15 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.796 2.038 . . . . 0.0 115.06 -172.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -20.38 60.43 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.01 2.124 . . . . 0.0 111.057 168.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 51.6 t30 59.23 83.41 0.13 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.837 2.455 . . . . 0.0 112.213 -168.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -103.93 -61.78 1.39 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.737 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.8 OUTLIER -31.1 -67.99 0.09 Allowed 'General case' 0 C--O 1.242 0.702 0 CA-C-O 127.12 3.343 . . . . 0.0 110.529 163.601 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.468 ' CD ' ' H ' ' A' ' 27' ' ' GLY 0.326 3.7 mm-40 -92.02 25.84 2.69 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 119.245 -2.159 . . . . 0.0 112.122 -170.887 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -108.86 126.84 28.51 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 114.961 -2.447 . . . . 0.0 107.189 151.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.78 19.87 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 125.984 4.456 . . . . 0.0 114.801 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.75 -21.61 61.72 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.934 0.893 . . . . 0.0 110.457 154.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -114.95 -79.5 0.59 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.82 1.648 . . . . 0.0 108.362 173.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 3.7 t -137.28 -60.38 0.67 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 24.8 t-80 . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 125.491 1.517 . . . . 0.0 113.149 -165.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -145.99 167.99 12.82 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.955 2.502 . . . . 0.0 107.427 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 75.34 1.83 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.317 2.678 . . . . 0.0 112.797 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.16 46.73 0.06 OUTLIER Glycine 0 N--CA 1.469 0.885 0 C-N-CA 124.284 0.945 . . . . 0.0 114.064 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -133.75 -172.23 2.92 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.421 1.088 . . . . 0.0 111.861 -168.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -110.38 121.95 46.53 Favored 'General case' 0 CA--C 1.56 1.362 1 CA-C-O 128.882 4.182 . . . . 0.0 116.568 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.16 108.51 21.23 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 118.29 -2.756 . . . . 0.0 112.81 172.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 28.3 t -82.49 122.95 28.71 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 125.822 1.649 . . . . 0.0 111.226 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.49 -19.84 2.51 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -70.98 -22.65 62.16 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.006 1.275 . . . . 0.0 112.366 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.4 m 125.59 51.82 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 1 C-N-CA 131.87 4.068 . . . . 0.0 111.425 166.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -130.46 134.95 47.49 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 124.304 2.002 . . . . 0.0 116.291 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.24 121.36 39.04 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.032 -2.293 . . . . 0.0 110.445 160.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.82 169.2 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 115.064 -2.398 . . . . 0.0 105.836 169.466 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -95.88 151.03 19.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 127.954 3.284 . . . . 0.0 112.918 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -61.15 -15.8 37.57 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 126.662 2.476 . . . . 0.0 114.096 -166.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -45.65 -25.65 0.5 Allowed 'General case' 0 CA--C 1.55 0.978 0 O-C-N 119.991 -1.693 . . . . 0.0 113.366 160.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -101.67 -4.2 26.95 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 126.265 2.936 . . . . 0.0 110.873 -172.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -78.24 114.41 17.1 Favored 'General case' 0 C--N 1.354 0.78 1 O-C-N 116.082 -4.136 . . . . 0.0 109.028 170.042 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.25 8.8 p 41.02 55.76 3.09 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -167.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -82.53 -29.63 30.28 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.694 145.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.68 -11.62 42.19 Favored Glycine 0 CA--C 1.534 1.272 0 CA-C-O 117.422 -1.766 . . . . 0.0 115.444 -175.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -81.31 142.33 33.19 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 125.371 2.51 . . . . 0.0 111.535 172.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -45.55 -2.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 130.296 3.438 . . . . 0.0 118.653 -169.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.61 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 3.0 p30 -75.5 -21.42 58.03 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 120.189 -1.569 . . . . 0.0 109.891 -91.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.8 t -61.02 -13.67 18.09 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 130.726 3.61 . . . . 0.0 116.085 164.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.28 -34.1 0.27 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 128.666 2.786 . . . . 0.0 113.248 -174.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -28.42 66.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.655 1.982 . . . . 0.0 110.125 164.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 65.4 81.59 0.2 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.326 2.65 . . . . 0.0 109.689 -169.148 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.4 m -98.27 -60.84 1.47 Allowed 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.61 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.7 p-10 -28.57 -66.31 0.08 Allowed 'General case' 0 C--O 1.247 0.957 0 CA-C-O 127.551 3.548 . . . . 0.0 112.076 157.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 22.2 mm-40 -87.18 17.76 4.1 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.953 -171.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -109.25 135.34 20.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 CA-C-O 115.214 -2.327 . . . . 0.0 108.047 155.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -68.68 22.98 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.993 1 C-N-CA 125.757 4.305 . . . . 0.0 114.556 -173.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.96 -20.32 60.4 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.997 0.919 . . . . 0.0 110.165 153.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -120.46 -82.51 0.65 Allowed 'General case' 0 C--N 1.344 0.346 0 C-N-CA 125.664 1.585 . . . . 0.0 108.868 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 36.4 t -144.47 -47.91 0.26 Allowed 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 177.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 11.7 t-160 . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 121.968 0.89 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -133.34 179.6 1.33 Allowed Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 130.128 3.371 . . . . 0.0 105.081 170.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -74.81 68.91 5.51 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.423 2.258 . . . . 0.0 113.208 -175.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.73 46.14 0.04 OUTLIER Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.636 1.112 . . . . 0.0 115.702 177.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -128.69 -162.34 1.18 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.119 1.46 . . . . 0.0 112.782 -164.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -121.54 125.98 48.09 Favored 'General case' 0 CA--C 1.563 1.444 1 CA-C-O 128.547 4.022 . . . . 0.0 118.669 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.08 107.35 18.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 117.801 -3.062 . . . . 0.0 113.074 170.308 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.7 t -74.25 122.87 23.52 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 168.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.48 -22.91 8.83 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 177.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -60.42 -25.83 66.24 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.755 1.622 . . . . 0.0 113.089 170.298 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.1 m 129.9 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 131.633 3.973 . . . . 0.0 112.317 161.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -125.91 128.58 47.79 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 -164.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.337 0.1 OUTLIER -98.31 116.6 30.88 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 120.237 -1.54 . . . . 0.0 111.951 167.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.25 165.32 31.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 115.249 -2.31 . . . . 0.0 105.768 171.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -88.82 146.56 24.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.922 3.888 . . . . 0.0 112.061 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.4 -21.29 62.05 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 126.805 2.566 . . . . 0.0 113.755 -165.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -40.99 -28.89 0.09 Allowed 'General case' 0 CA--C 1.547 0.849 0 O-C-N 120.394 -1.441 . . . . 0.0 113.359 161.548 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -102.77 -5.35 23.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 111.853 -3.927 . . . . 0.0 113.622 -171.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HE2' HD11 ' A' ' 41' ' ' LEU . 25.3 mttt -72.43 143.2 48.59 Favored 'General case' 0 C--N 1.363 1.165 1 O-C-N 130.505 4.878 . . . . 0.0 109.168 166.112 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.7 p 31.57 56.89 0.3 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.547 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 3.7 p30 -89.26 -8.95 52.4 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.689 1.196 . . . . 0.0 111.84 157.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.97 10.48 75.29 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 117.099 -1.945 . . . . 0.0 112.975 -163.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -115.87 132.49 56.63 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 126.562 3.077 . . . . 0.0 114.591 -172.118 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.65 39.55 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 O-C-N 119.797 -1.815 . . . . 0.0 115.137 152.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.28 -47.47 4.79 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.223 2.209 . . . . 0.0 108.602 146.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.7 t -81.7 113.03 19.41 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 154.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.41 -20.7 0.74 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.537 1.535 . . . . 0.0 114.615 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -102.29 -2.99 27.94 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.569 1.077 . . . . 0.0 113.297 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 51.51 68.55 0.78 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.395 1.878 . . . . 0.0 110.245 -166.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 m -77.65 -67.06 0.76 Allowed 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 11.5 p-10 -60.1 -47.21 86.86 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-O 125.796 2.712 . . . . 0.0 113.232 -170.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.547 ' OE2' ' OD1' ' A' ' 26' ' ' ASP . 58.8 mm-40 -61.18 2.41 0.14 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 112.62 -2.082 . . . . 0.0 114.605 172.389 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.92 141.61 29.5 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 120.178 1.354 . . . . 0.0 109.541 165.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -72.17 21.83 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.823 1 C-N-CA 125.919 4.412 . . . . 0.0 114.192 -168.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.09 -21.07 64.09 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.814 -0.554 . . . . 0.0 110.089 151.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.558 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 10.0 tt -127.21 -77.19 0.57 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 126.257 1.823 . . . . 0.0 108.732 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.2 t -138.13 -61.99 0.59 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 t60 . . . . . 0 CA--C 1.552 1.055 0 C-N-CA 125.743 1.617 . . . . 0.0 114.474 -165.79 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -142.2 -170.69 0.25 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.3 3.44 . . . . 0.0 106.396 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -78.35 70.8 7.06 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 CA-C-N 123.791 2.39 . . . . 0.0 111.464 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 134.73 53.36 0.07 OUTLIER Glycine 0 C--N 1.347 1.145 0 N-CA-C 118.203 2.041 . . . . 0.0 118.203 171.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -127.91 -159.0 0.91 Allowed 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.913 1.857 . . . . 0.0 111.626 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -111.85 124.25 51.96 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 127.911 3.719 . . . . 0.0 116.727 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.84 108.83 21.21 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 118.015 -2.928 . . . . 0.0 113.442 167.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.2 t -81.56 128.3 33.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.646 2.378 . . . . 0.0 111.515 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.93 -11.93 3.93 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 174.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -66.63 -25.83 66.78 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 120.884 1.674 . . . . 0.0 111.911 164.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m 126.77 44.05 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 1 C-N-CA 132.168 4.187 . . . . 0.0 111.281 165.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.4 mmm-85 -128.41 136.41 50.85 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.708 1.718 . . . . 0.0 114.967 -156.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.379 0.6 OUTLIER -104.04 114.51 28.81 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 119.133 -2.23 . . . . 0.0 112.538 170.418 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.55 167.34 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 114.074 -2.87 . . . . 0.0 106.46 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -87.38 145.57 26.25 Favored 'General case' 0 N--CA 1.449 -0.524 1 O-C-N 129.466 4.229 . . . . 0.0 113.235 -171.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.12 -17.18 16.56 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 126.988 2.68 . . . . 0.0 114.212 -167.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.54 -37.75 8.43 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.726 1.603 . . . . 0.0 110.217 165.068 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -83.4 -10.52 58.37 Favored 'General case' 0 CA--C 1.565 1.526 0 CA-C-O 125.849 2.738 . . . . 0.0 108.685 -165.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.2 mttt -76.34 126.91 31.85 Favored 'General case' 0 C--N 1.355 0.82 0 O-C-N 116.67 -3.768 . . . . 0.0 107.786 166.634 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.2 m 66.94 15.59 10.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -18.66 51.39 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 120.319 -1.488 . . . . 0.0 112.578 -175.159 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.475 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 93.63 -0.17 67.48 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 116.992 -2.004 . . . . 0.0 114.6 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.408 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 38.1 t0 -118.23 150.94 38.59 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 126.871 3.224 . . . . 0.0 113.901 170.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.493 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -61.95 53.48 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.741 2.417 . . . . 0.0 110.956 162.479 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.748 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -55.93 -28.97 59.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.754 1.622 . . . . 0.0 109.981 175.318 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.0 t -78.25 -14.03 59.61 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.91 2.884 . . . . 0.0 115.778 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.98 -32.68 0.13 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.115 2.166 . . . . 0.0 114.879 -172.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -22.14 55.12 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.542 2.337 . . . . 0.0 110.964 169.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 57.31 85.72 0.08 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.085 2.154 . . . . 0.0 111.491 -166.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.9 m -101.83 -62.82 1.21 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.748 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -29.58 -68.95 0.07 Allowed 'General case' 0 C--O 1.242 0.692 0 C-N-CA 130.571 3.549 . . . . 0.0 111.004 166.814 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.475 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 11.8 mm-40 -86.31 19.19 2.83 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 119.384 -2.073 . . . . 0.0 112.679 -170.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -110.6 130.64 22.68 Favored Pre-proline 0 CA--C 1.543 0.71 0 CA-C-O 115.538 -2.172 . . . . 0.0 107.406 157.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -68.82 21.04 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.97 1 C-N-CA 125.845 4.363 . . . . 0.0 114.656 -170.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.94 -21.14 60.93 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.858 0.863 . . . . 0.0 110.395 154.187 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -118.36 -79.37 0.59 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.584 1.554 . . . . 0.0 108.595 175.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 14.8 t -134.79 -66.38 0.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.6 t60 . . . . . 0 N--CA 1.471 0.608 0 C-N-CA 125.577 1.551 . . . . 0.0 113.612 -163.924 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -135.69 -167.54 0.15 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.144 3.378 . . . . 0.0 106.023 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -77.09 81.13 2.69 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 CA-C-N 123.734 2.369 . . . . 0.0 110.183 170.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 115.83 56.74 0.34 Allowed Glycine 0 C--N 1.347 1.18 0 N-CA-C 117.923 1.929 . . . . 0.0 117.923 173.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -124.55 -154.49 0.62 Allowed 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.783 . . . . 0.0 111.204 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -117.31 125.3 50.84 Favored 'General case' 0 CA--C 1.56 1.337 0 CA-C-O 128.349 3.928 . . . . 0.0 116.95 177.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.86 110.77 23.12 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 117.95 -2.969 . . . . 0.0 113.269 171.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 20.4 t -80.94 124.18 28.92 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 127.552 2.341 . . . . 0.0 110.733 175.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.33 -16.93 3.94 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 174.06 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -68.47 -26.85 65.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.363 1.438 . . . . 0.0 111.922 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.4 m 126.23 53.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.315 1 C-N-CA 131.929 4.092 . . . . 0.0 110.907 168.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.91 135.04 48.51 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 123.622 1.677 . . . . 0.0 115.525 -170.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.368 0.5 OUTLIER -104.1 116.95 33.13 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 119.132 -2.23 . . . . 0.0 112.09 163.048 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -133.01 160.88 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 115.139 -2.362 . . . . 0.0 104.838 176.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.86 153.42 30.61 Favored 'General case' 0 N--CA 1.442 -0.853 0 O-C-N 128.847 3.842 . . . . 0.0 112.567 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -59.68 -17.49 34.65 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 127.785 3.178 . . . . 0.0 113.863 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.05 -20.67 1.02 Allowed 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.452 -2.03 . . . . 0.0 113.969 162.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -98.99 -4.3 32.9 Favored 'General case' 0 CA--C 1.564 1.491 0 CA-C-O 125.597 2.618 . . . . 0.0 112.403 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -78.33 121.61 24.69 Favored 'General case' 0 C--N 1.352 0.714 0 O-C-N 116.935 -3.603 . . . . 0.0 109.425 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.261 4.2 p 39.14 58.66 1.81 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -89.79 -16.79 29.45 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 159.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 107.69 -12.67 38.82 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-O 115.74 -2.7 . . . . 0.0 116.502 -170.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -119.27 146.98 44.79 Favored 'General case' 0 N--CA 1.477 0.917 1 CA-C-O 129.343 4.401 . . . . 0.0 117.601 -176.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.514 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -66.96 52.91 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 O-C-N 118.031 -2.918 . . . . 0.0 111.37 172.549 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.668 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.5 OUTLIER -51.63 -31.97 27.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.572 1.949 . . . . 0.0 110.075 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 46.8 t -79.43 -13.36 59.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 127.66 2.384 . . . . 0.0 115.894 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.81 -34.27 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 127.391 2.276 . . . . 0.0 114.876 -171.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -20.33 60.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 128.15 2.58 . . . . 0.0 110.765 171.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 51.63 81.15 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.552 1.941 . . . . 0.0 110.035 -162.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.5 m -85.62 -81.89 0.2 Allowed 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.814 -2.291 . . . . 0.0 104.814 168.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.668 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.1 OUTLIER -16.12 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.062 2 C-N-CA 135.422 5.489 . . . . 0.0 112.129 175.891 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -74.84 1.68 12.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.759 -2.019 . . . . 0.0 114.451 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -105.51 131.64 21.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 115.527 -2.178 . . . . 0.0 107.668 169.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -69.76 19.79 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.937 1 C-N-CA 126.639 4.892 . . . . 0.0 114.481 -167.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.45 -23.51 61.85 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.105 0.962 . . . . 0.0 110.507 154.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -117.48 -81.48 0.62 Allowed 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.366 1.866 . . . . 0.0 107.93 170.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 t -142.33 -171.53 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.313 0.506 . . . . 0.0 110.494 170.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 N--CA 1.467 0.425 0 O-C-N 120.032 -1.668 . . . . 0.0 108.977 168.824 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 122.134 0.968 . . . . 0.0 109.046 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -138.85 171.75 7.67 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 130.473 3.509 . . . . 0.0 105.164 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.33 79.96 2.02 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.431 2.088 . . . . 0.0 112.146 -177.445 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.78 50.76 0.1 OUTLIER Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.407 1.003 . . . . 0.0 114.317 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -134.41 -166.47 1.81 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.508 1.123 . . . . 0.0 111.337 -169.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -115.84 122.66 46.06 Favored 'General case' 0 CA--C 1.558 1.283 1 CA-C-O 128.66 4.076 . . . . 0.0 117.115 177.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.22 106.67 18.37 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 118.355 -2.716 . . . . 0.0 111.707 171.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.409 ' SG ' ' HB3' ' A' ' 15' ' ' ASN . 19.8 t -85.47 129.6 34.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 126.217 1.807 . . . . 0.0 112.082 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.87 -22.22 2.09 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.409 ' HB3' ' SG ' ' A' ' 13' ' ' CYS . 24.5 t-20 -65.48 -25.21 67.39 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 120.256 1.389 . . . . 0.0 112.288 169.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m 125.57 44.91 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.441 1 C-N-CA 132.145 4.178 . . . . 0.0 111.056 166.57 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 mmm-85 -127.63 134.4 49.66 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-O 123.628 1.68 . . . . 0.0 114.943 -157.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.312 0.5 OUTLIER -102.54 115.22 30.14 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 119.422 -2.049 . . . . 0.0 111.147 167.749 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -135.92 169.0 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 114.637 -2.602 . . . . 0.0 106.073 174.744 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -93.95 149.09 21.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 128.595 3.685 . . . . 0.0 113.105 -168.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -59.66 -17.29 32.71 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 126.882 2.614 . . . . 0.0 114.008 -167.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -46.09 -26.68 0.79 Allowed 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.172 -1.58 . . . . 0.0 113.247 162.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -99.91 -10.75 21.34 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-O 126.081 2.848 . . . . 0.0 110.19 -172.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.5 mtpt -72.03 139.75 48.69 Favored 'General case' 0 C--N 1.355 0.837 1 O-C-N 115.537 -4.477 . . . . 0.0 107.153 165.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 m 64.35 10.1 5.42 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -41.34 50.99 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.768 1.627 . . . . 0.0 110.622 -170.406 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.428 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 119.16 -1.39 14.59 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-O 116.553 -2.248 . . . . 0.0 115.444 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASP . . . . . 0.531 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 36.2 t0 -118.23 151.32 37.87 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 127.398 3.475 . . . . 0.0 113.965 166.544 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.507 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -62.39 63.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 O-C-N 119.43 -2.044 . . . . 0.0 109.388 163.514 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.659 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 1.3 p30 -65.82 -24.57 66.93 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 120.631 -1.293 . . . . 0.0 109.47 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.7 t -67.33 -13.0 61.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.54 2.736 . . . . 0.0 115.705 166.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 65.06 -38.42 0.24 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.147 2.579 . . . . 0.0 114.56 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -86.65 -9.82 55.18 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.175 2.19 . . . . 0.0 111.028 174.725 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.0 t30 62.86 128.4 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 129.211 3.004 . . . . 0.0 112.546 -167.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.5 m -147.47 -52.15 0.2 Allowed 'General case' 0 C--O 1.212 -0.873 0 O-C-N 120.214 -1.554 . . . . 0.0 111.925 164.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.659 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.1 p-10 -28.41 -69.46 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 CA-C-O 127.912 3.72 . . . . 0.0 111.84 157.428 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 6.0 mm-40 -92.99 23.17 4.4 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.434 -2.666 . . . . 0.0 112.244 -173.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.99 119.62 54.89 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-O 114.458 -2.687 . . . . 0.0 106.045 152.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.52 19.63 0.08 OUTLIER 'Trans proline' 0 CA--C 1.543 0.926 1 C-N-CA 126.488 4.792 . . . . 0.0 115.497 -168.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -21.08 56.51 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.567 1.147 . . . . 0.0 110.319 156.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tt -108.11 -81.2 0.57 Allowed 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.179 1.392 . . . . 0.0 108.559 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 5.4 t -138.86 -59.03 0.61 Allowed 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 . . . . . 0 N--CA 1.473 0.722 0 C-N-CA 125.62 1.568 . . . . 0.0 114.395 -170.832 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.9 t . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 122.181 0.991 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -135.01 178.6 1.69 Allowed Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 131.085 3.754 . . . . 0.0 104.951 171.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.76 71.39 4.84 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 CA-C-N 123.331 2.225 . . . . 0.0 113.297 -173.737 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.81 50.4 0.06 OUTLIER Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.855 1.217 . . . . 0.0 114.871 177.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -129.37 -166.03 1.6 Allowed 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.885 1.342 . . . . 0.0 112.914 -165.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -117.09 123.54 47.04 Favored 'General case' 0 CA--C 1.561 1.367 1 CA-C-O 128.542 4.02 . . . . 0.0 117.166 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.57 108.17 20.71 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 117.871 -3.018 . . . . 0.0 112.374 168.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 13.5 t -79.78 126.39 30.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.31 1.844 . . . . 0.0 110.471 176.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -17.4 2.76 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 173.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.07 -24.33 64.15 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 120.459 1.481 . . . . 0.0 111.733 168.345 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.7 m 122.94 51.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 C-N-CA 131.897 4.079 . . . . 0.0 110.171 167.033 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -127.59 136.06 51.14 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 123.605 1.669 . . . . 0.0 115.445 -167.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.283 0.2 OUTLIER -99.17 115.87 30.06 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 119.455 -2.028 . . . . 0.0 111.068 165.004 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.67 163.31 37.8 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 115.096 -2.383 . . . . 0.0 105.81 173.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -85.48 142.06 29.48 Favored 'General case' 0 N--CA 1.442 -0.849 1 O-C-N 130.105 4.628 . . . . 0.0 111.799 -174.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -58.2 -16.86 15.25 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 127.295 2.872 . . . . 0.0 113.909 -169.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -52.87 -19.85 2.85 Favored 'General case' 0 CA--C 1.553 1.062 0 O-C-N 119.591 -1.943 . . . . 0.0 113.253 163.297 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -92.7 -10.29 37.69 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 126.077 2.846 . . . . 0.0 112.001 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -75.96 120.68 21.63 Favored 'General case' 0 C--N 1.353 0.731 1 O-C-N 116.009 -4.182 . . . . 0.0 108.343 171.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.257 1.6 p 42.83 57.76 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -164.224 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.83 -26.5 22.78 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.105 162.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.421 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 104.84 -3.17 41.62 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 116.966 -2.019 . . . . 0.0 114.712 -174.3 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -123.99 152.39 42.61 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 127.862 3.696 . . . . 0.0 114.471 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.468 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -64.09 55.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 127.877 2.471 . . . . 0.0 110.472 168.557 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.757 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 1.0 OUTLIER -57.49 -27.7 62.77 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.704 1.601 . . . . 0.0 110.139 176.652 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.5 t -80.52 -13.69 58.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 128.263 2.625 . . . . 0.0 115.897 173.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.0 -32.62 0.11 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.479 2.312 . . . . 0.0 115.06 -172.093 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -22.39 59.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 127.69 2.396 . . . . 0.0 110.903 169.106 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 58.6 87.06 0.08 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.352 2.261 . . . . 0.0 111.044 -168.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -106.44 -62.89 1.33 Allowed 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.162 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.757 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -28.86 -67.9 0.07 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-O 127.369 3.462 . . . . 0.0 111.569 164.104 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 26.9 mm-40 -82.37 11.82 5.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 112.676 -2.056 . . . . 0.0 113.752 -170.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.46 131.67 21.54 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-O 115.183 -2.341 . . . . 0.0 107.074 163.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -68.51 22.1 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 126.073 4.516 . . . . 0.0 114.498 -171.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.6 59.69 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.141 0.976 . . . . 0.0 110.227 154.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -119.83 -82.05 0.64 Allowed 'General case' 0 C--N 1.344 0.333 0 C-N-CA 125.614 1.566 . . . . 0.0 108.977 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 15.1 t -140.02 -50.61 0.48 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 37.1 t-80 . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -173.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -152.1 174.29 3.76 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 130.989 3.716 . . . . 0.0 105.605 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.08 84.41 0.44 Allowed 'Trans proline' 0 CA--C 1.545 1.069 0 CA-C-N 123.275 2.205 . . . . 0.0 113.981 -174.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.16 2.08 1.41 Allowed Glycine 0 CA--C 1.534 1.265 0 N-CA-C 117.168 1.627 . . . . 0.0 117.168 171.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.2 -162.12 0.76 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.597 1.199 . . . . 0.0 113.764 -153.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -113.71 124.11 51.5 Favored 'General case' 0 CA--C 1.559 1.299 1 CA-C-O 128.671 4.081 . . . . 0.0 117.157 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.77 110.85 23.39 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 117.958 -2.964 . . . . 0.0 113.071 166.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.6 t -79.14 122.8 26.7 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 125.515 1.526 . . . . 0.0 110.682 171.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.2 -13.57 5.28 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 173.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.99 -27.23 67.27 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.523 1.51 . . . . 0.0 111.996 166.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.7 m 128.31 52.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.389 1 C-N-CA 132.01 4.124 . . . . 0.0 111.319 166.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -130.27 132.18 45.8 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 123.615 1.674 . . . . 0.0 115.497 -168.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.314 0.5 OUTLIER -100.42 117.67 35.07 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 118.911 -2.368 . . . . 0.0 111.015 165.428 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.83 165.48 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 115.146 -2.359 . . . . 0.0 106.059 174.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -91.23 152.1 20.66 Favored 'General case' 0 N--CA 1.446 -0.633 1 O-C-N 129.16 4.037 . . . . 0.0 112.909 -170.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -60.63 -16.83 42.65 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 126.831 2.582 . . . . 0.0 114.123 -167.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -44.09 -27.06 0.35 Allowed 'General case' 0 CA--C 1.552 1.022 0 O-C-N 119.655 -1.903 . . . . 0.0 113.562 160.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.618 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 2.6 m0 -101.47 -6.67 23.66 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 126.354 2.978 . . . . 0.0 110.693 -172.669 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -76.4 118.33 18.97 Favored 'General case' 0 C--N 1.356 0.855 1 O-C-N 116.189 -4.07 . . . . 0.0 108.045 172.12 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.251 2.0 p 46.98 46.42 15.8 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -174.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -75.76 -23.58 55.98 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.145 -0.972 . . . . 0.0 111.693 151.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.56 5.0 65.36 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 117.262 -1.854 . . . . 0.0 114.101 -165.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -90.65 128.28 36.57 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 124.383 2.039 . . . . 0.0 110.094 175.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -44.26 -36.85 2.92 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-O 116.549 -1.691 . . . . 0.0 113.561 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 34.74 -50.1 0.0 OUTLIER 'General case' 0 C--N 1.35 0.624 1 C-N-CA 138.681 6.792 . . . . 0.0 114.72 173.479 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.5 t -69.92 -20.6 63.35 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.513 2.725 . . . . 0.0 115.601 166.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.63 -39.0 0.42 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.927 2.091 . . . . 0.0 112.419 -173.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -14.38 61.24 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.946 2.098 . . . . 0.0 110.311 170.422 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 52.41 65.44 1.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.296 2.239 . . . . 0.0 110.086 -174.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 m -78.93 -60.7 2.27 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 -176.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.618 ' OD2' ' O ' ' A' ' 23' ' ' TRP . 18.5 p-10 -57.82 -49.93 74.98 Favored 'General case' 0 C--O 1.246 0.869 0 CA-C-O 126.577 3.084 . . . . 0.0 111.478 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -71.01 9.75 0.66 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 112.631 -2.077 . . . . 0.0 114.144 176.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.58 137.69 22.28 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-O 116.411 -1.757 . . . . 0.0 108.659 157.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -69.76 21.04 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 126.145 4.563 . . . . 0.0 114.308 -171.278 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.36 -22.14 64.68 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.097 0.559 . . . . 0.0 110.276 151.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 5.7 tt -121.28 -76.56 0.58 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.015 1.726 . . . . 0.0 108.977 176.458 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 34.1 t -139.71 -68.5 0.42 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.2 t60 . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 127.383 2.273 . . . . 0.0 114.768 -164.927 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -139.14 -172.83 0.33 Allowed Pre-proline 0 CA--C 1.555 1.16 0 C-N-CA 130.862 3.665 . . . . 0.0 106.187 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.62 79.62 2.76 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 CA-C-N 123.388 2.246 . . . . 0.0 110.761 171.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 119.47 57.16 0.25 Allowed Glycine 0 C--N 1.346 1.12 0 N-CA-C 117.285 1.674 . . . . 0.0 117.285 173.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -127.39 -160.62 1.02 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 119.737 1.768 . . . . 0.0 111.504 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -108.89 122.95 48.28 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 127.915 3.721 . . . . 0.0 115.962 176.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.05 110.48 23.05 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 118.239 -2.788 . . . . 0.0 113.314 166.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.3 t -77.74 124.1 27.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.121 1.768 . . . . 0.0 110.68 171.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.04 -19.72 2.03 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 172.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -70.4 -24.25 62.9 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 120.279 1.399 . . . . 0.0 112.297 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m 125.59 52.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 131.666 3.987 . . . . 0.0 110.822 166.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.48 132.97 48.37 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 123.472 1.606 . . . . 0.0 115.141 -169.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.375 0.5 OUTLIER -105.09 117.05 33.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.022 -2.299 . . . . 0.0 112.45 167.206 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.68 166.14 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 114.203 -2.808 . . . . 0.0 106.318 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -88.81 144.41 26.24 Favored 'General case' 0 N--CA 1.449 -0.476 1 O-C-N 129.311 4.132 . . . . 0.0 113.103 -170.084 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -58.3 -15.22 9.45 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 127.12 2.763 . . . . 0.0 114.318 -167.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.7 ttp85 -50.64 -28.12 8.23 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.218 -1.551 . . . . 0.0 112.449 164.436 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -91.99 -4.3 54.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 126.146 2.879 . . . . 0.0 110.132 -172.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HB3' HD21 ' A' ' 41' ' ' LEU . 17.8 mttt -78.82 105.91 10.46 Favored 'General case' 0 C--N 1.351 0.672 0 O-C-N 116.425 -3.922 . . . . 0.0 108.265 170.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 12.8 p 48.08 57.16 6.38 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -168.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -81.06 -37.78 28.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.231 145.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.14 -19.96 8.12 Favored Glycine 0 CA--C 1.537 1.457 0 CA-C-O 117.09 -1.95 . . . . 0.0 116.036 -173.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -78.95 139.82 38.16 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 125.941 2.782 . . . . 0.0 111.864 173.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -54.79 8.45 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 118.536 -2.603 . . . . 0.0 117.572 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 2.1 p30 -55.18 -24.18 25.58 Favored 'General case' 0 C--N 1.325 -0.487 1 C-N-CA 133.002 4.521 . . . . 0.0 112.728 -120.746 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.2 t -61.63 -20.68 63.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 130.192 3.397 . . . . 0.0 117.894 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 66.45 -32.28 0.17 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 128.106 2.563 . . . . 0.0 113.777 -171.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -15.98 62.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.395 1.878 . . . . 0.0 110.649 160.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.83 63.49 2.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.285 1.834 . . . . 0.0 110.336 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -79.33 -59.02 2.93 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.674 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -38.93 -66.0 0.32 Allowed 'General case' 0 C--O 1.249 1.039 1 CA-C-O 128.55 4.024 . . . . 0.0 110.974 177.216 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -82.08 19.66 1.12 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 110.473 -3.058 . . . . 0.0 112.909 -175.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -116.2 136.64 23.06 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 115.449 -2.215 . . . . 0.0 108.076 153.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -67.61 19.69 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.987 1 C-N-CA 125.911 4.407 . . . . 0.0 114.688 -173.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.62 -21.86 62.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.863 0.865 . . . . 0.0 110.64 154.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.674 HD22 ' HA ' ' A' ' 36' ' ' ASP . 9.1 tt -119.19 -75.98 0.58 Allowed 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 126.02 1.728 . . . . 0.0 108.23 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 50.9 t -145.92 -59.83 0.32 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 t60 . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 -160.132 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 119.537 -0.268 . . . . 0.0 110.789 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -150.35 167.03 13.81 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.787 2.035 . . . . 0.0 108.808 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.14 78.19 0.81 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.154 2.569 . . . . 0.0 112.194 173.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.72 38.96 0.11 Allowed Glycine 0 N--CA 1.47 0.91 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -132.26 -170.46 2.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.657 1.183 . . . . 0.0 111.537 -171.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -111.93 121.64 45.57 Favored 'General case' 0 CA--C 1.56 1.359 1 CA-C-O 128.844 4.164 . . . . 0.0 116.675 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.23 107.48 19.96 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 118.216 -2.802 . . . . 0.0 112.824 170.075 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.6 t -83.55 123.56 29.88 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.752 1.621 . . . . 0.0 111.334 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.36 -12.76 4.1 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -66.74 -29.6 69.62 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 120.858 1.663 . . . . 0.0 111.775 165.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m 127.95 55.92 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 1 C-N-CA 132.052 4.141 . . . . 0.0 110.732 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -132.51 132.46 42.67 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 124.19 1.948 . . . . 0.0 115.344 -168.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.255 0.3 OUTLIER -98.66 119.38 37.3 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 118.863 -2.398 . . . . 0.0 110.493 161.701 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.24 168.47 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 115.028 -2.415 . . . . 0.0 105.993 171.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -93.84 150.81 20.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 128.366 3.541 . . . . 0.0 112.979 -169.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.2 -16.1 30.19 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 126.756 2.535 . . . . 0.0 114.305 -166.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -45.92 -26.82 0.76 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.117 -1.614 . . . . 0.0 113.297 161.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.8 m0 -99.03 -5.44 30.37 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-O 126.844 3.211 . . . . 0.0 110.377 -172.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.52 ' HG2' HD21 ' A' ' 41' ' ' LEU . 15.7 mttt -76.99 109.94 11.21 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 115.683 -4.385 . . . . 0.0 109.255 171.327 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 p 42.47 53.88 4.53 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 115.983 1.845 . . . . 0.0 115.983 -169.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -68.05 -25.87 65.57 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.251 140.462 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.37 14.38 51.05 Favored Glycine 0 CA--C 1.53 0.976 0 CA-C-O 117.179 -1.901 . . . . 0.0 113.313 -167.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -110.35 139.32 45.66 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-O 126.555 3.074 . . . . 0.0 113.68 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -40.59 -40.3 1.23 Allowed 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.706 2.402 . . . . 0.0 114.363 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.617 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.0 OUTLIER 30.42 -47.52 0.0 OUTLIER 'General case' 0 C--N 1.348 0.504 1 C-N-CA 139.146 6.978 . . . . 0.0 114.857 178.611 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 44.0 t -73.88 -24.81 59.78 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.982 3.313 . . . . 0.0 116.29 169.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.0 -27.52 0.16 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 126.994 2.118 . . . . 0.0 113.941 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -13.96 59.64 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.87 2.068 . . . . 0.0 110.788 158.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 49.82 58.12 5.79 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.376 2.27 . . . . 0.0 110.793 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -69.78 -58.61 3.69 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.617 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -36.66 -65.11 0.3 Allowed 'General case' 0 C--O 1.248 0.987 1 C-N-CA 131.798 4.039 . . . . 0.0 110.669 173.069 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.27 16.58 1.96 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 111.035 -2.802 . . . . 0.0 113.513 -173.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.68 136.53 22.02 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-O 115.689 -2.1 . . . . 0.0 108.174 155.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -68.89 20.9 0.15 Allowed 'Trans proline' 0 CA--C 1.543 0.959 1 C-N-CA 125.768 4.312 . . . . 0.0 114.552 -173.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.34 -21.35 62.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.629 0.772 . . . . 0.0 110.403 152.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 36' ' ' ASP . 6.3 tt -120.42 -76.86 0.58 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 125.78 1.632 . . . . 0.0 108.828 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.2 t -142.38 -61.5 0.44 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.8 t60 . . . . . 0 CA--C 1.541 0.619 0 C-N-CA 126.726 2.01 . . . . 0.0 115.565 -166.281 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 119.635 -0.221 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -150.48 166.11 15.88 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 126.986 2.114 . . . . 0.0 108.78 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.22 78.95 1.13 Allowed 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.05 2.5 . . . . 0.0 112.547 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.26 37.55 0.09 OUTLIER Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.685 1.136 . . . . 0.0 115.209 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -131.03 -170.14 2.3 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.0 1.32 . . . . 0.0 111.598 -168.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -113.75 122.41 47.0 Favored 'General case' 0 CA--C 1.56 1.33 1 CA-C-O 128.987 4.232 . . . . 0.0 116.546 -178.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.88 109.6 22.28 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 118.233 -2.792 . . . . 0.0 112.394 170.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 36.5 t -83.48 124.24 30.52 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.352 1.861 . . . . 0.0 111.307 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.53 -12.91 4.5 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 174.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.5 -29.34 69.42 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.871 1.669 . . . . 0.0 111.84 165.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 m 128.02 52.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.354 1 C-N-CA 132.186 4.194 . . . . 0.0 110.901 169.296 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -130.08 134.83 47.63 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 124.419 2.057 . . . . 0.0 115.66 -167.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 121.39 39.58 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 118.77 -2.456 . . . . 0.0 110.428 162.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.22 164.15 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 114.765 -2.541 . . . . 0.0 105.964 169.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -88.84 151.21 22.5 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.541 3.65 . . . . 0.0 112.721 -172.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -61.21 -16.0 40.4 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 126.39 2.306 . . . . 0.0 114.697 -166.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.39 -38.14 2.62 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.692 1.587 . . . . 0.0 110.792 161.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.807 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 5.7 m95 -88.87 -5.5 57.98 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 124.788 2.232 . . . . 0.0 108.982 -164.153 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HA ' ' HB2' ' A' ' 36' ' ' ASP . 18.3 mttt -77.97 134.91 37.76 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 117.983 -2.948 . . . . 0.0 109.443 165.624 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.8 m 60.33 15.29 5.29 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -175.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -11.15 58.65 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.263 1.825 . . . . 0.0 112.104 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.96 -3.51 28.24 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-O 116.997 -2.001 . . . . 0.0 114.481 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -91.16 133.97 34.93 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 126.479 3.037 . . . . 0.0 111.18 165.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -35.3 -44.92 0.29 Allowed 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 128.368 2.667 . . . . 0.0 112.872 169.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 35.64 -49.87 0.0 OUTLIER 'General case' 0 C--N 1.349 0.546 1 C-N-CA 138.746 6.818 . . . . 0.0 114.288 175.498 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 25.5 t -65.09 -23.87 67.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.469 3.108 . . . . 0.0 115.518 163.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.62 -25.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.997 2.119 . . . . 0.0 113.881 -178.481 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.7 -11.89 56.59 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.223 2.209 . . . . 0.0 110.762 163.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.0 m120 51.1 64.06 1.99 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 127.191 2.196 . . . . 0.0 109.891 -174.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 m -77.13 -60.86 2.19 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 -176.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.807 ' OD2' ' O ' ' A' ' 23' ' ' TRP . 17.4 p-10 -57.03 -52.0 67.0 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 126.111 2.863 . . . . 0.0 111.234 -175.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.465 ' OE2' ' OD2' ' A' ' 36' ' ' ASP . 12.1 mm-40 -75.09 15.58 0.4 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 113.091 -1.868 . . . . 0.0 113.31 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -118.09 143.44 32.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-O 117.06 -1.448 . . . . 0.0 109.634 155.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -71.05 21.66 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.847 1 C-N-CA 125.823 4.349 . . . . 0.0 114.25 -171.379 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.65 -21.42 64.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 110.235 151.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 8.5 tt -128.72 -75.97 0.56 Allowed 'General case' 0 C--N 1.343 0.295 0 C-N-CA 125.743 1.617 . . . . 0.0 108.792 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 35.5 t -132.41 -76.42 0.5 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.6 t60 . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 127.118 2.167 . . . . 0.0 115.0 -160.289 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.483 1.197 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -143.43 168.02 14.06 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.694 2.398 . . . . 0.0 107.276 175.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -72.91 72.14 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.99 2.46 . . . . 0.0 112.187 178.706 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.53 41.7 0.04 OUTLIER Glycine 0 CA--C 1.531 1.035 0 C-N-CA 124.8 1.19 . . . . 0.0 114.652 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -136.2 -172.1 3.05 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.158 1.383 . . . . 0.0 111.578 -168.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -127.13 141.95 51.63 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 111.819 -3.943 . . . . 0.0 112.715 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.404 ' HA ' ' O ' ' A' ' 17' ' ' ARG . . . -121.8 140.36 52.46 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 128.301 3.501 . . . . 0.0 114.861 166.749 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' CYS . . . . . 0.416 ' SG ' ' HB3' ' A' ' 15' ' ' ASN . 27.6 t -86.16 126.9 34.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.266 3.426 . . . . 0.0 110.674 -175.147 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.91 -15.69 5.36 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 173.34 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.416 ' HB3' ' SG ' ' A' ' 13' ' ' CYS . 28.4 t-20 -67.88 -26.22 65.9 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 120.392 1.451 . . . . 0.0 112.069 167.359 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m 127.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.475 1 C-N-CA 131.938 4.095 . . . . 0.0 111.317 164.57 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.404 ' O ' ' HA ' ' A' ' 12' ' ' ALA . 1.4 mmm180 -132.38 133.21 43.67 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -166.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 p -99.37 123.74 43.9 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 117.623 -3.173 . . . . 0.0 111.043 169.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.66 169.37 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-O 115.286 -2.292 . . . . 0.0 111.183 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.4 ' CD ' ' H ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -88.23 147.39 24.86 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.195 2.809 . . . . 0.0 114.279 -173.147 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -53.25 -18.33 2.31 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 129.045 2.938 . . . . 0.0 115.224 -169.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.75 -33.8 3.25 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 121.215 1.825 . . . . 0.0 110.963 163.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -85.87 -8.56 57.98 Favored 'General case' 0 CA--C 1.558 1.26 0 CA-C-O 124.761 2.219 . . . . 0.0 109.825 -167.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -76.23 108.02 8.88 Favored 'General case' 0 C--N 1.351 0.67 0 O-C-N 117.543 -3.223 . . . . 0.0 110.525 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.0 p 41.19 58.78 2.5 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -169.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -80.17 -27.0 39.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.891 143.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.6 4.37 67.9 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.103 -1.387 . . . . 0.0 113.555 -165.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.11 123.52 27.43 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 124.017 1.865 . . . . 0.0 108.139 168.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -52.71 -24.66 9.09 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 118.894 -2.379 . . . . 0.0 114.154 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.795 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.0 OUTLIER 28.54 -48.41 0.0 OUTLIER 'General case' 0 C--N 1.347 0.467 1 C-N-CA 139.61 7.164 . . . . 0.0 114.65 175.149 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.5 t -70.47 -20.92 62.84 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 127.444 2.297 . . . . 0.0 115.915 168.666 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 70.36 -30.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.939 2.096 . . . . 0.0 113.236 -176.365 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.27 -13.83 59.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 128.083 2.553 . . . . 0.0 111.415 170.69 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.9 m120 48.62 88.83 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.702 2.001 . . . . 0.0 110.814 -159.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.6 m -98.34 -68.24 0.81 Allowed 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.795 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.9 p-10 -26.65 -66.6 0.06 Allowed 'General case' 0 C--O 1.248 1.009 0 CA-C-O 127.734 3.635 . . . . 0.0 111.952 153.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -91.46 25.81 2.49 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.634 -172.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -112.93 139.94 23.51 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 115.268 -2.301 . . . . 0.0 108.799 148.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.75 21.76 0.14 Allowed 'Trans proline' 0 CA--C 1.545 1.026 1 C-N-CA 125.789 4.326 . . . . 0.0 114.356 -175.173 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.32 -20.59 60.76 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.107 0.963 . . . . 0.0 110.27 154.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 tt -121.58 -81.11 0.63 Allowed 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.268 1.427 . . . . 0.0 108.782 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.2 t -146.37 -43.0 0.2 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 . . . . . 0 N--CA 1.478 0.944 0 CA-C-N 121.167 1.803 . . . . 0.0 114.626 177.263 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -145.25 162.01 39.23 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 126.73 2.012 . . . . 0.0 108.759 177.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.93 75.18 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.349 2.699 . . . . 0.0 112.25 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.6 21.64 0.03 OUTLIER Glycine 0 CA--C 1.531 1.087 0 C-N-CA 125.006 1.289 . . . . 0.0 115.632 -176.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.53 -171.45 2.38 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.658 1.229 . . . . 0.0 112.318 -165.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -106.6 122.34 46.14 Favored 'General case' 0 CA--C 1.557 1.223 1 CA-C-O 128.768 4.127 . . . . 0.0 116.109 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.15 106.18 18.34 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 118.385 -2.697 . . . . 0.0 112.891 170.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 t -82.59 124.71 30.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.716 1.606 . . . . 0.0 111.173 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.08 -14.75 1.7 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -35.81 81.88 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.186 1.357 . . . . 0.0 111.079 166.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.9 m 132.45 49.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.282 1 C-N-CA 132.284 4.233 . . . . 0.0 111.488 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -125.11 135.8 53.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 116.037 1.866 . . . . 0.0 116.037 -167.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.96 120.12 37.8 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.688 -1.883 . . . . 0.0 110.944 163.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.09 171.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 114.532 -2.651 . . . . 0.0 106.37 171.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -94.7 147.04 23.72 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 128.502 3.626 . . . . 0.0 113.287 -168.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -59.38 -15.92 19.65 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 126.759 2.537 . . . . 0.0 114.333 -168.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -48.57 -25.89 1.95 Allowed 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.336 -1.477 . . . . 0.0 112.84 163.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -98.97 -2.84 36.42 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-O 126.227 2.917 . . . . 0.0 109.876 -171.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -79.38 121.92 25.75 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 116.209 -4.057 . . . . 0.0 109.45 168.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.271 1.9 p 45.07 51.56 8.84 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -172.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.8 -16.16 28.82 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 164.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.403 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 107.54 -11.54 39.14 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-O 115.721 -2.71 . . . . 0.0 116.484 -172.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -117.35 145.12 44.26 Favored 'General case' 0 N--CA 1.477 0.911 1 CA-C-O 129.27 4.367 . . . . 0.0 117.342 -178.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.507 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.78 55.59 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 O-C-N 118.044 -2.91 . . . . 0.0 111.145 170.104 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.538 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -55.72 -31.48 62.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.532 1.933 . . . . 0.0 109.857 173.467 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.5 t -76.12 -15.05 60.16 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 127.928 2.491 . . . . 0.0 115.662 174.173 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.2 -39.2 0.14 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.653 2.381 . . . . 0.0 113.732 -167.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -16.64 62.82 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.26 2.224 . . . . 0.0 111.256 175.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 49.7 78.76 0.09 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.359 2.264 . . . . 0.0 110.297 -166.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.6 m -84.75 -76.49 0.31 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 115.386 -2.245 . . . . 0.0 105.421 167.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.538 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -22.55 -71.02 0.02 OUTLIER 'General case' 0 C--O 1.247 0.956 2 C-N-CA 134.936 5.294 . . . . 0.0 112.698 179.963 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.403 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 41.4 mm-40 -73.44 7.01 2.55 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 110.761 -2.927 . . . . 0.0 114.248 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.68 143.18 34.34 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 116.483 -1.722 . . . . 0.0 108.419 167.784 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.73 20.72 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.907 1 C-N-CA 125.904 4.403 . . . . 0.0 114.149 -170.767 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.25 -21.14 63.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.104 0.562 . . . . 0.0 110.132 152.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 36' ' ' ASP . 6.2 tt -126.64 -77.79 0.58 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 125.61 1.564 . . . . 0.0 109.414 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 49.0 t -136.25 -62.94 0.65 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 . . . . . 0 N--CA 1.481 1.109 0 C-N-CA 126.621 1.968 . . . . 0.0 115.584 -166.536 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -141.74 -166.2 0.12 Allowed Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.07 3.348 . . . . 0.0 105.889 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.94 79.99 3.09 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 CA-C-N 123.99 2.461 . . . . 0.0 110.404 170.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 126.64 45.95 0.22 Allowed Glycine 0 C--N 1.348 1.206 0 N-CA-C 119.224 2.45 . . . . 0.0 119.224 169.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -125.83 -156.96 0.76 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.194 1.997 . . . . 0.0 111.228 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -114.93 126.84 55.25 Favored 'General case' 0 CA--C 1.558 1.288 1 CA-C-O 128.975 4.226 . . . . 0.0 116.785 174.089 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -103.93 111.68 24.33 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 117.995 -2.941 . . . . 0.0 111.92 173.369 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.2 t -84.39 125.56 32.43 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 128.626 2.77 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.02 -13.47 2.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 174.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -66.4 -30.51 70.9 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.764 1.62 . . . . 0.0 111.768 165.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m 127.56 51.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.322 1 C-N-CA 132.258 4.223 . . . . 0.0 110.558 169.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -130.12 138.03 50.47 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 123.71 1.719 . . . . 0.0 115.389 -165.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.444 0.5 OUTLIER -111.3 119.83 40.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 118.577 -2.577 . . . . 0.0 114.12 168.439 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.75 162.36 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 128.527 2.731 . . . . 0.0 105.418 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -86.35 147.13 26.18 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 128.579 3.674 . . . . 0.0 112.906 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -60.41 -13.81 15.49 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 128.102 2.561 . . . . 0.0 113.987 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -35.83 3.01 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 119.75 -1.844 . . . . 0.0 111.336 160.223 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -90.26 -3.72 57.62 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-O 124.864 2.269 . . . . 0.0 108.883 -166.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -79.49 124.47 28.51 Favored 'General case' 0 C--N 1.358 0.948 0 O-C-N 117.765 -3.084 . . . . 0.0 109.509 165.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.5 p 37.88 65.62 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.942 2.097 . . . . 0.0 116.234 -163.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.739 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 19.5 p30 -99.2 -4.21 32.59 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 160.177 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 75.84 12.71 83.71 Favored Glycine 0 CA--C 1.538 1.531 0 CA-C-O 116.55 -2.25 . . . . 0.0 115.089 -162.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -105.76 122.79 46.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.769 2.785 . . . . 0.0 112.908 177.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -24.59 -50.02 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 127.52 2.328 . . . . 0.0 113.633 162.46 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 30.75 -49.55 0.0 OUTLIER 'General case' 0 C--N 1.352 0.682 1 C-N-CA 139.109 6.964 . . . . 0.0 114.621 -179.56 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.0 t -66.21 -23.19 66.39 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 129.42 3.088 . . . . 0.0 115.384 167.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.46 -29.55 0.18 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.638 1.975 . . . . 0.0 113.563 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -19.4 61.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.177 1.791 . . . . 0.0 110.494 164.456 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.7 t30 45.61 87.55 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.808 1.643 . . . . 0.0 110.812 -155.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.6 m -86.26 -73.86 0.44 Allowed 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 114.44 -2.695 . . . . 0.0 104.157 163.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.449 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -59.83 -44.51 94.01 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 128.029 3.33 . . . . 0.0 111.137 -154.559 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.739 ' OE2' ' OD1' ' A' ' 26' ' ' ASP . 34.1 mm-40 -74.94 6.15 4.39 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 119.27 -2.143 . . . . 0.0 111.907 -173.602 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -104.12 135.62 19.31 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 116.656 -1.64 . . . . 0.0 108.044 161.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.79 20.28 0.15 Allowed 'Trans proline' 0 C--N 1.356 0.957 1 C-N-CA 126.459 4.772 . . . . 0.0 114.303 -171.932 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 -23.16 65.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.298 0.639 . . . . 0.0 110.308 152.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 8.5 tt -125.89 -79.98 0.61 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.99 1.716 . . . . 0.0 108.936 177.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 21.3 t -157.26 118.3 3.62 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 . . . . . 0 N--CA 1.466 0.361 0 O-C-N 120.539 -1.351 . . . . 0.0 109.039 172.605 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.496 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -149.76 158.74 37.09 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.931 2.092 . . . . 0.0 108.0 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -64.14 92.8 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.443 2.762 . . . . 0.0 112.225 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.61 -17.97 2.62 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 126.033 1.778 . . . . 0.0 114.482 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -78.68 -167.94 1.25 Allowed 'General case' 0 C--O 1.239 0.525 0 C-N-CA 125.435 1.494 . . . . 0.0 111.753 -171.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -113.43 120.94 42.78 Favored 'General case' 0 CA--C 1.561 1.368 1 CA-C-O 129.143 4.306 . . . . 0.0 116.323 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.93 109.18 20.62 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 117.955 -2.965 . . . . 0.0 112.642 167.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.01 29.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.898 1.679 . . . . 0.0 110.888 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -12.05 3.55 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -65.29 -31.56 72.76 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.739 1.609 . . . . 0.0 111.845 164.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.5 m 128.55 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 C-N-CA 132.131 4.172 . . . . 0.0 110.61 170.213 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -129.19 134.8 48.17 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 124.079 1.895 . . . . 0.0 115.311 -168.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.37 119.8 36.57 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 119.044 -2.285 . . . . 0.0 110.731 161.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.71 160.82 39.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 115.019 -2.42 . . . . 0.0 105.979 170.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -83.1 150.47 26.27 Favored 'General case' 0 N--CA 1.448 -0.532 1 O-C-N 129.379 4.174 . . . . 0.0 112.515 -173.605 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.404 ' HG3' ' HE2' ' A' ' 24' ' ' LYS . 6.8 tt0 -49.73 -24.56 2.38 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 127.42 2.95 . . . . 0.0 115.119 -171.438 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -38.55 7.23 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 121.441 1.928 . . . . 0.0 110.183 169.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -83.6 -7.99 59.4 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-O 124.781 2.229 . . . . 0.0 108.089 -163.306 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.404 ' HE2' ' HG3' ' A' ' 21' ' ' GLU . 43.0 mtmt -77.02 131.44 38.43 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 118.006 -2.934 . . . . 0.0 110.381 166.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 m 63.4 17.59 10.41 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.031 2.132 . . . . 0.0 114.457 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.43 -11.19 59.92 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 128.193 2.597 . . . . 0.0 113.382 -165.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.37 6.59 85.88 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 116.45 -2.306 . . . . 0.0 114.908 -173.261 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.88 146.6 43.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 128.438 3.97 . . . . 0.0 117.061 175.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.506 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -64.65 48.42 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.43 2.692 . . . . 0.0 111.363 165.262 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -45.31 -34.71 3.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.958 2.503 . . . . 0.0 110.247 164.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 t -78.99 -14.89 58.93 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 128.4 2.68 . . . . 0.0 115.097 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.19 -30.16 0.08 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.386 2.275 . . . . 0.0 114.945 -172.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -20.87 46.1 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 127.542 2.337 . . . . 0.0 110.601 171.206 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 52.83 82.31 0.07 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.123 1.769 . . . . 0.0 109.909 -163.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -88.56 -72.49 0.54 Allowed 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 113.814 -2.994 . . . . 0.0 103.885 168.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.493 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -59.57 -45.04 93.01 Favored 'General case' 0 C--O 1.241 0.618 0 O-C-N 127.921 3.263 . . . . 0.0 111.654 -156.927 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -70.97 5.41 2.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.29 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.78 140.72 25.05 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 117.016 -1.469 . . . . 0.0 108.941 165.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -71.13 21.45 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.859 1 C-N-CA 126.034 4.489 . . . . 0.0 114.162 -170.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -22.25 65.45 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.956 -0.465 . . . . 0.0 110.231 151.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.518 HD23 ' HB2' ' A' ' 42' ' ' CYS . 8.9 tt -129.15 -76.19 0.55 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 125.983 1.713 . . . . 0.0 109.201 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.518 ' HB2' HD23 ' A' ' 41' ' ' LEU . 7.3 t -134.57 -65.76 0.63 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 116.056 1.872 . . . . 0.0 116.056 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 . . . . . 0 CA--C 1.554 1.105 0 C-N-CA 124.606 1.162 . . . . 0.0 113.121 -160.797 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.223 0 CA-C-O 119.725 -0.486 . . . . 0.0 114.043 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.8 t -134.25 85.58 38.46 Favored Pre-proline 0 CA--C 1.539 0.545 0 C-N-CA 125.262 1.425 . . . . 0.0 109.761 175.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -82.85 110.1 1.81 Allowed 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 124.087 3.191 . . . . 0.0 112.301 -176.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.68 -62.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.263 1.975 . . . . 0.0 111.003 174.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.424 ' O ' ' HB2' ' A' ' 18' ' ' CYS . 72.3 mt-30 81.48 -11.48 1.08 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.755 2.822 . . . . 0.0 117.288 168.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.8 t -162.94 -50.05 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 126.059 1.744 . . . . 0.0 109.764 165.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.469 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 13.6 mt-30 -129.8 -174.59 0.39 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.171 3.388 . . . . 0.0 105.068 168.176 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -77.37 66.7 7.87 Favored 'Trans proline' 0 CA--C 1.549 1.269 0 CA-C-N 123.717 2.363 . . . . 0.0 112.867 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.01 59.89 0.04 OUTLIER Glycine 0 C--N 1.345 1.064 0 C-N-CA 124.345 0.974 . . . . 0.0 115.065 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.469 ' HG3' ' H ' ' A' ' 7' ' ' GLN . 6.2 mm-40 -133.29 -158.9 0.92 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.069 1.348 . . . . 0.0 111.495 -166.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -121.86 127.81 50.92 Favored 'General case' 0 CA--C 1.569 1.703 1 CA-C-O 129.295 4.379 . . . . 0.0 117.879 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.33 111.63 23.96 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 117.154 -3.466 . . . . 0.0 112.275 171.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 38.1 t -87.35 127.98 35.19 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.971 1.708 . . . . 0.0 111.017 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.64 -11.45 4.95 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -63.38 -28.37 69.94 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.858 1.663 . . . . 0.0 112.032 163.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.7 m 126.55 45.42 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.425 1 C-N-CA 132.239 4.215 . . . . 0.0 110.885 166.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.8 mmm-85 -126.53 135.94 51.95 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 123.706 1.717 . . . . 0.0 114.641 -158.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 0.1 OUTLIER -97.99 116.46 30.25 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 119.791 -1.818 . . . . 0.0 110.519 166.08 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.42 HG21 ' CZ3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -139.07 176.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 115.381 -2.247 . . . . 0.0 105.733 174.486 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -103.15 149.4 24.68 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 128.501 3.626 . . . . 0.0 112.429 -162.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -53.16 -19.36 2.9 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 127.714 3.134 . . . . 0.0 113.942 -167.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.38 -42.0 9.69 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.668 1.576 . . . . 0.0 109.632 169.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.42 ' CZ3' HG21 ' A' ' 19' ' ' ILE . 9.3 m0 -73.49 -17.58 61.21 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 123.928 1.823 . . . . 0.0 108.386 -163.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' HB2' ' A' ' 36' ' ' ASP . 46.1 mtmt -80.47 110.1 15.61 Favored 'General case' 0 C--N 1.357 0.917 0 O-C-N 119.879 -1.763 . . . . 0.0 108.881 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 m 71.85 24.35 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.63 1.172 . . . . 0.0 112.376 -170.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.57 -30.36 52.55 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.667 -1.271 . . . . 0.0 110.752 173.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.79 -1.41 71.3 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 117.609 -1.662 . . . . 0.0 114.137 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 30' ' ' ASP . 38.7 t70 -96.09 150.58 20.34 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 125.944 2.783 . . . . 0.0 111.891 162.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -48.92 -42.42 37.11 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 111.842 -2.436 . . . . 0.0 113.018 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 28' ' ' ASP . 17.1 t0 59.61 -60.89 0.05 Allowed 'General case' 0 N--CA 1.477 0.904 1 C-N-CA 133.174 4.59 . . . . 0.0 110.914 151.398 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.6 t -52.11 -20.33 2.44 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 128.146 2.579 . . . . 0.0 116.942 150.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -34.03 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.646 1.978 . . . . 0.0 113.035 -172.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -12.1 53.53 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.885 1.674 . . . . 0.0 110.816 172.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.79 63.86 1.92 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.862 1.665 . . . . 0.0 109.951 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 m -85.68 -56.1 3.66 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.444 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 16.7 p-10 -55.8 -47.26 77.43 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 126.411 3.005 . . . . 0.0 110.655 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 43' ' ' HIS 0.261 8.9 mm-40 -83.6 17.89 2.08 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 119.13 -2.231 . . . . 0.0 113.468 -178.37 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.44 132.85 20.56 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-O 116.76 -1.59 . . . . 0.0 108.06 150.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.89 20.99 0.18 Allowed 'Trans proline' 0 CA--C 1.542 0.878 1 C-N-CA 126.177 4.585 . . . . 0.0 114.334 -169.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.28 -22.22 64.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.314 0.646 . . . . 0.0 110.378 152.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 9.6 tt -120.61 -74.39 0.61 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.471 1.508 . . . . 0.0 108.935 177.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.0 t -139.92 -70.12 0.4 Allowed 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 116.311 1.967 . . . . 0.0 116.311 176.262 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER 63.87 86.19 0.12 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.532 1.933 . . . . 0.0 114.197 -164.463 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -70.43 142.89 51.96 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.257 151.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 . . . . . 0 CA--C 1.534 0.363 0 C-N-CA 124.733 1.213 . . . . 0.0 109.671 -179.32 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.078 0 CA-C-O 118.875 -0.958 . . . . 0.0 114.533 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.9 m 105.66 -36.27 0.0 OUTLIER Pre-proline 0 N--CA 1.479 1.004 0 C-N-CA 130.69 3.596 . . . . 0.0 117.299 169.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.97 159.96 43.89 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 CA-C-N 123.892 2.426 . . . . 0.0 112.534 -175.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -76.88 54.69 4.63 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 125.09 3.86 . . . . 0.0 111.793 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -66.41 -19.64 65.85 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.526 1.931 . . . . 0.0 114.756 -161.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.93 -55.5 1.98 Allowed 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 126.051 1.74 . . . . 0.0 109.294 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -145.01 167.7 13.96 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 128.162 2.585 . . . . 0.0 107.33 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.44 70.66 4.79 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.154 2.57 . . . . 0.0 112.913 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.18 46.02 0.03 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.898 1.237 . . . . 0.0 113.756 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -133.3 -172.69 3.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.606 1.162 . . . . 0.0 112.155 -166.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -109.86 124.55 51.53 Favored 'General case' 0 CA--C 1.56 1.354 1 CA-C-O 128.681 4.086 . . . . 0.0 116.449 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.4 108.11 20.73 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 118.421 -2.674 . . . . 0.0 112.627 170.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.0 t -85.55 125.01 32.76 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.51 1.524 . . . . 0.0 111.233 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.71 -16.63 4.51 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 173.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -68.5 -24.45 64.67 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 120.635 1.561 . . . . 0.0 112.031 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.7 m 126.28 50.75 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 131.84 4.056 . . . . 0.0 111.221 165.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -128.38 135.72 49.93 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 124.231 1.967 . . . . 0.0 115.53 -166.263 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.18 121.12 38.72 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 119.353 -2.092 . . . . 0.0 110.413 160.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.34 167.69 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 114.087 -2.863 . . . . 0.0 106.729 173.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -87.24 144.73 26.68 Favored 'General case' 0 N--CA 1.45 -0.469 1 O-C-N 129.395 4.185 . . . . 0.0 113.301 -170.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.54 -16.4 9.89 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 128.122 2.569 . . . . 0.0 114.249 -170.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.0 ttp85 -50.19 -27.13 5.4 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.587 -1.321 . . . . 0.0 112.614 165.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -93.9 -4.34 50.09 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-O 126.33 2.967 . . . . 0.0 109.579 -171.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -78.55 111.29 14.45 Favored 'General case' 0 C--N 1.355 0.814 0 O-C-N 116.471 -3.893 . . . . 0.0 109.029 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.283 8.1 p 41.75 53.27 4.01 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -166.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -76.8 -24.85 52.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 118.756 -0.64 . . . . 0.0 112.269 145.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.6 -8.49 40.31 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-O 117.063 -1.965 . . . . 0.0 115.339 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -98.1 144.77 27.23 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 125.987 2.803 . . . . 0.0 113.887 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.84 58.42 0.33 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 118.616 -2.552 . . . . 0.0 110.878 170.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.22 -30.66 62.63 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 127.206 2.202 . . . . 0.0 110.12 175.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 51.6 t -80.38 -15.38 56.96 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.69 1.996 . . . . 0.0 115.779 175.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.37 -36.55 0.13 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.321 2.248 . . . . 0.0 114.849 -170.006 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -19.22 61.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.19 2.596 . . . . 0.0 111.014 169.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.7 74.56 0.44 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.365 2.266 . . . . 0.0 111.003 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.1 m -102.24 -58.41 1.88 Allowed 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.728 0.811 . . . . 0.0 110.237 -177.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -28.6 -67.65 0.07 Allowed 'General case' 0 C--O 1.247 0.923 0 CA-C-O 128.012 3.767 . . . . 0.0 111.631 158.026 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 20.4 mm-40 -86.77 21.0 2.35 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 112.151 -2.295 . . . . 0.0 112.863 -173.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.6 135.52 21.1 Favored Pre-proline 0 CA--C 1.542 0.658 0 CA-C-O 115.085 -2.388 . . . . 0.0 107.994 154.469 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -68.31 21.66 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.074 1 C-N-CA 125.735 4.29 . . . . 0.0 114.614 -173.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.05 -20.87 60.89 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.052 0.941 . . . . 0.0 110.293 153.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 tt -120.15 -80.5 0.62 Allowed 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.716 1.607 . . . . 0.0 108.576 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 38.8 t -141.74 -54.36 0.45 Allowed 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 32.2 t-80 57.15 99.25 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.536 1.534 . . . . 0.0 114.777 -171.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -62.22 109.5 1.34 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.833 -0.542 . . . . 0.0 111.312 175.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 83.7 t60 . . . . . 0 N--CA 1.466 0.355 0 C-N-CA 125.374 1.47 . . . . 0.0 112.11 -173.615 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.064 0 CA-C-O 119.182 -0.788 . . . . 0.0 113.651 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.7 m 110.55 -58.47 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.867 0 C-N-CA 131.609 3.964 . . . . 0.0 114.399 173.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -72.29 159.38 49.68 Favored 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 122.226 1.951 . . . . 0.0 114.706 -168.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -78.42 60.31 7.47 Favored 'Trans proline' 0 CA--C 1.544 1.022 1 C-N-CA 125.393 4.062 . . . . 0.0 113.972 -169.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -19.18 63.19 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -176.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.89 -58.54 1.96 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.227 1.011 . . . . 0.0 110.477 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -150.13 167.83 12.22 Favored Pre-proline 0 CA--C 1.552 1.019 0 C-N-CA 128.883 2.873 . . . . 0.0 106.908 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.66 76.89 1.45 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 123.323 2.682 . . . . 0.0 113.461 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.7 43.8 0.07 OUTLIER Glycine 0 N--CA 1.473 1.115 0 C-N-CA 124.441 1.02 . . . . 0.0 114.577 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -128.25 -174.51 3.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.271 1.035 . . . . 0.0 113.181 -162.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -109.14 121.29 44.83 Favored 'General case' 0 CA--C 1.563 1.465 1 CA-C-O 128.964 4.221 . . . . 0.0 116.214 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.8 107.79 20.32 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 118.223 -2.798 . . . . 0.0 112.75 172.383 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.5 t -82.59 124.09 29.82 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.302 1.441 . . . . 0.0 111.508 175.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.83 -12.53 3.18 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 173.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -67.38 -30.62 70.45 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.925 1.693 . . . . 0.0 111.684 165.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.9 m 128.03 53.78 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.273 1 C-N-CA 132.186 4.194 . . . . 0.0 110.741 170.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -129.28 132.16 47.12 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-O 124.341 2.02 . . . . 0.0 114.835 -167.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -101.49 117.57 35.19 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 118.739 -2.476 . . . . 0.0 110.212 167.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.18 169.41 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 114.961 -2.447 . . . . 0.0 105.987 172.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.98 154.45 18.15 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.547 3.029 . . . . 0.0 113.704 -171.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.05 -15.38 31.74 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 127.162 2.789 . . . . 0.0 114.196 -168.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -43.27 -33.52 0.99 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.545 -1.347 . . . . 0.0 112.82 160.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -95.41 -0.29 52.64 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 125.704 2.669 . . . . 0.0 111.825 -171.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HG2' HD21 ' A' ' 41' ' ' LEU . 18.6 mttt -79.44 101.06 7.96 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 117.398 -3.314 . . . . 0.0 108.807 173.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.337 21.2 p 49.76 57.84 6.09 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -165.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.1 p30 -75.61 -23.03 56.38 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.679 137.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.87 9.71 65.71 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-O 117.668 -1.629 . . . . 0.0 113.932 -168.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -93.98 135.37 35.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.321 2.06 . . . . 0.0 110.949 171.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -29.29 -13.81 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 1 C-N-CA 132.344 4.258 . . . . 0.0 119.523 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.13 -23.86 40.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 123.591 1.663 . . . . 0.0 109.566 -85.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.5 t -56.11 -21.62 23.37 Favored 'General case' 0 N--CA 1.429 -1.494 1 C-N-CA 132.272 4.229 . . . . 0.0 116.176 164.014 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 69.66 -29.77 0.18 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.663 2.385 . . . . 0.0 113.494 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -16.66 62.3 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.637 1.975 . . . . 0.0 110.545 157.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.19 64.24 1.93 Allowed 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 126.17 1.788 . . . . 0.0 110.233 -176.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.5 m -73.56 -64.85 0.91 Allowed 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 176.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.765 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -39.29 -63.8 0.52 Allowed 'General case' 0 N--CA 1.441 -0.884 2 C-N-CA 132.752 4.421 . . . . 0.0 110.524 -177.998 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -84.81 21.34 1.58 Allowed 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 111.036 -2.802 . . . . 0.0 112.544 -172.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.68 139.52 26.42 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 116.136 -1.888 . . . . 0.0 108.428 153.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -69.12 20.72 0.15 Allowed 'Trans proline' 0 CA--C 1.542 0.886 1 C-N-CA 125.875 4.383 . . . . 0.0 114.596 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.65 -21.29 63.55 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.213 0.605 . . . . 0.0 110.388 152.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.765 HD22 ' HA ' ' A' ' 36' ' ' ASP . 8.1 tt -123.66 -76.07 0.59 Allowed 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.917 1.687 . . . . 0.0 108.786 178.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.4 t -139.74 -67.12 0.44 Allowed 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.6 t60 56.95 -59.41 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.626 1.97 . . . . 0.0 115.043 -161.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 59.45 -65.59 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 128.116 2.566 . . . . 0.0 113.043 -168.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 . . . . . 0 CA--C 1.54 0.579 0 C-N-CA 125.67 1.588 . . . . 0.0 109.728 171.11 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.75 ' H1 ' ' H ' ' A' ' 12' ' ' ALA . . . . . . . . 0 CA--C 1.531 1.085 0 CA-C-O 120.117 -0.269 . . . . 0.0 113.354 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.1 m -167.27 -56.17 0.01 OUTLIER Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 126.785 2.034 . . . . 0.0 111.267 172.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.72 160.01 50.82 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 121.583 1.522 . . . . 0.0 111.326 169.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -77.77 58.65 6.53 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 124.451 3.434 . . . . 0.0 111.546 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.5 tp60 -69.28 -23.91 63.89 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -155.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.44 -57.18 2.01 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.412 1.885 . . . . 0.0 108.079 173.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -139.25 168.96 13.53 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 128.471 2.708 . . . . 0.0 107.454 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.2 73.31 4.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.816 2.344 . . . . 0.0 113.082 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.41 46.58 0.02 OUTLIER Glycine 0 CA--C 1.528 0.904 0 C-N-CA 125.305 1.431 . . . . 0.0 112.988 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -134.99 -176.83 4.38 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.663 1.185 . . . . 0.0 112.47 -165.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.501 ' HA ' ' H1 ' ' A' ' 1' ' ' GLY . 8.3 t80 -105.75 121.96 45.1 Favored 'General case' 0 CA--C 1.56 1.349 1 CA-C-O 128.689 4.09 . . . . 0.0 116.268 -178.202 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.75 ' H ' ' H1 ' ' A' ' 1' ' ' GLY . . . -97.38 107.37 19.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 118.353 -2.717 . . . . 0.0 112.58 171.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.5 t -86.97 126.59 34.82 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.832 1.653 . . . . 0.0 111.725 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.48 -13.18 3.3 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 115.866 1.802 . . . . 0.0 115.866 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -66.77 -28.59 68.52 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.759 1.618 . . . . 0.0 111.744 165.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.4 m 128.36 48.49 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.382 1 C-N-CA 132.133 4.173 . . . . 0.0 110.912 166.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -126.85 136.04 51.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 124.265 1.983 . . . . 0.0 115.069 -162.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 120.01 37.34 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 119.406 -2.059 . . . . 0.0 110.326 163.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.6 170.82 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 114.501 -2.666 . . . . 0.0 106.341 172.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -94.07 147.44 23.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 128.439 3.587 . . . . 0.0 113.407 -168.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -53.59 -20.57 5.3 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 127.603 3.064 . . . . 0.0 113.809 -169.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -50.46 -28.52 8.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.948 0.899 . . . . 0.0 112.265 167.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -92.82 -5.41 51.12 Favored 'General case' 0 CA--C 1.565 1.52 0 CA-C-O 126.751 3.167 . . . . 0.0 109.237 -170.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB3' HD21 ' A' ' 41' ' ' LEU . 34.7 mtpt -80.16 102.5 9.44 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 116.368 -3.958 . . . . 0.0 108.493 171.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.294 21.1 p 45.99 60.04 3.4 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -165.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -71.07 -26.91 63.27 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.444 -1.253 . . . . 0.0 112.482 133.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.0 19.73 20.75 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-O 116.238 -2.423 . . . . 0.0 115.248 -172.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -128.74 152.46 48.4 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 126.726 3.155 . . . . 0.0 115.139 169.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.497 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.23 52.83 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 O-C-N 118.567 -2.583 . . . . 0.0 111.765 171.168 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.63 -29.54 59.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.368 1.867 . . . . 0.0 110.033 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.3 t -78.72 -13.55 59.75 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 127.572 2.349 . . . . 0.0 116.129 175.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.6 -34.51 0.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.991 2.116 . . . . 0.0 114.837 -172.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.63 -22.14 59.08 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 128.275 2.63 . . . . 0.0 111.074 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 56.97 86.41 0.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.358 2.263 . . . . 0.0 111.31 -168.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -105.05 -61.77 1.43 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.174 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.696 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -29.97 -67.46 0.08 Allowed 'General case' 0 C--O 1.246 0.873 1 CA-C-O 128.699 4.095 . . . . 0.0 111.763 166.634 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -86.18 17.87 3.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.069 -2.332 . . . . 0.0 112.906 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.94 139.35 20.57 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.032 156.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -68.09 20.69 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.864 1 C-N-CA 126.323 4.682 . . . . 0.0 114.27 -173.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.36 -20.7 59.99 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.127 0.971 . . . . 0.0 110.421 155.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.696 HD22 ' HA ' ' A' ' 36' ' ' ASP . 9.3 tt -125.76 -76.62 0.58 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.94 1.296 . . . . 0.0 109.218 -176.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 47.6 t -138.53 -71.23 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 171.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 24.1 t60 58.19 96.07 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.83 1.652 . . . . 0.0 113.721 -162.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -153.58 68.57 0.79 Allowed 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.131 -0.981 . . . . 0.0 111.793 171.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 17.5 t60 . . . . . 0 CA--C 1.536 0.42 0 C-N-CA 123.708 0.803 . . . . 0.0 111.725 177.832 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.256 0 CA-C-O 119.532 -0.593 . . . . 0.0 114.215 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.4 p -145.31 157.68 52.54 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 125.529 1.532 . . . . 0.0 110.973 177.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -76.47 121.61 6.1 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 122.695 2.264 . . . . 0.0 111.05 178.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -72.31 -42.8 1.25 Allowed 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.972 2.448 . . . . 0.0 112.509 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 85.41 -27.38 0.09 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 129.694 3.198 . . . . 0.0 116.524 166.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.2 t -152.93 -52.52 0.11 Allowed 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 120.564 1.529 . . . . 0.0 110.606 172.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -132.09 -179.65 1.12 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.394 3.478 . . . . 0.0 105.033 171.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -74.88 69.42 5.45 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.23 2.189 . . . . 0.0 113.165 -174.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.08 54.29 0.05 OUTLIER Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.94 1.257 . . . . 0.0 114.814 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -133.28 -165.94 1.69 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.766 1.283 . . . . 0.0 112.723 -166.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -117.41 125.08 50.36 Favored 'General case' 0 CA--C 1.564 1.502 1 CA-C-O 128.848 4.166 . . . . 0.0 118.205 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.3 107.09 18.35 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 117.725 -3.109 . . . . 0.0 112.678 171.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.35 127.02 31.96 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.851 1.26 . . . . 0.0 109.927 170.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.54 -21.91 19.11 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 170.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -7.3 38.02 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 119.849 1.204 . . . . 0.0 112.416 168.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.5 m 106.91 53.45 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.893 1 C-N-CA 132.059 4.144 . . . . 0.0 110.392 160.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.6 mmm-85 -130.76 131.26 44.62 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 123.063 1.411 . . . . 0.0 114.526 -166.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.332 0.1 OUTLIER -101.56 115.08 29.71 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 119.65 -1.906 . . . . 0.0 111.706 168.471 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -136.41 170.68 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 115.553 -2.165 . . . . 0.0 105.635 174.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -97.76 155.38 17.05 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 128.167 3.417 . . . . 0.0 112.958 -167.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -58.63 -16.9 18.12 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 127.271 2.857 . . . . 0.0 114.626 -163.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.54 -41.11 4.31 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.089 1.768 . . . . 0.0 110.787 163.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -84.58 -7.95 59.07 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 125.97 2.795 . . . . 0.0 108.61 -164.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.562 ' HG2' HD21 ' A' ' 41' ' ' LEU . 13.8 mttt -77.98 123.39 26.75 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 117.107 -3.496 . . . . 0.0 107.401 164.026 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 m 78.97 11.63 1.46 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.864 1.665 . . . . 0.0 114.862 168.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -83.79 -3.61 57.98 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.07 -1.644 . . . . 0.0 112.239 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 77.38 10.33 86.31 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-O 117.762 -1.577 . . . . 0.0 114.35 -175.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -103.86 125.69 50.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 124.188 1.947 . . . . 0.0 112.347 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.871 ' H ' HD21 ' A' ' 29' ' ' ASN . 0.0 OUTLIER -67.77 56.93 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 118.828 -2.42 . . . . 0.0 110.801 163.661 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -31.75 65.53 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.972 2.509 . . . . 0.0 109.459 175.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.0 t -75.7 -14.49 60.34 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.734 2.414 . . . . 0.0 115.619 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.16 -35.75 0.17 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.325 2.25 . . . . 0.0 114.485 -172.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.66 61.57 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 128.206 2.602 . . . . 0.0 110.774 171.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 54.58 80.75 0.12 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.824 2.05 . . . . 0.0 110.413 -164.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 m -86.12 -76.45 0.34 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 115.335 -2.269 . . . . 0.0 105.334 170.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.692 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -22.49 -70.68 0.02 OUTLIER 'General case' 0 N--CA 1.441 -0.889 2 C-N-CA 134.074 4.95 . . . . 0.0 111.411 175.331 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -80.74 16.27 1.47 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 111.871 -2.422 . . . . 0.0 113.228 -167.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.52 140.5 30.48 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 116.257 -1.83 . . . . 0.0 108.148 164.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.67 19.99 0.26 Allowed 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.66 4.24 . . . . 0.0 114.224 -168.355 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.29 -20.47 62.2 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.015 0.526 . . . . 0.0 110.189 153.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.692 HD22 ' HA ' ' A' ' 36' ' ' ASP . 2.3 tt -125.57 -77.09 0.58 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.417 1.487 . . . . 0.0 109.538 174.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 11.9 t -133.28 -61.52 0.82 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 75.3 t60 57.48 87.7 0.06 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.144 1.377 . . . . 0.0 114.199 -162.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 65.97 140.77 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.458 1.903 . . . . 0.0 115.001 170.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 17.5 p80 . . . . . 0 CA--C 1.542 0.663 0 C-N-CA 125.687 1.595 . . . . 0.0 112.122 -178.014 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.222 0 CA-C-O 119.626 -0.541 . . . . 0.0 114.118 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 t -139.58 92.69 10.12 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 125.473 1.509 . . . . 0.0 110.182 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -74.9 135.53 19.4 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.467 2.111 . . . . 0.0 111.0 -177.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.4 -44.49 2.29 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.394 2.062 . . . . 0.0 111.996 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 76.1 -47.98 0.57 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 127.034 2.133 . . . . 0.0 112.394 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -129.91 -55.65 1.13 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.908 1.683 . . . . 0.0 110.368 176.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -144.74 169.81 9.33 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 129.1 2.96 . . . . 0.0 106.463 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.86 70.0 4.45 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 122.355 2.037 . . . . 0.0 113.336 -174.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.16 40.36 0.03 OUTLIER Glycine 0 CA--C 1.533 1.185 0 C-N-CA 125.318 1.437 . . . . 0.0 115.282 178.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -125.58 -163.42 1.2 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 119.031 1.416 . . . . 0.0 113.145 -164.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -124.17 125.33 44.26 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 128.479 3.99 . . . . 0.0 117.803 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.15 111.35 22.87 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 117.288 -3.383 . . . . 0.0 113.615 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.6 t -82.07 125.03 30.36 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.121 1.769 . . . . 0.0 111.035 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.4 -10.9 3.58 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 174.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -66.22 -30.08 70.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 120.883 1.674 . . . . 0.0 111.635 164.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.8 m 128.11 51.79 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.343 1 C-N-CA 132.076 4.15 . . . . 0.0 110.803 168.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -128.13 134.41 49.11 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 123.839 1.781 . . . . 0.0 114.772 -166.488 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.272 0.5 OUTLIER -97.89 117.9 33.25 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 119.067 -2.271 . . . . 0.0 110.697 162.995 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.42 169.74 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-O 114.749 -2.548 . . . . 0.0 106.141 173.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -93.78 146.92 23.52 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 129.04 3.963 . . . . 0.0 112.964 -170.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.32 -16.13 31.9 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 126.926 2.641 . . . . 0.0 113.708 -166.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.3 ttt180 -46.16 -27.88 1.09 Allowed 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.143 -1.598 . . . . 0.0 113.026 162.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -97.47 -9.38 27.32 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 126.244 2.926 . . . . 0.0 110.117 -172.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -75.44 136.24 40.7 Favored 'General case' 0 C--N 1.353 0.735 1 O-C-N 115.92 -4.237 . . . . 0.0 107.916 166.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.1 m 63.75 13.58 7.55 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.74 -35.19 52.14 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.642 -173.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.468 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 106.53 -3.26 36.85 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 117.094 -1.948 . . . . 0.0 114.615 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -105.69 145.28 31.28 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 126.073 2.844 . . . . 0.0 112.487 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.64 60.85 0.35 Allowed 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.43 -2.044 . . . . 0.0 109.23 168.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -59.0 -25.68 63.86 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.352 1.861 . . . . 0.0 110.144 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.8 t -78.08 -16.7 57.79 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 129.107 2.963 . . . . 0.0 116.258 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.38 -33.9 0.15 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.796 2.038 . . . . 0.0 115.06 -172.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -20.38 60.43 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.01 2.124 . . . . 0.0 111.057 168.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 51.6 t30 59.23 83.41 0.13 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.837 2.455 . . . . 0.0 112.213 -168.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -103.93 -61.78 1.39 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -31.1 -67.99 0.09 Allowed 'General case' 0 C--O 1.242 0.702 0 CA-C-O 127.12 3.343 . . . . 0.0 110.529 163.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.468 ' CD ' ' H ' ' A' ' 27' ' ' GLY 0.326 3.7 mm-40 -92.02 25.84 2.69 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 119.245 -2.159 . . . . 0.0 112.122 -170.887 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -108.86 126.84 28.51 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 114.961 -2.447 . . . . 0.0 107.189 151.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.78 19.87 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 125.984 4.456 . . . . 0.0 114.801 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.75 -21.61 61.72 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.934 0.893 . . . . 0.0 110.457 154.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -114.95 -79.5 0.59 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.82 1.648 . . . . 0.0 108.362 173.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 3.7 t -137.28 -60.38 0.67 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 24.8 t-80 57.59 86.7 0.07 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.491 1.517 . . . . 0.0 113.149 -165.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 60.91 -177.96 0.11 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.13 1.372 . . . . 0.0 112.587 178.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 . . . . . 0 CA--C 1.543 0.686 0 O-C-N 120.234 -1.541 . . . . 0.0 109.932 174.488 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.022 0 CA-C-O 118.878 -0.957 . . . . 0.0 114.243 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 t 128.94 -60.82 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 131.198 3.799 . . . . 0.0 112.878 178.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -67.88 150.1 78.24 Favored 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 121.721 1.614 . . . . 0.0 113.903 -168.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -78.74 55.26 5.45 Favored 'Trans proline' 0 CA--C 1.539 0.745 1 C-N-CA 125.539 4.159 . . . . 0.0 112.666 -174.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -65.26 -9.16 21.64 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.012 1.725 . . . . 0.0 115.607 -172.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.22 -59.53 1.83 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.294 1.438 . . . . 0.0 109.696 176.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -145.99 167.99 12.82 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.955 2.502 . . . . 0.0 107.427 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 75.34 1.83 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.317 2.678 . . . . 0.0 112.797 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.16 46.73 0.06 OUTLIER Glycine 0 N--CA 1.469 0.885 0 C-N-CA 124.284 0.945 . . . . 0.0 114.064 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -133.75 -172.23 2.92 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.421 1.088 . . . . 0.0 111.861 -168.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -110.38 121.95 46.53 Favored 'General case' 0 CA--C 1.56 1.362 1 CA-C-O 128.882 4.182 . . . . 0.0 116.568 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.16 108.51 21.23 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 118.29 -2.756 . . . . 0.0 112.81 172.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 28.3 t -82.49 122.95 28.71 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 125.822 1.649 . . . . 0.0 111.226 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.49 -19.84 2.51 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -70.98 -22.65 62.16 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.006 1.275 . . . . 0.0 112.366 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.4 m 125.59 51.82 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 1 C-N-CA 131.87 4.068 . . . . 0.0 111.425 166.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -130.46 134.95 47.49 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 124.304 2.002 . . . . 0.0 116.291 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.24 121.36 39.04 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.032 -2.293 . . . . 0.0 110.445 160.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.82 169.2 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 115.064 -2.398 . . . . 0.0 105.836 169.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -95.88 151.03 19.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 127.954 3.284 . . . . 0.0 112.918 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -61.15 -15.8 37.57 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 126.662 2.476 . . . . 0.0 114.096 -166.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -45.65 -25.65 0.5 Allowed 'General case' 0 CA--C 1.55 0.978 0 O-C-N 119.991 -1.693 . . . . 0.0 113.366 160.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -101.67 -4.2 26.95 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 126.265 2.936 . . . . 0.0 110.873 -172.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -78.24 114.41 17.1 Favored 'General case' 0 C--N 1.354 0.78 1 O-C-N 116.082 -4.136 . . . . 0.0 109.028 170.042 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.25 8.8 p 41.02 55.76 3.09 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -167.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -82.53 -29.63 30.28 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.694 145.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.68 -11.62 42.19 Favored Glycine 0 CA--C 1.534 1.272 0 CA-C-O 117.422 -1.766 . . . . 0.0 115.444 -175.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -81.31 142.33 33.19 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 125.371 2.51 . . . . 0.0 111.535 172.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -45.55 -2.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 130.296 3.438 . . . . 0.0 118.653 -169.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -75.5 -21.42 58.03 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 120.189 -1.569 . . . . 0.0 109.891 -91.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.8 t -61.02 -13.67 18.09 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 130.726 3.61 . . . . 0.0 116.085 164.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.28 -34.1 0.27 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 128.666 2.786 . . . . 0.0 113.248 -174.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -28.42 66.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.655 1.982 . . . . 0.0 110.125 164.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 65.4 81.59 0.2 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.326 2.65 . . . . 0.0 109.689 -169.148 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.4 m -98.27 -60.84 1.47 Allowed 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -28.57 -66.31 0.08 Allowed 'General case' 0 C--O 1.247 0.957 0 CA-C-O 127.551 3.548 . . . . 0.0 112.076 157.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 22.2 mm-40 -87.18 17.76 4.1 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.953 -171.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -109.25 135.34 20.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 CA-C-O 115.214 -2.327 . . . . 0.0 108.047 155.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -68.68 22.98 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.993 1 C-N-CA 125.757 4.305 . . . . 0.0 114.556 -173.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.96 -20.32 60.4 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.997 0.919 . . . . 0.0 110.165 153.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -120.46 -82.51 0.65 Allowed 'General case' 0 C--N 1.344 0.346 0 C-N-CA 125.664 1.585 . . . . 0.0 108.868 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 36.4 t -144.47 -47.91 0.26 Allowed 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 177.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 11.7 t-160 56.74 95.81 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -179.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -68.03 84.33 0.23 Allowed 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.841 0.829 . . . . 0.0 112.428 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.3 t-80 . . . . . 0 CA--C 1.54 0.56 0 C-N-CA 125.835 1.654 . . . . 0.0 109.553 -179.421 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.243 0 CA-C-O 119.603 -0.554 . . . . 0.0 114.164 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.5 p -145.58 158.61 49.93 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 125.656 1.582 . . . . 0.0 110.893 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.98 118.97 5.19 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 122.87 2.38 . . . . 0.0 110.744 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -72.36 -47.59 0.39 Allowed 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.904 2.403 . . . . 0.0 112.195 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 84.4 -30.51 0.07 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 129.022 2.929 . . . . 0.0 115.976 168.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t -149.89 -50.79 0.14 Allowed 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 120.393 1.452 . . . . 0.0 110.92 173.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -133.34 179.6 1.33 Allowed Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 130.128 3.371 . . . . 0.0 105.081 170.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -74.81 68.91 5.51 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.423 2.258 . . . . 0.0 113.208 -175.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.73 46.14 0.04 OUTLIER Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.636 1.112 . . . . 0.0 115.702 177.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -128.69 -162.34 1.18 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.119 1.46 . . . . 0.0 112.782 -164.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -121.54 125.98 48.09 Favored 'General case' 0 CA--C 1.563 1.444 1 CA-C-O 128.547 4.022 . . . . 0.0 118.669 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.08 107.35 18.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 117.801 -3.062 . . . . 0.0 113.074 170.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.7 t -74.25 122.87 23.52 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 168.546 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.48 -22.91 8.83 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 177.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -60.42 -25.83 66.24 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.755 1.622 . . . . 0.0 113.089 170.298 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.1 m 129.9 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 131.633 3.973 . . . . 0.0 112.317 161.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -125.91 128.58 47.79 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 -164.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.337 0.1 OUTLIER -98.31 116.6 30.88 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 120.237 -1.54 . . . . 0.0 111.951 167.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.25 165.32 31.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 115.249 -2.31 . . . . 0.0 105.768 171.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -88.82 146.56 24.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.922 3.888 . . . . 0.0 112.061 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.4 -21.29 62.05 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 126.805 2.566 . . . . 0.0 113.755 -165.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -40.99 -28.89 0.09 Allowed 'General case' 0 CA--C 1.547 0.849 0 O-C-N 120.394 -1.441 . . . . 0.0 113.359 161.548 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -102.77 -5.35 23.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 111.853 -3.927 . . . . 0.0 113.622 -171.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HE2' HD11 ' A' ' 41' ' ' LEU . 25.3 mttt -72.43 143.2 48.59 Favored 'General case' 0 C--N 1.363 1.165 1 O-C-N 130.505 4.878 . . . . 0.0 109.168 166.112 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.7 p 31.57 56.89 0.3 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -89.26 -8.95 52.4 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.689 1.196 . . . . 0.0 111.84 157.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.97 10.48 75.29 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 117.099 -1.945 . . . . 0.0 112.975 -163.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -115.87 132.49 56.63 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 126.562 3.077 . . . . 0.0 114.591 -172.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.65 39.55 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 O-C-N 119.797 -1.815 . . . . 0.0 115.137 152.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.28 -47.47 4.79 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.223 2.209 . . . . 0.0 108.602 146.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.7 t -81.7 113.03 19.41 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 154.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.41 -20.7 0.74 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.537 1.535 . . . . 0.0 114.615 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -102.29 -2.99 27.94 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.569 1.077 . . . . 0.0 113.297 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 51.51 68.55 0.78 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.395 1.878 . . . . 0.0 110.245 -166.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 m -77.65 -67.06 0.76 Allowed 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 11.5 p-10 -60.1 -47.21 86.86 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-O 125.796 2.712 . . . . 0.0 113.232 -170.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -61.18 2.41 0.14 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 112.62 -2.082 . . . . 0.0 114.605 172.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.92 141.61 29.5 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 120.178 1.354 . . . . 0.0 109.541 165.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -72.17 21.83 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.823 1 C-N-CA 125.919 4.412 . . . . 0.0 114.192 -168.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.09 -21.07 64.09 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.814 -0.554 . . . . 0.0 110.089 151.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.558 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 10.0 tt -127.21 -77.19 0.57 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 126.257 1.823 . . . . 0.0 108.732 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.2 t -138.13 -61.99 0.59 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 t60 58.42 173.3 0.06 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.743 1.617 . . . . 0.0 114.474 -165.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 39.88 85.55 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 128.761 2.824 . . . . 0.0 116.087 171.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 61.3 t60 . . . . . 0 N--CA 1.469 0.496 0 C-N-CA 125.028 1.331 . . . . 0.0 112.02 173.82 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.242 0 N-CA-C 112.242 -0.343 . . . . 0.0 112.242 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.8 m 65.21 160.35 0.12 Allowed Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 127.477 2.311 . . . . 0.0 113.859 -174.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.1 111.0 3.07 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 123.035 2.49 . . . . 0.0 110.229 172.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -67.92 -54.82 0.3 Allowed 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.237 2.624 . . . . 0.0 112.788 -169.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 68.74 114.21 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 127.084 2.154 . . . . 0.0 111.323 173.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 67.36 -60.68 0.37 Allowed 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 126.696 1.998 . . . . 0.0 113.476 -176.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -142.2 -170.69 0.25 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.3 3.44 . . . . 0.0 106.396 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -78.35 70.8 7.06 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 CA-C-N 123.791 2.39 . . . . 0.0 111.464 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 134.73 53.36 0.07 OUTLIER Glycine 0 C--N 1.347 1.145 0 N-CA-C 118.203 2.041 . . . . 0.0 118.203 171.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -127.91 -159.0 0.91 Allowed 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.913 1.857 . . . . 0.0 111.626 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -111.85 124.25 51.96 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 127.911 3.719 . . . . 0.0 116.727 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.84 108.83 21.21 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 118.015 -2.928 . . . . 0.0 113.442 167.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.2 t -81.56 128.3 33.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.646 2.378 . . . . 0.0 111.515 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.93 -11.93 3.93 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 174.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -66.63 -25.83 66.78 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 120.884 1.674 . . . . 0.0 111.911 164.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m 126.77 44.05 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 1 C-N-CA 132.168 4.187 . . . . 0.0 111.281 165.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.4 mmm-85 -128.41 136.41 50.85 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.708 1.718 . . . . 0.0 114.967 -156.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.379 0.6 OUTLIER -104.04 114.51 28.81 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 119.133 -2.23 . . . . 0.0 112.538 170.418 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.55 167.34 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 114.074 -2.87 . . . . 0.0 106.46 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -87.38 145.57 26.25 Favored 'General case' 0 N--CA 1.449 -0.524 1 O-C-N 129.466 4.229 . . . . 0.0 113.235 -171.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.12 -17.18 16.56 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 126.988 2.68 . . . . 0.0 114.212 -167.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.54 -37.75 8.43 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.726 1.603 . . . . 0.0 110.217 165.068 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -83.4 -10.52 58.37 Favored 'General case' 0 CA--C 1.565 1.526 0 CA-C-O 125.849 2.738 . . . . 0.0 108.685 -165.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.2 mttt -76.34 126.91 31.85 Favored 'General case' 0 C--N 1.355 0.82 0 O-C-N 116.67 -3.768 . . . . 0.0 107.786 166.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.2 m 66.94 15.59 10.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -18.66 51.39 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 120.319 -1.488 . . . . 0.0 112.578 -175.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.475 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 93.63 -0.17 67.48 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 116.992 -2.004 . . . . 0.0 114.6 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -118.23 150.94 38.59 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 126.871 3.224 . . . . 0.0 113.901 170.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.493 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -61.95 53.48 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.741 2.417 . . . . 0.0 110.956 162.479 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.93 -28.97 59.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.754 1.622 . . . . 0.0 109.981 175.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.0 t -78.25 -14.03 59.61 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.91 2.884 . . . . 0.0 115.778 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.98 -32.68 0.13 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.115 2.166 . . . . 0.0 114.879 -172.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -22.14 55.12 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.542 2.337 . . . . 0.0 110.964 169.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 57.31 85.72 0.08 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.085 2.154 . . . . 0.0 111.491 -166.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.9 m -101.83 -62.82 1.21 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -29.58 -68.95 0.07 Allowed 'General case' 0 C--O 1.242 0.692 0 C-N-CA 130.571 3.549 . . . . 0.0 111.004 166.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.475 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 11.8 mm-40 -86.31 19.19 2.83 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 119.384 -2.073 . . . . 0.0 112.679 -170.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -110.6 130.64 22.68 Favored Pre-proline 0 CA--C 1.543 0.71 0 CA-C-O 115.538 -2.172 . . . . 0.0 107.406 157.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -68.82 21.04 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.97 1 C-N-CA 125.845 4.363 . . . . 0.0 114.656 -170.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.94 -21.14 60.93 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.858 0.863 . . . . 0.0 110.395 154.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -118.36 -79.37 0.59 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.584 1.554 . . . . 0.0 108.595 175.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 14.8 t -134.79 -66.38 0.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.6 t60 54.92 91.57 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.577 1.551 . . . . 0.0 113.612 -163.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -74.13 -41.21 61.93 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.112 161.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 . . . . . 0 CA--C 1.535 0.385 0 C-N-CA 123.737 0.815 . . . . 0.0 110.601 175.775 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.248 0 N-CA-C 113.911 0.325 . . . . 0.0 113.911 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.1 m -167.75 160.9 9.98 Favored Pre-proline 0 N--CA 1.468 0.473 0 C-N-CA 126.439 1.896 . . . . 0.0 110.01 174.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -68.91 133.7 27.84 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 121.952 1.768 . . . . 0.0 110.119 173.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.76 -38.52 7.69 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.952 2.435 . . . . 0.0 112.035 177.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 63.67 111.15 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.757 2.023 . . . . 0.0 110.892 178.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 60.9 -58.2 0.09 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 128.85 2.86 . . . . 0.0 116.192 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -135.69 -167.54 0.15 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.144 3.378 . . . . 0.0 106.023 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -77.09 81.13 2.69 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 CA-C-N 123.734 2.369 . . . . 0.0 110.183 170.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 115.83 56.74 0.34 Allowed Glycine 0 C--N 1.347 1.18 0 N-CA-C 117.923 1.929 . . . . 0.0 117.923 173.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -124.55 -154.49 0.62 Allowed 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.783 . . . . 0.0 111.204 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -117.31 125.3 50.84 Favored 'General case' 0 CA--C 1.56 1.337 0 CA-C-O 128.349 3.928 . . . . 0.0 116.95 177.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.86 110.77 23.12 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 117.95 -2.969 . . . . 0.0 113.269 171.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 20.4 t -80.94 124.18 28.92 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 127.552 2.341 . . . . 0.0 110.733 175.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.33 -16.93 3.94 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 174.06 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -68.47 -26.85 65.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.363 1.438 . . . . 0.0 111.922 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.4 m 126.23 53.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.315 1 C-N-CA 131.929 4.092 . . . . 0.0 110.907 168.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.91 135.04 48.51 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 123.622 1.677 . . . . 0.0 115.525 -170.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.368 0.5 OUTLIER -104.1 116.95 33.13 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 119.132 -2.23 . . . . 0.0 112.09 163.048 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -133.01 160.88 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 115.139 -2.362 . . . . 0.0 104.838 176.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.86 153.42 30.61 Favored 'General case' 0 N--CA 1.442 -0.853 0 O-C-N 128.847 3.842 . . . . 0.0 112.567 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -59.68 -17.49 34.65 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 127.785 3.178 . . . . 0.0 113.863 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.05 -20.67 1.02 Allowed 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.452 -2.03 . . . . 0.0 113.969 162.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -98.99 -4.3 32.9 Favored 'General case' 0 CA--C 1.564 1.491 0 CA-C-O 125.597 2.618 . . . . 0.0 112.403 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -78.33 121.61 24.69 Favored 'General case' 0 C--N 1.352 0.714 0 O-C-N 116.935 -3.603 . . . . 0.0 109.425 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.261 4.2 p 39.14 58.66 1.81 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -89.79 -16.79 29.45 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 159.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 107.69 -12.67 38.82 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-O 115.74 -2.7 . . . . 0.0 116.502 -170.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -119.27 146.98 44.79 Favored 'General case' 0 N--CA 1.477 0.917 1 CA-C-O 129.343 4.401 . . . . 0.0 117.601 -176.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.514 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -66.96 52.91 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 O-C-N 118.031 -2.918 . . . . 0.0 111.37 172.549 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.63 -31.97 27.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.572 1.949 . . . . 0.0 110.075 172.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 46.8 t -79.43 -13.36 59.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 127.66 2.384 . . . . 0.0 115.894 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.81 -34.27 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 127.391 2.276 . . . . 0.0 114.876 -171.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -20.33 60.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 128.15 2.58 . . . . 0.0 110.765 171.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 51.63 81.15 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.552 1.941 . . . . 0.0 110.035 -162.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.5 m -85.62 -81.89 0.2 Allowed 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.814 -2.291 . . . . 0.0 104.814 168.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -16.12 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.062 2 C-N-CA 135.422 5.489 . . . . 0.0 112.129 175.891 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -74.84 1.68 12.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.759 -2.019 . . . . 0.0 114.451 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -105.51 131.64 21.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 115.527 -2.178 . . . . 0.0 107.668 169.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -69.76 19.79 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.937 1 C-N-CA 126.639 4.892 . . . . 0.0 114.481 -167.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.45 -23.51 61.85 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.105 0.962 . . . . 0.0 110.507 154.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -117.48 -81.48 0.62 Allowed 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.366 1.866 . . . . 0.0 107.93 170.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 t -142.33 -171.53 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.313 0.506 . . . . 0.0 110.494 170.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -168.28 122.14 0.9 Allowed 'General case' 0 N--CA 1.467 0.425 0 O-C-N 120.032 -1.668 . . . . 0.0 108.977 168.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.16 68.92 4.29 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 122.019 0.914 . . . . 0.0 111.876 -177.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 . . . . . 0 CA--C 1.539 0.541 0 C-N-CA 126.947 2.099 . . . . 0.0 112.441 -179.98 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.233 0 N-CA-C 114.619 0.608 . . . . 0.0 114.619 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.8 m -168.37 -58.27 0.01 OUTLIER Pre-proline 0 N--CA 1.474 0.747 0 C-N-CA 126.385 1.874 . . . . 0.0 111.451 172.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -71.25 165.36 32.68 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.134 1.889 . . . . 0.0 111.7 171.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -72.67 69.4 3.58 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 125.029 3.819 . . . . 0.0 111.301 174.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.722 ' NE2' ' H ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -17.0 -53.36 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.594 1 C-N-CA 133.731 4.812 . . . . 0.0 117.497 -175.648 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.7 t -137.27 -45.43 0.56 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.627 2.371 . . . . 0.0 109.046 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -138.85 171.75 7.67 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 130.473 3.509 . . . . 0.0 105.164 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.33 79.96 2.02 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.431 2.088 . . . . 0.0 112.146 -177.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.78 50.76 0.1 OUTLIER Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.407 1.003 . . . . 0.0 114.317 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.722 ' H ' ' NE2' ' A' ' 5' ' ' GLN . 6.5 mm-40 -134.41 -166.47 1.81 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.508 1.123 . . . . 0.0 111.337 -169.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -115.84 122.66 46.06 Favored 'General case' 0 CA--C 1.558 1.283 1 CA-C-O 128.66 4.076 . . . . 0.0 117.115 177.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.22 106.67 18.37 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 118.355 -2.716 . . . . 0.0 111.707 171.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.409 ' SG ' ' HB3' ' A' ' 15' ' ' ASN . 19.8 t -85.47 129.6 34.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 126.217 1.807 . . . . 0.0 112.082 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.87 -22.22 2.09 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.409 ' HB3' ' SG ' ' A' ' 13' ' ' CYS . 24.5 t-20 -65.48 -25.21 67.39 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 120.256 1.389 . . . . 0.0 112.288 169.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m 125.57 44.91 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.441 1 C-N-CA 132.145 4.178 . . . . 0.0 111.056 166.57 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 mmm-85 -127.63 134.4 49.66 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-O 123.628 1.68 . . . . 0.0 114.943 -157.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.312 0.5 OUTLIER -102.54 115.22 30.14 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 119.422 -2.049 . . . . 0.0 111.147 167.749 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -135.92 169.0 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 114.637 -2.602 . . . . 0.0 106.073 174.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -93.95 149.09 21.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 128.595 3.685 . . . . 0.0 113.105 -168.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -59.66 -17.29 32.71 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 126.882 2.614 . . . . 0.0 114.008 -167.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -46.09 -26.68 0.79 Allowed 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.172 -1.58 . . . . 0.0 113.247 162.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -99.91 -10.75 21.34 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-O 126.081 2.848 . . . . 0.0 110.19 -172.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.5 mtpt -72.03 139.75 48.69 Favored 'General case' 0 C--N 1.355 0.837 1 O-C-N 115.537 -4.477 . . . . 0.0 107.153 165.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 m 64.35 10.1 5.42 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -41.34 50.99 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.768 1.627 . . . . 0.0 110.622 -170.406 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.428 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 119.16 -1.39 14.59 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-O 116.553 -2.248 . . . . 0.0 115.444 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -118.23 151.32 37.87 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 127.398 3.475 . . . . 0.0 113.965 166.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.507 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -62.39 63.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 O-C-N 119.43 -2.044 . . . . 0.0 109.388 163.514 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -65.82 -24.57 66.93 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 120.631 -1.293 . . . . 0.0 109.47 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.7 t -67.33 -13.0 61.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.54 2.736 . . . . 0.0 115.705 166.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 65.06 -38.42 0.24 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.147 2.579 . . . . 0.0 114.56 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -86.65 -9.82 55.18 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.175 2.19 . . . . 0.0 111.028 174.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.0 t30 62.86 128.4 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 129.211 3.004 . . . . 0.0 112.546 -167.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.5 m -147.47 -52.15 0.2 Allowed 'General case' 0 C--O 1.212 -0.873 0 O-C-N 120.214 -1.554 . . . . 0.0 111.925 164.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -28.41 -69.46 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 CA-C-O 127.912 3.72 . . . . 0.0 111.84 157.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 6.0 mm-40 -92.99 23.17 4.4 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.434 -2.666 . . . . 0.0 112.244 -173.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.99 119.62 54.89 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-O 114.458 -2.687 . . . . 0.0 106.045 152.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.52 19.63 0.08 OUTLIER 'Trans proline' 0 CA--C 1.543 0.926 1 C-N-CA 126.488 4.792 . . . . 0.0 115.497 -168.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -21.08 56.51 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.567 1.147 . . . . 0.0 110.319 156.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tt -108.11 -81.2 0.57 Allowed 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.179 1.392 . . . . 0.0 108.559 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 5.4 t -138.86 -59.03 0.61 Allowed 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 56.21 93.47 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.62 1.568 . . . . 0.0 114.395 -170.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 56.69 90.26 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.7 1.6 . . . . 0.0 114.547 171.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 . . . . . 0 N--CA 1.469 0.494 0 C-N-CA 125.896 1.679 . . . . 0.0 112.724 -171.414 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.101 0 CA-C-O 121.425 0.458 . . . . 0.0 112.269 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.4 m -163.77 156.84 15.84 Favored Pre-proline 0 N--CA 1.469 0.523 0 C-N-CA 125.133 1.373 . . . . 0.0 110.062 172.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.42 121.5 6.83 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 122.922 2.415 . . . . 0.0 111.049 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -71.73 -44.34 1.03 Allowed 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.868 2.379 . . . . 0.0 112.207 178.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 87.0 -25.1 0.1 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 129.972 3.309 . . . . 0.0 116.019 168.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.9 t -155.82 -50.53 0.08 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.585 1.554 . . . . 0.0 110.524 171.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -135.01 178.6 1.69 Allowed Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 131.085 3.754 . . . . 0.0 104.951 171.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.76 71.39 4.84 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 CA-C-N 123.331 2.225 . . . . 0.0 113.297 -173.737 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.81 50.4 0.06 OUTLIER Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.855 1.217 . . . . 0.0 114.871 177.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -129.37 -166.03 1.6 Allowed 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.885 1.342 . . . . 0.0 112.914 -165.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -117.09 123.54 47.04 Favored 'General case' 0 CA--C 1.561 1.367 1 CA-C-O 128.542 4.02 . . . . 0.0 117.166 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.57 108.17 20.71 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 117.871 -3.018 . . . . 0.0 112.374 168.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 13.5 t -79.78 126.39 30.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.31 1.844 . . . . 0.0 110.471 176.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -17.4 2.76 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 173.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.07 -24.33 64.15 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 120.459 1.481 . . . . 0.0 111.733 168.345 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.7 m 122.94 51.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 C-N-CA 131.897 4.079 . . . . 0.0 110.171 167.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -127.59 136.06 51.14 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 123.605 1.669 . . . . 0.0 115.445 -167.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.283 0.2 OUTLIER -99.17 115.87 30.06 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 119.455 -2.028 . . . . 0.0 111.068 165.004 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.67 163.31 37.8 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 115.096 -2.383 . . . . 0.0 105.81 173.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -85.48 142.06 29.48 Favored 'General case' 0 N--CA 1.442 -0.849 1 O-C-N 130.105 4.628 . . . . 0.0 111.799 -174.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -58.2 -16.86 15.25 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 127.295 2.872 . . . . 0.0 113.909 -169.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -52.87 -19.85 2.85 Favored 'General case' 0 CA--C 1.553 1.062 0 O-C-N 119.591 -1.943 . . . . 0.0 113.253 163.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -92.7 -10.29 37.69 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 126.077 2.846 . . . . 0.0 112.001 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -75.96 120.68 21.63 Favored 'General case' 0 C--N 1.353 0.731 1 O-C-N 116.009 -4.182 . . . . 0.0 108.343 171.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.257 1.6 p 42.83 57.76 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -164.224 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.83 -26.5 22.78 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.105 162.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.421 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 104.84 -3.17 41.62 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 116.966 -2.019 . . . . 0.0 114.712 -174.3 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -123.99 152.39 42.61 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 127.862 3.696 . . . . 0.0 114.471 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.468 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -64.09 55.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 127.877 2.471 . . . . 0.0 110.472 168.557 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.49 -27.7 62.77 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.704 1.601 . . . . 0.0 110.139 176.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.5 t -80.52 -13.69 58.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 128.263 2.625 . . . . 0.0 115.897 173.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.0 -32.62 0.11 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.479 2.312 . . . . 0.0 115.06 -172.093 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -22.39 59.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 127.69 2.396 . . . . 0.0 110.903 169.106 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 58.6 87.06 0.08 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.352 2.261 . . . . 0.0 111.044 -168.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -106.44 -62.89 1.33 Allowed 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.162 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -28.86 -67.9 0.07 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-O 127.369 3.462 . . . . 0.0 111.569 164.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 26.9 mm-40 -82.37 11.82 5.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 112.676 -2.056 . . . . 0.0 113.752 -170.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.46 131.67 21.54 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-O 115.183 -2.341 . . . . 0.0 107.074 163.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -68.51 22.1 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 126.073 4.516 . . . . 0.0 114.498 -171.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.6 59.69 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.141 0.976 . . . . 0.0 110.227 154.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -119.83 -82.05 0.64 Allowed 'General case' 0 C--N 1.344 0.333 0 C-N-CA 125.614 1.566 . . . . 0.0 108.977 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 15.1 t -140.02 -50.61 0.48 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 37.1 t-80 57.31 98.98 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -173.116 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -69.17 103.03 1.81 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.419 -0.8 . . . . 0.0 111.078 170.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 . . . . . 0 CA--C 1.538 0.507 0 C-N-CA 126.211 1.804 . . . . 0.0 113.126 -179.993 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.204 0 CA-C-O 119.201 -0.777 . . . . 0.0 114.083 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.6 m 32.78 66.43 1.12 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 128.427 2.691 . . . . 0.0 114.8 -178.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -59.63 163.58 12.92 Favored 'Trans proline' 0 CA--C 1.549 1.239 0 C-N-CA 122.958 2.438 . . . . 0.0 113.642 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -73.07 -23.49 18.23 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.79 2.993 . . . . 0.0 114.84 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 49.1 mm-40 79.34 -105.54 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.323 2.249 . . . . 0.0 112.323 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.31 -45.2 23.3 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.773 1.17 . . . . 0.0 112.63 -174.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -152.1 174.29 3.76 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 130.989 3.716 . . . . 0.0 105.605 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.08 84.41 0.44 Allowed 'Trans proline' 0 CA--C 1.545 1.069 0 CA-C-N 123.275 2.205 . . . . 0.0 113.981 -174.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.16 2.08 1.41 Allowed Glycine 0 CA--C 1.534 1.265 0 N-CA-C 117.168 1.627 . . . . 0.0 117.168 171.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.2 -162.12 0.76 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.597 1.199 . . . . 0.0 113.764 -153.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -113.71 124.11 51.5 Favored 'General case' 0 CA--C 1.559 1.299 1 CA-C-O 128.671 4.081 . . . . 0.0 117.157 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.77 110.85 23.39 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 117.958 -2.964 . . . . 0.0 113.071 166.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.6 t -79.14 122.8 26.7 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 125.515 1.526 . . . . 0.0 110.682 171.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.2 -13.57 5.28 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 173.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.99 -27.23 67.27 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.523 1.51 . . . . 0.0 111.996 166.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.7 m 128.31 52.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.389 1 C-N-CA 132.01 4.124 . . . . 0.0 111.319 166.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -130.27 132.18 45.8 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 123.615 1.674 . . . . 0.0 115.497 -168.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.314 0.5 OUTLIER -100.42 117.67 35.07 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 118.911 -2.368 . . . . 0.0 111.015 165.428 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.83 165.48 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 115.146 -2.359 . . . . 0.0 106.059 174.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -91.23 152.1 20.66 Favored 'General case' 0 N--CA 1.446 -0.633 1 O-C-N 129.16 4.037 . . . . 0.0 112.909 -170.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -60.63 -16.83 42.65 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 126.831 2.582 . . . . 0.0 114.123 -167.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -44.09 -27.06 0.35 Allowed 'General case' 0 CA--C 1.552 1.022 0 O-C-N 119.655 -1.903 . . . . 0.0 113.562 160.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 2.6 m0 -101.47 -6.67 23.66 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 126.354 2.978 . . . . 0.0 110.693 -172.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -76.4 118.33 18.97 Favored 'General case' 0 C--N 1.356 0.855 1 O-C-N 116.189 -4.07 . . . . 0.0 108.045 172.12 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.251 2.0 p 46.98 46.42 15.8 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -174.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -75.76 -23.58 55.98 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.145 -0.972 . . . . 0.0 111.693 151.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.56 5.0 65.36 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 117.262 -1.854 . . . . 0.0 114.101 -165.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -90.65 128.28 36.57 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 124.383 2.039 . . . . 0.0 110.094 175.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -44.26 -36.85 2.92 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-O 116.549 -1.691 . . . . 0.0 113.561 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 34.74 -50.1 0.0 OUTLIER 'General case' 0 C--N 1.35 0.624 1 C-N-CA 138.681 6.792 . . . . 0.0 114.72 173.479 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.5 t -69.92 -20.6 63.35 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.513 2.725 . . . . 0.0 115.601 166.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.63 -39.0 0.42 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.927 2.091 . . . . 0.0 112.419 -173.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -14.38 61.24 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.946 2.098 . . . . 0.0 110.311 170.422 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 52.41 65.44 1.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.296 2.239 . . . . 0.0 110.086 -174.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 m -78.93 -60.7 2.27 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 -176.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 18.5 p-10 -57.82 -49.93 74.98 Favored 'General case' 0 C--O 1.246 0.869 0 CA-C-O 126.577 3.084 . . . . 0.0 111.478 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -71.01 9.75 0.66 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 112.631 -2.077 . . . . 0.0 114.144 176.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.58 137.69 22.28 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-O 116.411 -1.757 . . . . 0.0 108.659 157.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -69.76 21.04 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 126.145 4.563 . . . . 0.0 114.308 -171.278 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.36 -22.14 64.68 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.097 0.559 . . . . 0.0 110.276 151.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 5.7 tt -121.28 -76.56 0.58 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.015 1.726 . . . . 0.0 108.977 176.458 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 34.1 t -139.71 -68.5 0.42 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.2 t60 60.53 136.52 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 127.383 2.273 . . . . 0.0 114.768 -164.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -146.93 -63.33 0.29 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.693 0.797 . . . . 0.0 111.744 172.661 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 13.6 t60 . . . . . 0 N--CA 1.471 0.609 0 C-N-CA 125.754 1.622 . . . . 0.0 113.058 -176.952 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.253 0 CA-C-O 119.663 -0.52 . . . . 0.0 114.023 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.7 p -64.4 113.65 11.31 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 125.873 1.669 . . . . 0.0 111.146 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.48 114.35 3.24 Favored 'Trans proline' 0 CA--C 1.547 1.125 0 C-N-CA 123.118 2.545 . . . . 0.0 111.239 -177.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -70.53 -41.55 3.22 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.789 2.993 . . . . 0.0 113.188 -171.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 67.17 117.17 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 127.61 2.364 . . . . 0.0 111.819 173.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER 64.56 -58.94 0.23 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 127.739 2.416 . . . . 0.0 114.609 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -139.14 -172.83 0.33 Allowed Pre-proline 0 CA--C 1.555 1.16 0 C-N-CA 130.862 3.665 . . . . 0.0 106.187 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.62 79.62 2.76 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 CA-C-N 123.388 2.246 . . . . 0.0 110.761 171.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 119.47 57.16 0.25 Allowed Glycine 0 C--N 1.346 1.12 0 N-CA-C 117.285 1.674 . . . . 0.0 117.285 173.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -127.39 -160.62 1.02 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 119.737 1.768 . . . . 0.0 111.504 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -108.89 122.95 48.28 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 127.915 3.721 . . . . 0.0 115.962 176.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.05 110.48 23.05 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 118.239 -2.788 . . . . 0.0 113.314 166.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.3 t -77.74 124.1 27.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.121 1.768 . . . . 0.0 110.68 171.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.04 -19.72 2.03 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 172.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -70.4 -24.25 62.9 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 120.279 1.399 . . . . 0.0 112.297 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m 125.59 52.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 131.666 3.987 . . . . 0.0 110.822 166.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.48 132.97 48.37 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 123.472 1.606 . . . . 0.0 115.141 -169.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.375 0.5 OUTLIER -105.09 117.05 33.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.022 -2.299 . . . . 0.0 112.45 167.206 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.68 166.14 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 114.203 -2.808 . . . . 0.0 106.318 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -88.81 144.41 26.24 Favored 'General case' 0 N--CA 1.449 -0.476 1 O-C-N 129.311 4.132 . . . . 0.0 113.103 -170.084 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -58.3 -15.22 9.45 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 127.12 2.763 . . . . 0.0 114.318 -167.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.7 ttp85 -50.64 -28.12 8.23 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.218 -1.551 . . . . 0.0 112.449 164.436 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -91.99 -4.3 54.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 126.146 2.879 . . . . 0.0 110.132 -172.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HB3' HD21 ' A' ' 41' ' ' LEU . 17.8 mttt -78.82 105.91 10.46 Favored 'General case' 0 C--N 1.351 0.672 0 O-C-N 116.425 -3.922 . . . . 0.0 108.265 170.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 12.8 p 48.08 57.16 6.38 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -168.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -81.06 -37.78 28.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.231 145.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.14 -19.96 8.12 Favored Glycine 0 CA--C 1.537 1.457 0 CA-C-O 117.09 -1.95 . . . . 0.0 116.036 -173.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -78.95 139.82 38.16 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 125.941 2.782 . . . . 0.0 111.864 173.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -54.79 8.45 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 118.536 -2.603 . . . . 0.0 117.572 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -55.18 -24.18 25.58 Favored 'General case' 0 C--N 1.325 -0.487 1 C-N-CA 133.002 4.521 . . . . 0.0 112.728 -120.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.2 t -61.63 -20.68 63.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 130.192 3.397 . . . . 0.0 117.894 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 66.45 -32.28 0.17 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 128.106 2.563 . . . . 0.0 113.777 -171.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -15.98 62.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.395 1.878 . . . . 0.0 110.649 160.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.83 63.49 2.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.285 1.834 . . . . 0.0 110.336 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -79.33 -59.02 2.93 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.674 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -38.93 -66.0 0.32 Allowed 'General case' 0 C--O 1.249 1.039 1 CA-C-O 128.55 4.024 . . . . 0.0 110.974 177.216 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -82.08 19.66 1.12 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 110.473 -3.058 . . . . 0.0 112.909 -175.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -116.2 136.64 23.06 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 115.449 -2.215 . . . . 0.0 108.076 153.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -67.61 19.69 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.987 1 C-N-CA 125.911 4.407 . . . . 0.0 114.688 -173.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.62 -21.86 62.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.863 0.865 . . . . 0.0 110.64 154.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.674 HD22 ' HA ' ' A' ' 36' ' ' ASP . 9.1 tt -119.19 -75.98 0.58 Allowed 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 126.02 1.728 . . . . 0.0 108.23 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 50.9 t -145.92 -59.83 0.32 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 t60 49.06 -64.22 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 -160.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -91.9 93.19 8.69 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 120.88 -1.137 . . . . 0.0 110.617 -174.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.8 t60 . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.191 1.396 . . . . 0.0 112.503 -175.021 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.225 0 CA-C-O 119.664 -0.52 . . . . 0.0 114.184 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.7 m -60.59 128.81 88.9 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.858 1.263 . . . . 0.0 111.415 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -71.0 121.47 7.89 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 122.931 2.42 . . . . 0.0 112.318 -172.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -77.9 48.33 2.61 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 125.119 3.879 . . . . 0.0 112.519 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -63.93 141.86 58.62 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.973 1.709 . . . . 0.0 110.959 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 61.62 -71.36 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.841 1.656 . . . . 0.0 110.789 -155.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -150.35 167.03 13.81 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.787 2.035 . . . . 0.0 108.808 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.14 78.19 0.81 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.154 2.569 . . . . 0.0 112.194 173.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.72 38.96 0.11 Allowed Glycine 0 N--CA 1.47 0.91 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -132.26 -170.46 2.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.657 1.183 . . . . 0.0 111.537 -171.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -111.93 121.64 45.57 Favored 'General case' 0 CA--C 1.56 1.359 1 CA-C-O 128.844 4.164 . . . . 0.0 116.675 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.23 107.48 19.96 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 118.216 -2.802 . . . . 0.0 112.824 170.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.6 t -83.55 123.56 29.88 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.752 1.621 . . . . 0.0 111.334 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.36 -12.76 4.1 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -66.74 -29.6 69.62 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 120.858 1.663 . . . . 0.0 111.775 165.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m 127.95 55.92 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 1 C-N-CA 132.052 4.141 . . . . 0.0 110.732 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -132.51 132.46 42.67 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 124.19 1.948 . . . . 0.0 115.344 -168.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.255 0.3 OUTLIER -98.66 119.38 37.3 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 118.863 -2.398 . . . . 0.0 110.493 161.701 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.24 168.47 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 115.028 -2.415 . . . . 0.0 105.993 171.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -93.84 150.81 20.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 128.366 3.541 . . . . 0.0 112.979 -169.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.2 -16.1 30.19 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 126.756 2.535 . . . . 0.0 114.305 -166.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -45.92 -26.82 0.76 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.117 -1.614 . . . . 0.0 113.297 161.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.8 m0 -99.03 -5.44 30.37 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-O 126.844 3.211 . . . . 0.0 110.377 -172.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.52 ' HG2' HD21 ' A' ' 41' ' ' LEU . 15.7 mttt -76.99 109.94 11.21 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 115.683 -4.385 . . . . 0.0 109.255 171.327 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 p 42.47 53.88 4.53 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 115.983 1.845 . . . . 0.0 115.983 -169.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -68.05 -25.87 65.57 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.251 140.462 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.37 14.38 51.05 Favored Glycine 0 CA--C 1.53 0.976 0 CA-C-O 117.179 -1.901 . . . . 0.0 113.313 -167.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -110.35 139.32 45.66 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-O 126.555 3.074 . . . . 0.0 113.68 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -40.59 -40.3 1.23 Allowed 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.706 2.402 . . . . 0.0 114.363 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 30.42 -47.52 0.0 OUTLIER 'General case' 0 C--N 1.348 0.504 1 C-N-CA 139.146 6.978 . . . . 0.0 114.857 178.611 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 44.0 t -73.88 -24.81 59.78 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.982 3.313 . . . . 0.0 116.29 169.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.0 -27.52 0.16 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 126.994 2.118 . . . . 0.0 113.941 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -13.96 59.64 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.87 2.068 . . . . 0.0 110.788 158.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 49.82 58.12 5.79 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.376 2.27 . . . . 0.0 110.793 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -69.78 -58.61 3.69 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.573 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -36.66 -65.11 0.3 Allowed 'General case' 0 C--O 1.248 0.987 1 C-N-CA 131.798 4.039 . . . . 0.0 110.669 173.069 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.27 16.58 1.96 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 111.035 -2.802 . . . . 0.0 113.513 -173.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.68 136.53 22.02 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-O 115.689 -2.1 . . . . 0.0 108.174 155.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -68.89 20.9 0.15 Allowed 'Trans proline' 0 CA--C 1.543 0.959 1 C-N-CA 125.768 4.312 . . . . 0.0 114.552 -173.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.34 -21.35 62.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.629 0.772 . . . . 0.0 110.403 152.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 36' ' ' ASP . 6.3 tt -120.42 -76.86 0.58 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 125.78 1.632 . . . . 0.0 108.828 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.2 t -142.38 -61.5 0.44 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.8 t60 60.95 120.52 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.726 2.01 . . . . 0.0 115.565 -166.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -129.87 166.14 20.59 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.336 0.654 . . . . 0.0 110.879 157.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 6.3 p-80 . . . . . 0 CA--C 1.533 0.315 0 C-N-CA 125.013 1.325 . . . . 0.0 110.888 -179.648 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.252 0 CA-C-O 119.098 -0.834 . . . . 0.0 114.156 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.5 m 34.73 59.18 2.31 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 128.173 2.589 . . . . 0.0 114.676 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.84 124.08 10.32 Favored 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.924 2.416 . . . . 0.0 112.481 -170.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -77.27 47.02 2.13 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 125.049 3.833 . . . . 0.0 112.758 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -63.98 146.54 53.91 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.801 1.64 . . . . 0.0 110.778 172.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 61.68 -72.54 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.668 1.587 . . . . 0.0 110.85 -157.121 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -150.48 166.11 15.88 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 126.986 2.114 . . . . 0.0 108.78 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.22 78.95 1.13 Allowed 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.05 2.5 . . . . 0.0 112.547 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.26 37.55 0.09 OUTLIER Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.685 1.136 . . . . 0.0 115.209 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -131.03 -170.14 2.3 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.0 1.32 . . . . 0.0 111.598 -168.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -113.75 122.41 47.0 Favored 'General case' 0 CA--C 1.56 1.33 1 CA-C-O 128.987 4.232 . . . . 0.0 116.546 -178.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.88 109.6 22.28 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 118.233 -2.792 . . . . 0.0 112.394 170.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 36.5 t -83.48 124.24 30.52 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.352 1.861 . . . . 0.0 111.307 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.53 -12.91 4.5 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 174.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.5 -29.34 69.42 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.871 1.669 . . . . 0.0 111.84 165.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 m 128.02 52.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.354 1 C-N-CA 132.186 4.194 . . . . 0.0 110.901 169.296 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -130.08 134.83 47.63 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 124.419 2.057 . . . . 0.0 115.66 -167.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 121.39 39.58 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 118.77 -2.456 . . . . 0.0 110.428 162.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.22 164.15 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 114.765 -2.541 . . . . 0.0 105.964 169.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -88.84 151.21 22.5 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.541 3.65 . . . . 0.0 112.721 -172.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -61.21 -16.0 40.4 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 126.39 2.306 . . . . 0.0 114.697 -166.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.39 -38.14 2.62 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.692 1.587 . . . . 0.0 110.792 161.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -88.87 -5.5 57.98 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 124.788 2.232 . . . . 0.0 108.982 -164.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HA ' ' HB2' ' A' ' 36' ' ' ASP . 18.3 mttt -77.97 134.91 37.76 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 117.983 -2.948 . . . . 0.0 109.443 165.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.8 m 60.33 15.29 5.29 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -175.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -11.15 58.65 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.263 1.825 . . . . 0.0 112.104 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.96 -3.51 28.24 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-O 116.997 -2.001 . . . . 0.0 114.481 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -91.16 133.97 34.93 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 126.479 3.037 . . . . 0.0 111.18 165.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -35.3 -44.92 0.29 Allowed 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 128.368 2.667 . . . . 0.0 112.872 169.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 35.64 -49.87 0.0 OUTLIER 'General case' 0 C--N 1.349 0.546 1 C-N-CA 138.746 6.818 . . . . 0.0 114.288 175.498 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 25.5 t -65.09 -23.87 67.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.469 3.108 . . . . 0.0 115.518 163.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.62 -25.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.997 2.119 . . . . 0.0 113.881 -178.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.7 -11.89 56.59 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.223 2.209 . . . . 0.0 110.762 163.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.0 m120 51.1 64.06 1.99 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 127.191 2.196 . . . . 0.0 109.891 -174.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 m -77.13 -60.86 2.19 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 -176.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.49 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 17.4 p-10 -57.03 -52.0 67.0 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 126.111 2.863 . . . . 0.0 111.234 -175.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -75.09 15.58 0.4 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 113.091 -1.868 . . . . 0.0 113.31 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -118.09 143.44 32.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-O 117.06 -1.448 . . . . 0.0 109.634 155.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -71.05 21.66 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.847 1 C-N-CA 125.823 4.349 . . . . 0.0 114.25 -171.379 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.65 -21.42 64.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 110.235 151.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 8.5 tt -128.72 -75.97 0.56 Allowed 'General case' 0 C--N 1.343 0.295 0 C-N-CA 125.743 1.617 . . . . 0.0 108.792 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 35.5 t -132.41 -76.42 0.5 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.6 t60 58.32 -48.73 0.05 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.118 2.167 . . . . 0.0 115.0 -160.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -146.69 159.43 43.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.459 1.503 . . . . 0.0 111.094 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 . . . . . 0 CA--C 1.539 0.524 0 C-N-CA 123.78 0.832 . . . . 0.0 110.322 179.502 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.132 0 CA-C-O 119.767 -0.463 . . . . 0.0 114.039 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.3 m -71.93 145.48 89.16 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 117.969 0.885 . . . . 0.0 111.253 172.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -70.54 148.75 60.7 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 122.434 2.089 . . . . 0.0 112.839 -178.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.79 77.75 3.3 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 124.294 3.329 . . . . 0.0 110.561 174.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 62.5 mt-30 -69.02 63.01 0.12 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.626 1.97 . . . . 0.0 114.275 -174.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 0.1 OUTLIER 121.84 -52.81 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.197 1 C-N-CA 134.884 5.274 . . . . 0.0 108.232 -177.493 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -143.43 168.02 14.06 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.694 2.398 . . . . 0.0 107.276 175.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -72.91 72.14 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.99 2.46 . . . . 0.0 112.187 178.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.53 41.7 0.04 OUTLIER Glycine 0 CA--C 1.531 1.035 0 C-N-CA 124.8 1.19 . . . . 0.0 114.652 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -136.2 -172.1 3.05 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.158 1.383 . . . . 0.0 111.578 -168.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -127.13 141.95 51.63 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 111.819 -3.943 . . . . 0.0 112.715 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.404 ' HA ' ' O ' ' A' ' 17' ' ' ARG . . . -121.8 140.36 52.46 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 128.301 3.501 . . . . 0.0 114.861 166.749 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . 0.416 ' SG ' ' HB3' ' A' ' 15' ' ' ASN . 27.6 t -86.16 126.9 34.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.266 3.426 . . . . 0.0 110.674 -175.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.91 -15.69 5.36 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 173.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.416 ' HB3' ' SG ' ' A' ' 13' ' ' CYS . 28.4 t-20 -67.88 -26.22 65.9 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 120.392 1.451 . . . . 0.0 112.069 167.359 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m 127.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.475 1 C-N-CA 131.938 4.095 . . . . 0.0 111.317 164.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.404 ' O ' ' HA ' ' A' ' 12' ' ' ALA . 1.4 mmm180 -132.38 133.21 43.67 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -166.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 p -99.37 123.74 43.9 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 117.623 -3.173 . . . . 0.0 111.043 169.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.66 169.37 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-O 115.286 -2.292 . . . . 0.0 111.183 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.4 ' CD ' ' H ' ' A' ' 20' ' ' GLN . 0.4 OUTLIER -88.23 147.39 24.86 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.195 2.809 . . . . 0.0 114.279 -173.147 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -53.25 -18.33 2.31 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 129.045 2.938 . . . . 0.0 115.224 -169.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.75 -33.8 3.25 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 121.215 1.825 . . . . 0.0 110.963 163.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -85.87 -8.56 57.98 Favored 'General case' 0 CA--C 1.558 1.26 0 CA-C-O 124.761 2.219 . . . . 0.0 109.825 -167.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -76.23 108.02 8.88 Favored 'General case' 0 C--N 1.351 0.67 0 O-C-N 117.543 -3.223 . . . . 0.0 110.525 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.0 p 41.19 58.78 2.5 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -169.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -80.17 -27.0 39.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.891 143.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.6 4.37 67.9 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.103 -1.387 . . . . 0.0 113.555 -165.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.11 123.52 27.43 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 124.017 1.865 . . . . 0.0 108.139 168.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -52.71 -24.66 9.09 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 118.894 -2.379 . . . . 0.0 114.154 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 28.54 -48.41 0.0 OUTLIER 'General case' 0 C--N 1.347 0.467 1 C-N-CA 139.61 7.164 . . . . 0.0 114.65 175.149 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.5 t -70.47 -20.92 62.84 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 127.444 2.297 . . . . 0.0 115.915 168.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 70.36 -30.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.939 2.096 . . . . 0.0 113.236 -176.365 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.27 -13.83 59.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 128.083 2.553 . . . . 0.0 111.415 170.69 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.9 m120 48.62 88.83 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.702 2.001 . . . . 0.0 110.814 -159.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.6 m -98.34 -68.24 0.81 Allowed 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -26.65 -66.6 0.06 Allowed 'General case' 0 C--O 1.248 1.009 0 CA-C-O 127.734 3.635 . . . . 0.0 111.952 153.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -91.46 25.81 2.49 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.634 -172.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -112.93 139.94 23.51 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 115.268 -2.301 . . . . 0.0 108.799 148.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.75 21.76 0.14 Allowed 'Trans proline' 0 CA--C 1.545 1.026 1 C-N-CA 125.789 4.326 . . . . 0.0 114.356 -175.173 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.32 -20.59 60.76 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.107 0.963 . . . . 0.0 110.27 154.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 tt -121.58 -81.11 0.63 Allowed 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.268 1.427 . . . . 0.0 108.782 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.2 t -146.37 -43.0 0.2 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 54.67 89.69 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 121.167 1.803 . . . . 0.0 114.626 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -63.71 -44.94 92.13 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 3.5 t60 . . . . . 0 N--CA 1.468 0.44 0 C-N-CA 125.858 1.663 . . . . 0.0 112.672 176.885 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.264 0 CA-C-O 119.863 -0.409 . . . . 0.0 114.073 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.0 p -62.27 121.45 66.56 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.148 1.379 . . . . 0.0 110.861 174.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -63.71 115.95 3.37 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 122.952 2.435 . . . . 0.0 110.419 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -68.85 -54.23 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.056 2.504 . . . . 0.0 112.432 -168.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 61.84 -43.51 0.15 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.384 2.674 . . . . 0.0 115.497 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.1 -68.17 0.85 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.982 1.713 . . . . 0.0 108.151 160.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -145.25 162.01 39.23 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 126.73 2.012 . . . . 0.0 108.759 177.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.93 75.18 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.349 2.699 . . . . 0.0 112.25 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.6 21.64 0.03 OUTLIER Glycine 0 CA--C 1.531 1.087 0 C-N-CA 125.006 1.289 . . . . 0.0 115.632 -176.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.53 -171.45 2.38 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.658 1.229 . . . . 0.0 112.318 -165.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -106.6 122.34 46.14 Favored 'General case' 0 CA--C 1.557 1.223 1 CA-C-O 128.768 4.127 . . . . 0.0 116.109 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.15 106.18 18.34 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 118.385 -2.697 . . . . 0.0 112.891 170.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 t -82.59 124.71 30.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.716 1.606 . . . . 0.0 111.173 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.08 -14.75 1.7 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -35.81 81.88 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.186 1.357 . . . . 0.0 111.079 166.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.9 m 132.45 49.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.282 1 C-N-CA 132.284 4.233 . . . . 0.0 111.488 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -125.11 135.8 53.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 116.037 1.866 . . . . 0.0 116.037 -167.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.96 120.12 37.8 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.688 -1.883 . . . . 0.0 110.944 163.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.09 171.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 114.532 -2.651 . . . . 0.0 106.37 171.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -94.7 147.04 23.72 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 128.502 3.626 . . . . 0.0 113.287 -168.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -59.38 -15.92 19.65 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 126.759 2.537 . . . . 0.0 114.333 -168.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -48.57 -25.89 1.95 Allowed 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.336 -1.477 . . . . 0.0 112.84 163.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -98.97 -2.84 36.42 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-O 126.227 2.917 . . . . 0.0 109.876 -171.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -79.38 121.92 25.75 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 116.209 -4.057 . . . . 0.0 109.45 168.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.271 1.9 p 45.07 51.56 8.84 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -172.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.8 -16.16 28.82 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 164.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.403 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 107.54 -11.54 39.14 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-O 115.721 -2.71 . . . . 0.0 116.484 -172.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -117.35 145.12 44.26 Favored 'General case' 0 N--CA 1.477 0.911 1 CA-C-O 129.27 4.367 . . . . 0.0 117.342 -178.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.507 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.78 55.59 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 O-C-N 118.044 -2.91 . . . . 0.0 111.145 170.104 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -31.48 62.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.532 1.933 . . . . 0.0 109.857 173.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.5 t -76.12 -15.05 60.16 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 127.928 2.491 . . . . 0.0 115.662 174.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.2 -39.2 0.14 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.653 2.381 . . . . 0.0 113.732 -167.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -16.64 62.82 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.26 2.224 . . . . 0.0 111.256 175.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 49.7 78.76 0.09 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.359 2.264 . . . . 0.0 110.297 -166.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.6 m -84.75 -76.49 0.31 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 115.386 -2.245 . . . . 0.0 105.421 167.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.412 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -22.55 -71.02 0.02 OUTLIER 'General case' 0 C--O 1.247 0.956 2 C-N-CA 134.936 5.294 . . . . 0.0 112.698 179.963 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.403 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 41.4 mm-40 -73.44 7.01 2.55 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 110.761 -2.927 . . . . 0.0 114.248 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.68 143.18 34.34 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 116.483 -1.722 . . . . 0.0 108.419 167.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.73 20.72 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.907 1 C-N-CA 125.904 4.403 . . . . 0.0 114.149 -170.767 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.25 -21.14 63.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.104 0.562 . . . . 0.0 110.132 152.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 36' ' ' ASP . 6.2 tt -126.64 -77.79 0.58 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 125.61 1.564 . . . . 0.0 109.414 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 49.0 t -136.25 -62.94 0.65 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 57.86 -55.83 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 126.621 1.968 . . . . 0.0 115.584 -166.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 58.15 -23.79 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 129.935 3.294 . . . . 0.0 116.543 -175.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 24.6 t60 . . . . . 0 CA--C 1.532 0.282 0 C-N-CA 127.109 2.164 . . . . 0.0 112.939 175.686 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.077 0 N-CA-C 112.214 -0.354 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.0 t -150.32 143.13 16.22 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.16 1.384 . . . . 0.0 109.484 177.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.17 115.21 4.18 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.122 2.548 . . . . 0.0 110.763 177.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.83 -49.6 0.71 Allowed 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.807 2.338 . . . . 0.0 112.207 -176.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.473 ' NE2' ' H ' ' A' ' 12' ' ' ALA . 61.4 mt-30 63.93 110.89 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.042 2.137 . . . . 0.0 112.255 177.545 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 66.94 -59.49 0.38 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 128.134 2.574 . . . . 0.0 113.831 -176.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -141.74 -166.2 0.12 Allowed Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.07 3.348 . . . . 0.0 105.889 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.94 79.99 3.09 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 CA-C-N 123.99 2.461 . . . . 0.0 110.404 170.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 126.64 45.95 0.22 Allowed Glycine 0 C--N 1.348 1.206 0 N-CA-C 119.224 2.45 . . . . 0.0 119.224 169.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -125.83 -156.96 0.76 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.194 1.997 . . . . 0.0 111.228 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -114.93 126.84 55.25 Favored 'General case' 0 CA--C 1.558 1.288 1 CA-C-O 128.975 4.226 . . . . 0.0 116.785 174.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.473 ' H ' ' NE2' ' A' ' 5' ' ' GLN . . . -103.93 111.68 24.33 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 117.995 -2.941 . . . . 0.0 111.92 173.369 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.2 t -84.39 125.56 32.43 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 128.626 2.77 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.02 -13.47 2.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 174.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -66.4 -30.51 70.9 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.764 1.62 . . . . 0.0 111.768 165.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m 127.56 51.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.322 1 C-N-CA 132.258 4.223 . . . . 0.0 110.558 169.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -130.12 138.03 50.47 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 123.71 1.719 . . . . 0.0 115.389 -165.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.444 0.5 OUTLIER -111.3 119.83 40.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 118.577 -2.577 . . . . 0.0 114.12 168.439 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.75 162.36 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 128.527 2.731 . . . . 0.0 105.418 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -86.35 147.13 26.18 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 128.579 3.674 . . . . 0.0 112.906 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -60.41 -13.81 15.49 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 128.102 2.561 . . . . 0.0 113.987 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -35.83 3.01 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 119.75 -1.844 . . . . 0.0 111.336 160.223 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -90.26 -3.72 57.62 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-O 124.864 2.269 . . . . 0.0 108.883 -166.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -79.49 124.47 28.51 Favored 'General case' 0 C--N 1.358 0.948 0 O-C-N 117.765 -3.084 . . . . 0.0 109.509 165.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.5 p 37.88 65.62 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.942 2.097 . . . . 0.0 116.234 -163.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.5 p30 -99.2 -4.21 32.59 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 160.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 75.84 12.71 83.71 Favored Glycine 0 CA--C 1.538 1.531 0 CA-C-O 116.55 -2.25 . . . . 0.0 115.089 -162.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -105.76 122.79 46.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.769 2.785 . . . . 0.0 112.908 177.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -24.59 -50.02 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 127.52 2.328 . . . . 0.0 113.633 162.46 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 30.75 -49.55 0.0 OUTLIER 'General case' 0 C--N 1.352 0.682 1 C-N-CA 139.109 6.964 . . . . 0.0 114.621 -179.56 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.0 t -66.21 -23.19 66.39 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 129.42 3.088 . . . . 0.0 115.384 167.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.46 -29.55 0.18 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.638 1.975 . . . . 0.0 113.563 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -19.4 61.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.177 1.791 . . . . 0.0 110.494 164.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.7 t30 45.61 87.55 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.808 1.643 . . . . 0.0 110.812 -155.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.6 m -86.26 -73.86 0.44 Allowed 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 114.44 -2.695 . . . . 0.0 104.157 163.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.449 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -59.83 -44.51 94.01 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 128.029 3.33 . . . . 0.0 111.137 -154.559 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -74.94 6.15 4.39 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 119.27 -2.143 . . . . 0.0 111.907 -173.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -104.12 135.62 19.31 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 116.656 -1.64 . . . . 0.0 108.044 161.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.79 20.28 0.15 Allowed 'Trans proline' 0 C--N 1.356 0.957 1 C-N-CA 126.459 4.772 . . . . 0.0 114.303 -171.932 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 -23.16 65.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.298 0.639 . . . . 0.0 110.308 152.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 8.5 tt -125.89 -79.98 0.61 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.99 1.716 . . . . 0.0 108.936 177.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 21.3 t -157.26 118.3 3.62 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -128.64 108.03 10.17 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 120.539 -1.351 . . . . 0.0 109.039 172.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -142.28 114.55 8.31 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.679 0.792 . . . . 0.0 110.218 -174.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 23.9 m80 . . . . . 0 CA--C 1.534 0.346 0 C-N-CA 124.956 1.303 . . . . 0.0 111.519 175.922 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.171 0 N-CA-C 112.368 -0.293 . . . . 0.0 112.368 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 t 75.11 126.25 0.03 OUTLIER Pre-proline 0 N--CA 1.473 0.718 0 C-N-CA 127.781 2.433 . . . . 0.0 111.609 -170.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -68.49 111.74 2.63 Favored 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.151 1.901 . . . . 0.0 108.45 173.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -79.77 -63.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.594 2.196 . . . . 0.0 114.437 -155.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 57.62 -52.67 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.119 2.568 . . . . 0.0 115.623 -171.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.26 -64.64 1.09 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.345 1.458 . . . . 0.0 109.973 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -149.76 158.74 37.09 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.931 2.092 . . . . 0.0 108.0 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -64.14 92.8 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.443 2.762 . . . . 0.0 112.225 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.61 -17.97 2.62 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 126.033 1.778 . . . . 0.0 114.482 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -78.68 -167.94 1.25 Allowed 'General case' 0 C--O 1.239 0.525 0 C-N-CA 125.435 1.494 . . . . 0.0 111.753 -171.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -113.43 120.94 42.78 Favored 'General case' 0 CA--C 1.561 1.368 1 CA-C-O 129.143 4.306 . . . . 0.0 116.323 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.93 109.18 20.62 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 117.955 -2.965 . . . . 0.0 112.642 167.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.01 29.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.898 1.679 . . . . 0.0 110.888 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -12.05 3.55 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -65.29 -31.56 72.76 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.739 1.609 . . . . 0.0 111.845 164.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.5 m 128.55 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 C-N-CA 132.131 4.172 . . . . 0.0 110.61 170.213 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -129.19 134.8 48.17 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 124.079 1.895 . . . . 0.0 115.311 -168.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.37 119.8 36.57 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 119.044 -2.285 . . . . 0.0 110.731 161.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.71 160.82 39.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 115.019 -2.42 . . . . 0.0 105.979 170.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -83.1 150.47 26.27 Favored 'General case' 0 N--CA 1.448 -0.532 1 O-C-N 129.379 4.174 . . . . 0.0 112.515 -173.605 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.404 ' HG3' ' HE2' ' A' ' 24' ' ' LYS . 6.8 tt0 -49.73 -24.56 2.38 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 127.42 2.95 . . . . 0.0 115.119 -171.438 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -38.55 7.23 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 121.441 1.928 . . . . 0.0 110.183 169.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -83.6 -7.99 59.4 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-O 124.781 2.229 . . . . 0.0 108.089 -163.306 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.404 ' HE2' ' HG3' ' A' ' 21' ' ' GLU . 43.0 mtmt -77.02 131.44 38.43 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 118.006 -2.934 . . . . 0.0 110.381 166.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 m 63.4 17.59 10.41 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.031 2.132 . . . . 0.0 114.457 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.43 -11.19 59.92 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 128.193 2.597 . . . . 0.0 113.382 -165.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.37 6.59 85.88 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 116.45 -2.306 . . . . 0.0 114.908 -173.261 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.88 146.6 43.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 128.438 3.97 . . . . 0.0 117.061 175.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.506 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -64.65 48.42 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.43 2.692 . . . . 0.0 111.363 165.262 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -45.31 -34.71 3.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.958 2.503 . . . . 0.0 110.247 164.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 t -78.99 -14.89 58.93 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 128.4 2.68 . . . . 0.0 115.097 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.19 -30.16 0.08 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.386 2.275 . . . . 0.0 114.945 -172.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -20.87 46.1 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 127.542 2.337 . . . . 0.0 110.601 171.206 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 52.83 82.31 0.07 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.123 1.769 . . . . 0.0 109.909 -163.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -88.56 -72.49 0.54 Allowed 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 113.814 -2.994 . . . . 0.0 103.885 168.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.493 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -59.57 -45.04 93.01 Favored 'General case' 0 C--O 1.241 0.618 0 O-C-N 127.921 3.263 . . . . 0.0 111.654 -156.927 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -70.97 5.41 2.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.29 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.78 140.72 25.05 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 117.016 -1.469 . . . . 0.0 108.941 165.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -71.13 21.45 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.859 1 C-N-CA 126.034 4.489 . . . . 0.0 114.162 -170.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -22.25 65.45 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.956 -0.465 . . . . 0.0 110.231 151.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.518 HD23 ' HB2' ' A' ' 42' ' ' CYS . 8.9 tt -129.15 -76.19 0.55 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 125.983 1.713 . . . . 0.0 109.201 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.518 ' HB2' HD23 ' A' ' 41' ' ' LEU . 7.3 t -134.57 -65.76 0.63 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 116.056 1.872 . . . . 0.0 116.056 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.568 ' CG ' ' H ' ' A' ' 44' ' ' GLN . 28.7 t60 56.78 -170.07 0.09 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.606 1.162 . . . . 0.0 113.121 -160.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.568 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 3.1 mm100 22.87 87.49 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 130.877 3.671 . . . . 0.0 116.634 175.228 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 9.2 m-70 . . . . . 0 CA--C 1.535 0.374 0 C-N-CA 126.067 1.747 . . . . 0.0 111.939 172.572 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 122.058 0.932 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.469 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 13.6 mt-30 -129.8 -174.59 0.39 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.171 3.388 . . . . 0.0 105.068 168.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -77.37 66.7 7.87 Favored 'Trans proline' 0 CA--C 1.549 1.269 0 CA-C-N 123.717 2.363 . . . . 0.0 112.867 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.01 59.89 0.04 OUTLIER Glycine 0 C--N 1.345 1.064 0 C-N-CA 124.345 0.974 . . . . 0.0 115.065 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.469 ' HG3' ' H ' ' A' ' 7' ' ' GLN . 6.2 mm-40 -133.29 -158.9 0.92 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.069 1.348 . . . . 0.0 111.495 -166.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -121.86 127.81 50.92 Favored 'General case' 0 CA--C 1.569 1.703 1 CA-C-O 129.295 4.379 . . . . 0.0 117.879 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.33 111.63 23.96 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 117.154 -3.466 . . . . 0.0 112.275 171.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 38.1 t -87.35 127.98 35.19 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.971 1.708 . . . . 0.0 111.017 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.64 -11.45 4.95 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -63.38 -28.37 69.94 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.858 1.663 . . . . 0.0 112.032 163.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.7 m 126.55 45.42 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.425 1 C-N-CA 132.239 4.215 . . . . 0.0 110.885 166.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.8 mmm-85 -126.53 135.94 51.95 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 123.706 1.717 . . . . 0.0 114.641 -158.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -97.99 116.46 30.25 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 119.791 -1.818 . . . . 0.0 110.519 166.08 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.42 HG21 ' CZ3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -139.07 176.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 115.381 -2.247 . . . . 0.0 105.733 174.486 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -103.15 149.4 24.68 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 128.501 3.626 . . . . 0.0 112.429 -162.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -53.16 -19.36 2.9 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 127.714 3.134 . . . . 0.0 113.942 -167.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.38 -42.0 9.69 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.668 1.576 . . . . 0.0 109.632 169.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.944 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 9.3 m0 -73.49 -17.58 61.21 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 123.928 1.823 . . . . 0.0 108.386 -163.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' HB2' ' A' ' 36' ' ' ASP . 46.1 mtmt -80.47 110.1 15.61 Favored 'General case' 0 C--N 1.357 0.917 0 O-C-N 119.879 -1.763 . . . . 0.0 108.881 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 m 71.85 24.35 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.63 1.172 . . . . 0.0 112.376 -170.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.433 ' OD1' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -77.57 -30.36 52.55 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.667 -1.271 . . . . 0.0 110.752 173.118 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.79 -1.41 71.3 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 117.609 -1.662 . . . . 0.0 114.137 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 30' ' ' ASP . 38.7 t70 -96.09 150.58 20.34 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 125.944 2.783 . . . . 0.0 111.891 162.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -48.92 -42.42 37.11 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 111.842 -2.436 . . . . 0.0 113.018 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 28' ' ' ASP . 17.1 t0 59.61 -60.89 0.05 Allowed 'General case' 0 N--CA 1.477 0.904 1 C-N-CA 133.174 4.59 . . . . 0.0 110.914 151.398 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.6 t -52.11 -20.33 2.44 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 128.146 2.579 . . . . 0.0 116.942 150.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -34.03 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.646 1.978 . . . . 0.0 113.035 -172.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -12.1 53.53 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.885 1.674 . . . . 0.0 110.816 172.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.79 63.86 1.92 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.862 1.665 . . . . 0.0 109.951 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 m -85.68 -56.1 3.66 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.944 ' OD2' ' O ' ' A' ' 23' ' ' TRP . 16.7 p-10 -55.8 -47.26 77.43 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 126.411 3.005 . . . . 0.0 110.655 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.499 ' OE2' ' OD2' ' A' ' 36' ' ' ASP 0.261 8.9 mm-40 -83.6 17.89 2.08 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 119.13 -2.231 . . . . 0.0 113.468 -178.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.44 132.85 20.56 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-O 116.76 -1.59 . . . . 0.0 108.06 150.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.89 20.99 0.18 Allowed 'Trans proline' 0 CA--C 1.542 0.878 1 C-N-CA 126.177 4.585 . . . . 0.0 114.334 -169.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.28 -22.22 64.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.314 0.646 . . . . 0.0 110.378 152.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 9.6 tt -120.61 -74.39 0.61 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.471 1.508 . . . . 0.0 108.935 177.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.0 t -139.92 -70.12 0.4 Allowed 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 116.311 1.967 . . . . 0.0 116.311 176.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER . . . . . 0 N--CA 1.473 0.684 0 C-N-CA 126.532 1.933 . . . . 0.0 114.197 -164.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.3 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -145.01 167.7 13.96 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 128.162 2.585 . . . . 0.0 107.33 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.44 70.66 4.79 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.154 2.57 . . . . 0.0 112.913 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.18 46.02 0.03 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.898 1.237 . . . . 0.0 113.756 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -133.3 -172.69 3.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.606 1.162 . . . . 0.0 112.155 -166.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -109.86 124.55 51.53 Favored 'General case' 0 CA--C 1.56 1.354 1 CA-C-O 128.681 4.086 . . . . 0.0 116.449 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.4 108.11 20.73 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 118.421 -2.674 . . . . 0.0 112.627 170.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.0 t -85.55 125.01 32.76 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.51 1.524 . . . . 0.0 111.233 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.71 -16.63 4.51 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 173.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -68.5 -24.45 64.67 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 120.635 1.561 . . . . 0.0 112.031 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.7 m 126.28 50.75 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 131.84 4.056 . . . . 0.0 111.221 165.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -128.38 135.72 49.93 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 124.231 1.967 . . . . 0.0 115.53 -166.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.18 121.12 38.72 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 119.353 -2.092 . . . . 0.0 110.413 160.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.34 167.69 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 114.087 -2.863 . . . . 0.0 106.729 173.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -87.24 144.73 26.68 Favored 'General case' 0 N--CA 1.45 -0.469 1 O-C-N 129.395 4.185 . . . . 0.0 113.301 -170.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.54 -16.4 9.89 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 128.122 2.569 . . . . 0.0 114.249 -170.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.0 ttp85 -50.19 -27.13 5.4 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.587 -1.321 . . . . 0.0 112.614 165.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -93.9 -4.34 50.09 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-O 126.33 2.967 . . . . 0.0 109.579 -171.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -78.55 111.29 14.45 Favored 'General case' 0 C--N 1.355 0.814 0 O-C-N 116.471 -3.893 . . . . 0.0 109.029 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.283 8.1 p 41.75 53.27 4.01 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -166.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -76.8 -24.85 52.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 118.756 -0.64 . . . . 0.0 112.269 145.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.6 -8.49 40.31 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-O 117.063 -1.965 . . . . 0.0 115.339 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -98.1 144.77 27.23 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 125.987 2.803 . . . . 0.0 113.887 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.84 58.42 0.33 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 118.616 -2.552 . . . . 0.0 110.878 170.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -56.22 -30.66 62.63 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 127.206 2.202 . . . . 0.0 110.12 175.636 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 51.6 t -80.38 -15.38 56.96 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.69 1.996 . . . . 0.0 115.779 175.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.37 -36.55 0.13 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.321 2.248 . . . . 0.0 114.849 -170.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -19.22 61.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.19 2.596 . . . . 0.0 111.014 169.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.7 74.56 0.44 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.365 2.266 . . . . 0.0 111.003 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.1 m -102.24 -58.41 1.88 Allowed 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.728 0.811 . . . . 0.0 110.237 -177.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.0 OUTLIER -28.6 -67.65 0.07 Allowed 'General case' 0 C--O 1.247 0.923 0 CA-C-O 128.012 3.767 . . . . 0.0 111.631 158.026 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 20.4 mm-40 -86.77 21.0 2.35 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 112.151 -2.295 . . . . 0.0 112.863 -173.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.6 135.52 21.1 Favored Pre-proline 0 CA--C 1.542 0.658 0 CA-C-O 115.085 -2.388 . . . . 0.0 107.994 154.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -68.31 21.66 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.074 1 C-N-CA 125.735 4.29 . . . . 0.0 114.614 -173.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.05 -20.87 60.89 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.052 0.941 . . . . 0.0 110.293 153.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 tt -120.15 -80.5 0.62 Allowed 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.716 1.607 . . . . 0.0 108.576 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 38.8 t -141.74 -54.36 0.45 Allowed 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 32.2 t-80 . . . . . 0 N--CA 1.476 0.871 0 C-N-CA 125.536 1.534 . . . . 0.0 114.777 -171.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.411 0 CA-C-O 120.973 0.416 . . . . 0.0 110.477 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -150.13 167.83 12.22 Favored Pre-proline 0 CA--C 1.552 1.019 0 C-N-CA 128.883 2.873 . . . . 0.0 106.908 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.66 76.89 1.45 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 123.323 2.682 . . . . 0.0 113.461 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.7 43.8 0.07 OUTLIER Glycine 0 N--CA 1.473 1.115 0 C-N-CA 124.441 1.02 . . . . 0.0 114.577 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -128.25 -174.51 3.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.271 1.035 . . . . 0.0 113.181 -162.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -109.14 121.29 44.83 Favored 'General case' 0 CA--C 1.563 1.465 1 CA-C-O 128.964 4.221 . . . . 0.0 116.214 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.8 107.79 20.32 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 118.223 -2.798 . . . . 0.0 112.75 172.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.5 t -82.59 124.09 29.82 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.302 1.441 . . . . 0.0 111.508 175.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.83 -12.53 3.18 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 173.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -67.38 -30.62 70.45 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.925 1.693 . . . . 0.0 111.684 165.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.9 m 128.03 53.78 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.273 1 C-N-CA 132.186 4.194 . . . . 0.0 110.741 170.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -129.28 132.16 47.12 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-O 124.341 2.02 . . . . 0.0 114.835 -167.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -101.49 117.57 35.19 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 118.739 -2.476 . . . . 0.0 110.212 167.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.18 169.41 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 114.961 -2.447 . . . . 0.0 105.987 172.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.98 154.45 18.15 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.547 3.029 . . . . 0.0 113.704 -171.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.05 -15.38 31.74 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 127.162 2.789 . . . . 0.0 114.196 -168.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -43.27 -33.52 0.99 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.545 -1.347 . . . . 0.0 112.82 160.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -95.41 -0.29 52.64 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 125.704 2.669 . . . . 0.0 111.825 -171.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HG2' HD21 ' A' ' 41' ' ' LEU . 18.6 mttt -79.44 101.06 7.96 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 117.398 -3.314 . . . . 0.0 108.807 173.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.337 21.2 p 49.76 57.84 6.09 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -165.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.1 p30 -75.61 -23.03 56.38 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.679 137.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.87 9.71 65.71 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-O 117.668 -1.629 . . . . 0.0 113.932 -168.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -93.98 135.37 35.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.321 2.06 . . . . 0.0 110.949 171.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -29.29 -13.81 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 1 C-N-CA 132.344 4.258 . . . . 0.0 119.523 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.553 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 3.0 p30 -80.13 -23.86 40.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 123.591 1.663 . . . . 0.0 109.566 -85.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.5 t -56.11 -21.62 23.37 Favored 'General case' 0 N--CA 1.429 -1.494 1 C-N-CA 132.272 4.229 . . . . 0.0 116.176 164.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 69.66 -29.77 0.18 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.663 2.385 . . . . 0.0 113.494 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -16.66 62.3 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.637 1.975 . . . . 0.0 110.545 157.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.19 64.24 1.93 Allowed 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 126.17 1.788 . . . . 0.0 110.233 -176.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.5 m -73.56 -64.85 0.91 Allowed 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 176.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.765 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -39.29 -63.8 0.52 Allowed 'General case' 0 N--CA 1.441 -0.884 2 C-N-CA 132.752 4.421 . . . . 0.0 110.524 -177.998 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -84.81 21.34 1.58 Allowed 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 111.036 -2.802 . . . . 0.0 112.544 -172.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.68 139.52 26.42 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 116.136 -1.888 . . . . 0.0 108.428 153.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -69.12 20.72 0.15 Allowed 'Trans proline' 0 CA--C 1.542 0.886 1 C-N-CA 125.875 4.383 . . . . 0.0 114.596 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.65 -21.29 63.55 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.213 0.605 . . . . 0.0 110.388 152.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.765 HD22 ' HA ' ' A' ' 36' ' ' ASP . 8.1 tt -123.66 -76.07 0.59 Allowed 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.917 1.687 . . . . 0.0 108.786 178.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.4 t -139.74 -67.12 0.44 Allowed 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.6 t60 . . . . . 0 N--CA 1.474 0.739 0 C-N-CA 126.626 1.97 . . . . 0.0 115.043 -161.097 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.289 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -139.25 168.96 13.53 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 128.471 2.708 . . . . 0.0 107.454 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.2 73.31 4.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.816 2.344 . . . . 0.0 113.082 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.41 46.58 0.02 OUTLIER Glycine 0 CA--C 1.528 0.904 0 C-N-CA 125.305 1.431 . . . . 0.0 112.988 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -134.99 -176.83 4.38 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.663 1.185 . . . . 0.0 112.47 -165.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -105.75 121.96 45.1 Favored 'General case' 0 CA--C 1.56 1.349 1 CA-C-O 128.689 4.09 . . . . 0.0 116.268 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -97.38 107.37 19.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 118.353 -2.717 . . . . 0.0 112.58 171.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.5 t -86.97 126.59 34.82 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.832 1.653 . . . . 0.0 111.725 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.48 -13.18 3.3 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 115.866 1.802 . . . . 0.0 115.866 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -66.77 -28.59 68.52 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.759 1.618 . . . . 0.0 111.744 165.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.4 m 128.36 48.49 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.382 1 C-N-CA 132.133 4.173 . . . . 0.0 110.912 166.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -126.85 136.04 51.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 124.265 1.983 . . . . 0.0 115.069 -162.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 120.01 37.34 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 119.406 -2.059 . . . . 0.0 110.326 163.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.6 170.82 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 114.501 -2.666 . . . . 0.0 106.341 172.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -94.07 147.44 23.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 128.439 3.587 . . . . 0.0 113.407 -168.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -53.59 -20.57 5.3 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 127.603 3.064 . . . . 0.0 113.809 -169.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -50.46 -28.52 8.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.948 0.899 . . . . 0.0 112.265 167.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -92.82 -5.41 51.12 Favored 'General case' 0 CA--C 1.565 1.52 0 CA-C-O 126.751 3.167 . . . . 0.0 109.237 -170.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB3' HD21 ' A' ' 41' ' ' LEU . 34.7 mtpt -80.16 102.5 9.44 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 116.368 -3.958 . . . . 0.0 108.493 171.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.294 21.1 p 45.99 60.04 3.4 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -165.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -71.07 -26.91 63.27 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.444 -1.253 . . . . 0.0 112.482 133.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.0 19.73 20.75 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-O 116.238 -2.423 . . . . 0.0 115.248 -172.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -128.74 152.46 48.4 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 126.726 3.155 . . . . 0.0 115.139 169.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.497 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.23 52.83 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 O-C-N 118.567 -2.583 . . . . 0.0 111.765 171.168 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.629 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.6 OUTLIER -55.63 -29.54 59.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.368 1.867 . . . . 0.0 110.033 176.11 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.3 t -78.72 -13.55 59.75 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 127.572 2.349 . . . . 0.0 116.129 175.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.6 -34.51 0.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.991 2.116 . . . . 0.0 114.837 -172.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.63 -22.14 59.08 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 128.275 2.63 . . . . 0.0 111.074 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 56.97 86.41 0.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.358 2.263 . . . . 0.0 111.31 -168.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -105.05 -61.77 1.43 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.174 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.696 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -29.97 -67.46 0.08 Allowed 'General case' 0 C--O 1.246 0.873 1 CA-C-O 128.699 4.095 . . . . 0.0 111.763 166.634 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -86.18 17.87 3.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.069 -2.332 . . . . 0.0 112.906 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.94 139.35 20.57 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.032 156.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -68.09 20.69 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.864 1 C-N-CA 126.323 4.682 . . . . 0.0 114.27 -173.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.36 -20.7 59.99 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.127 0.971 . . . . 0.0 110.421 155.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.696 HD22 ' HA ' ' A' ' 36' ' ' ASP . 9.3 tt -125.76 -76.62 0.58 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.94 1.296 . . . . 0.0 109.218 -176.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 47.6 t -138.53 -71.23 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 171.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 24.1 t60 . . . . . 0 CA--C 1.545 0.781 0 C-N-CA 125.83 1.652 . . . . 0.0 113.721 -162.579 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.2 t . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 122.247 1.022 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -132.09 -179.65 1.12 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.394 3.478 . . . . 0.0 105.033 171.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -74.88 69.42 5.45 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.23 2.189 . . . . 0.0 113.165 -174.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.08 54.29 0.05 OUTLIER Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.94 1.257 . . . . 0.0 114.814 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -133.28 -165.94 1.69 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.766 1.283 . . . . 0.0 112.723 -166.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -117.41 125.08 50.36 Favored 'General case' 0 CA--C 1.564 1.502 1 CA-C-O 128.848 4.166 . . . . 0.0 118.205 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.3 107.09 18.35 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 117.725 -3.109 . . . . 0.0 112.678 171.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.35 127.02 31.96 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.851 1.26 . . . . 0.0 109.927 170.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.54 -21.91 19.11 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 170.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -7.3 38.02 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 119.849 1.204 . . . . 0.0 112.416 168.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.5 m 106.91 53.45 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.893 1 C-N-CA 132.059 4.144 . . . . 0.0 110.392 160.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.6 mmm-85 -130.76 131.26 44.62 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 123.063 1.411 . . . . 0.0 114.526 -166.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.332 0.1 OUTLIER -101.56 115.08 29.71 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 119.65 -1.906 . . . . 0.0 111.706 168.471 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -136.41 170.68 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 115.553 -2.165 . . . . 0.0 105.635 174.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -97.76 155.38 17.05 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 128.167 3.417 . . . . 0.0 112.958 -167.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -58.63 -16.9 18.12 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 127.271 2.857 . . . . 0.0 114.626 -163.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.54 -41.11 4.31 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.089 1.768 . . . . 0.0 110.787 163.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -84.58 -7.95 59.07 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 125.97 2.795 . . . . 0.0 108.61 -164.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.562 ' HG2' HD21 ' A' ' 41' ' ' LEU . 13.8 mttt -77.98 123.39 26.75 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 117.107 -3.496 . . . . 0.0 107.401 164.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 m 78.97 11.63 1.46 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.864 1.665 . . . . 0.0 114.862 168.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.575 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 34.2 p-10 -83.79 -3.61 57.98 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.07 -1.644 . . . . 0.0 112.239 -179.004 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 77.38 10.33 86.31 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-O 117.762 -1.577 . . . . 0.0 114.35 -175.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -103.86 125.69 50.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 124.188 1.947 . . . . 0.0 112.347 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.569 ' ND2' HD22 ' A' ' 34' ' ' ASN . 0.0 OUTLIER -67.77 56.93 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 118.828 -2.42 . . . . 0.0 110.801 163.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.581 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -57.06 -31.75 65.53 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.972 2.509 . . . . 0.0 109.459 175.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.0 t -75.7 -14.49 60.34 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.734 2.414 . . . . 0.0 115.619 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.16 -35.75 0.17 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.325 2.25 . . . . 0.0 114.485 -172.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.66 61.57 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 128.206 2.602 . . . . 0.0 110.774 171.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.569 HD22 ' ND2' ' A' ' 29' ' ' ASN . 22.2 t-20 54.58 80.75 0.12 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.824 2.05 . . . . 0.0 110.413 -164.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 m -86.12 -76.45 0.34 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 115.335 -2.269 . . . . 0.0 105.334 170.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.692 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -22.49 -70.68 0.02 OUTLIER 'General case' 0 N--CA 1.441 -0.889 2 C-N-CA 134.074 4.95 . . . . 0.0 111.411 175.331 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.575 ' OE2' ' OD1' ' A' ' 26' ' ' ASP . 28.4 mm-40 -80.74 16.27 1.47 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 111.871 -2.422 . . . . 0.0 113.228 -167.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.52 140.5 30.48 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 116.257 -1.83 . . . . 0.0 108.148 164.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.67 19.99 0.26 Allowed 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.66 4.24 . . . . 0.0 114.224 -168.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.29 -20.47 62.2 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.015 0.526 . . . . 0.0 110.189 153.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.692 HD22 ' HA ' ' A' ' 36' ' ' ASP . 2.3 tt -125.57 -77.09 0.58 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.417 1.487 . . . . 0.0 109.538 174.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 11.9 t -133.28 -61.52 0.82 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 75.3 t60 . . . . . 0 N--CA 1.474 0.768 0 C-N-CA 125.144 1.377 . . . . 0.0 114.199 -162.91 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.471 0.575 0 CA-C-O 121.098 0.475 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -144.74 169.81 9.33 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 129.1 2.96 . . . . 0.0 106.463 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.86 70.0 4.45 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 122.355 2.037 . . . . 0.0 113.336 -174.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.16 40.36 0.03 OUTLIER Glycine 0 CA--C 1.533 1.185 0 C-N-CA 125.318 1.437 . . . . 0.0 115.282 178.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -125.58 -163.42 1.2 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 119.031 1.416 . . . . 0.0 113.145 -164.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -124.17 125.33 44.26 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 128.479 3.99 . . . . 0.0 117.803 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.15 111.35 22.87 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 117.288 -3.383 . . . . 0.0 113.615 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.6 t -82.07 125.03 30.36 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.121 1.769 . . . . 0.0 111.035 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.4 -10.9 3.58 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 174.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -66.22 -30.08 70.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 120.883 1.674 . . . . 0.0 111.635 164.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.8 m 128.11 51.79 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.343 1 C-N-CA 132.076 4.15 . . . . 0.0 110.803 168.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -128.13 134.41 49.11 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 123.839 1.781 . . . . 0.0 114.772 -166.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.272 0.5 OUTLIER -97.89 117.9 33.25 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 119.067 -2.271 . . . . 0.0 110.697 162.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.42 169.74 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-O 114.749 -2.548 . . . . 0.0 106.141 173.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -93.78 146.92 23.52 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 129.04 3.963 . . . . 0.0 112.964 -170.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.32 -16.13 31.9 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 126.926 2.641 . . . . 0.0 113.708 -166.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.3 ttt180 -46.16 -27.88 1.09 Allowed 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.143 -1.598 . . . . 0.0 113.026 162.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -97.47 -9.38 27.32 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 126.244 2.926 . . . . 0.0 110.117 -172.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -75.44 136.24 40.7 Favored 'General case' 0 C--N 1.353 0.735 1 O-C-N 115.92 -4.237 . . . . 0.0 107.916 166.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.1 m 63.75 13.58 7.55 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.74 -35.19 52.14 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.642 -173.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.468 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 106.53 -3.26 36.85 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 117.094 -1.948 . . . . 0.0 114.615 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -105.69 145.28 31.28 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 126.073 2.844 . . . . 0.0 112.487 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.64 60.85 0.35 Allowed 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.43 -2.044 . . . . 0.0 109.23 168.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.737 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 1.2 p30 -59.0 -25.68 63.86 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.352 1.861 . . . . 0.0 110.144 -179.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.8 t -78.08 -16.7 57.79 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 129.107 2.963 . . . . 0.0 116.258 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.38 -33.9 0.15 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.796 2.038 . . . . 0.0 115.06 -172.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -20.38 60.43 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.01 2.124 . . . . 0.0 111.057 168.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 51.6 t30 59.23 83.41 0.13 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.837 2.455 . . . . 0.0 112.213 -168.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -103.93 -61.78 1.39 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.737 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.8 OUTLIER -31.1 -67.99 0.09 Allowed 'General case' 0 C--O 1.242 0.702 0 CA-C-O 127.12 3.343 . . . . 0.0 110.529 163.601 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.468 ' CD ' ' H ' ' A' ' 27' ' ' GLY 0.326 3.7 mm-40 -92.02 25.84 2.69 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 119.245 -2.159 . . . . 0.0 112.122 -170.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -108.86 126.84 28.51 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 114.961 -2.447 . . . . 0.0 107.189 151.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.78 19.87 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 125.984 4.456 . . . . 0.0 114.801 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.75 -21.61 61.72 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.934 0.893 . . . . 0.0 110.457 154.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -114.95 -79.5 0.59 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.82 1.648 . . . . 0.0 108.362 173.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 3.7 t -137.28 -60.38 0.67 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 24.8 t-80 . . . . . 0 N--CA 1.473 0.701 0 C-N-CA 125.491 1.517 . . . . 0.0 113.149 -165.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -145.99 167.99 12.82 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.955 2.502 . . . . 0.0 107.427 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 75.34 1.83 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.317 2.678 . . . . 0.0 112.797 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.16 46.73 0.06 OUTLIER Glycine 0 N--CA 1.469 0.885 0 C-N-CA 124.284 0.945 . . . . 0.0 114.064 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -133.75 -172.23 2.92 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.421 1.088 . . . . 0.0 111.861 -168.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -110.38 121.95 46.53 Favored 'General case' 0 CA--C 1.56 1.362 1 CA-C-O 128.882 4.182 . . . . 0.0 116.568 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.16 108.51 21.23 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 118.29 -2.756 . . . . 0.0 112.81 172.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 28.3 t -82.49 122.95 28.71 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 125.822 1.649 . . . . 0.0 111.226 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.49 -19.84 2.51 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -70.98 -22.65 62.16 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.006 1.275 . . . . 0.0 112.366 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.4 m 125.59 51.82 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 1 C-N-CA 131.87 4.068 . . . . 0.0 111.425 166.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -130.46 134.95 47.49 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 124.304 2.002 . . . . 0.0 116.291 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.24 121.36 39.04 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.032 -2.293 . . . . 0.0 110.445 160.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.82 169.2 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 115.064 -2.398 . . . . 0.0 105.836 169.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -95.88 151.03 19.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 127.954 3.284 . . . . 0.0 112.918 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -61.15 -15.8 37.57 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 126.662 2.476 . . . . 0.0 114.096 -166.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -45.65 -25.65 0.5 Allowed 'General case' 0 CA--C 1.55 0.978 0 O-C-N 119.991 -1.693 . . . . 0.0 113.366 160.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -101.67 -4.2 26.95 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 126.265 2.936 . . . . 0.0 110.873 -172.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -78.24 114.41 17.1 Favored 'General case' 0 C--N 1.354 0.78 1 O-C-N 116.082 -4.136 . . . . 0.0 109.028 170.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.25 8.8 p 41.02 55.76 3.09 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -167.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -82.53 -29.63 30.28 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.694 145.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.68 -11.62 42.19 Favored Glycine 0 CA--C 1.534 1.272 0 CA-C-O 117.422 -1.766 . . . . 0.0 115.444 -175.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -81.31 142.33 33.19 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 125.371 2.51 . . . . 0.0 111.535 172.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -45.55 -2.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 130.296 3.438 . . . . 0.0 118.653 -169.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.61 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 3.0 p30 -75.5 -21.42 58.03 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 120.189 -1.569 . . . . 0.0 109.891 -91.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.8 t -61.02 -13.67 18.09 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 130.726 3.61 . . . . 0.0 116.085 164.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.28 -34.1 0.27 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 128.666 2.786 . . . . 0.0 113.248 -174.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -28.42 66.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.655 1.982 . . . . 0.0 110.125 164.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 65.4 81.59 0.2 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.326 2.65 . . . . 0.0 109.689 -169.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.4 m -98.27 -60.84 1.47 Allowed 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.61 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.7 p-10 -28.57 -66.31 0.08 Allowed 'General case' 0 C--O 1.247 0.957 0 CA-C-O 127.551 3.548 . . . . 0.0 112.076 157.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 22.2 mm-40 -87.18 17.76 4.1 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.953 -171.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -109.25 135.34 20.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 CA-C-O 115.214 -2.327 . . . . 0.0 108.047 155.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -68.68 22.98 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.993 1 C-N-CA 125.757 4.305 . . . . 0.0 114.556 -173.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.96 -20.32 60.4 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.997 0.919 . . . . 0.0 110.165 153.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -120.46 -82.51 0.65 Allowed 'General case' 0 C--N 1.344 0.346 0 C-N-CA 125.664 1.585 . . . . 0.0 108.868 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 36.4 t -144.47 -47.91 0.26 Allowed 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 177.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 11.7 t-160 . . . . . 0 N--CA 1.479 1.004 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -179.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t . . . . . 0 N--CA 1.485 1.284 0 CA-C-O 121.968 0.89 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -133.34 179.6 1.33 Allowed Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 130.128 3.371 . . . . 0.0 105.081 170.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -74.81 68.91 5.51 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.423 2.258 . . . . 0.0 113.208 -175.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.73 46.14 0.04 OUTLIER Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.636 1.112 . . . . 0.0 115.702 177.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -128.69 -162.34 1.18 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.119 1.46 . . . . 0.0 112.782 -164.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -121.54 125.98 48.09 Favored 'General case' 0 CA--C 1.563 1.444 1 CA-C-O 128.547 4.022 . . . . 0.0 118.669 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.08 107.35 18.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 117.801 -3.062 . . . . 0.0 113.074 170.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.7 t -74.25 122.87 23.52 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 168.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.48 -22.91 8.83 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 177.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -60.42 -25.83 66.24 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.755 1.622 . . . . 0.0 113.089 170.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.1 m 129.9 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 131.633 3.973 . . . . 0.0 112.317 161.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -125.91 128.58 47.79 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 -164.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.337 0.1 OUTLIER -98.31 116.6 30.88 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 120.237 -1.54 . . . . 0.0 111.951 167.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.25 165.32 31.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 115.249 -2.31 . . . . 0.0 105.768 171.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -88.82 146.56 24.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.922 3.888 . . . . 0.0 112.061 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.4 -21.29 62.05 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 126.805 2.566 . . . . 0.0 113.755 -165.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -40.99 -28.89 0.09 Allowed 'General case' 0 CA--C 1.547 0.849 0 O-C-N 120.394 -1.441 . . . . 0.0 113.359 161.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -102.77 -5.35 23.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 111.853 -3.927 . . . . 0.0 113.622 -171.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HE2' HD11 ' A' ' 41' ' ' LEU . 25.3 mttt -72.43 143.2 48.59 Favored 'General case' 0 C--N 1.363 1.165 1 O-C-N 130.505 4.878 . . . . 0.0 109.168 166.112 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.7 p 31.57 56.89 0.3 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.547 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 3.7 p30 -89.26 -8.95 52.4 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.689 1.196 . . . . 0.0 111.84 157.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.97 10.48 75.29 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 117.099 -1.945 . . . . 0.0 112.975 -163.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -115.87 132.49 56.63 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 126.562 3.077 . . . . 0.0 114.591 -172.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.65 39.55 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 O-C-N 119.797 -1.815 . . . . 0.0 115.137 152.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.28 -47.47 4.79 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.223 2.209 . . . . 0.0 108.602 146.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.7 t -81.7 113.03 19.41 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 154.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.41 -20.7 0.74 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.537 1.535 . . . . 0.0 114.615 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -102.29 -2.99 27.94 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.569 1.077 . . . . 0.0 113.297 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 51.51 68.55 0.78 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.395 1.878 . . . . 0.0 110.245 -166.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 m -77.65 -67.06 0.76 Allowed 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 11.5 p-10 -60.1 -47.21 86.86 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-O 125.796 2.712 . . . . 0.0 113.232 -170.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.547 ' OE2' ' OD1' ' A' ' 26' ' ' ASP . 58.8 mm-40 -61.18 2.41 0.14 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 112.62 -2.082 . . . . 0.0 114.605 172.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.92 141.61 29.5 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 120.178 1.354 . . . . 0.0 109.541 165.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -72.17 21.83 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.823 1 C-N-CA 125.919 4.412 . . . . 0.0 114.192 -168.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.09 -21.07 64.09 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.814 -0.554 . . . . 0.0 110.089 151.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.558 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 10.0 tt -127.21 -77.19 0.57 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 126.257 1.823 . . . . 0.0 108.732 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.2 t -138.13 -61.99 0.59 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 t60 . . . . . 0 CA--C 1.552 1.055 0 C-N-CA 125.743 1.617 . . . . 0.0 114.474 -165.79 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.08 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -142.2 -170.69 0.25 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.3 3.44 . . . . 0.0 106.396 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -78.35 70.8 7.06 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 CA-C-N 123.791 2.39 . . . . 0.0 111.464 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 134.73 53.36 0.07 OUTLIER Glycine 0 C--N 1.347 1.145 0 N-CA-C 118.203 2.041 . . . . 0.0 118.203 171.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -127.91 -159.0 0.91 Allowed 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.913 1.857 . . . . 0.0 111.626 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -111.85 124.25 51.96 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 127.911 3.719 . . . . 0.0 116.727 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.84 108.83 21.21 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 118.015 -2.928 . . . . 0.0 113.442 167.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.2 t -81.56 128.3 33.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.646 2.378 . . . . 0.0 111.515 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.93 -11.93 3.93 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 174.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -66.63 -25.83 66.78 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 120.884 1.674 . . . . 0.0 111.911 164.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m 126.77 44.05 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 1 C-N-CA 132.168 4.187 . . . . 0.0 111.281 165.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.4 mmm-85 -128.41 136.41 50.85 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.708 1.718 . . . . 0.0 114.967 -156.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.379 0.6 OUTLIER -104.04 114.51 28.81 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 119.133 -2.23 . . . . 0.0 112.538 170.418 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.55 167.34 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 114.074 -2.87 . . . . 0.0 106.46 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -87.38 145.57 26.25 Favored 'General case' 0 N--CA 1.449 -0.524 1 O-C-N 129.466 4.229 . . . . 0.0 113.235 -171.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.12 -17.18 16.56 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 126.988 2.68 . . . . 0.0 114.212 -167.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.54 -37.75 8.43 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.726 1.603 . . . . 0.0 110.217 165.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -83.4 -10.52 58.37 Favored 'General case' 0 CA--C 1.565 1.526 0 CA-C-O 125.849 2.738 . . . . 0.0 108.685 -165.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.2 mttt -76.34 126.91 31.85 Favored 'General case' 0 C--N 1.355 0.82 0 O-C-N 116.67 -3.768 . . . . 0.0 107.786 166.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.2 m 66.94 15.59 10.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -18.66 51.39 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 120.319 -1.488 . . . . 0.0 112.578 -175.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.475 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 93.63 -0.17 67.48 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 116.992 -2.004 . . . . 0.0 114.6 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.408 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 38.1 t0 -118.23 150.94 38.59 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 126.871 3.224 . . . . 0.0 113.901 170.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.493 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -61.95 53.48 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.741 2.417 . . . . 0.0 110.956 162.479 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.748 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -55.93 -28.97 59.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.754 1.622 . . . . 0.0 109.981 175.318 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.0 t -78.25 -14.03 59.61 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.91 2.884 . . . . 0.0 115.778 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.98 -32.68 0.13 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.115 2.166 . . . . 0.0 114.879 -172.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -22.14 55.12 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.542 2.337 . . . . 0.0 110.964 169.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 57.31 85.72 0.08 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.085 2.154 . . . . 0.0 111.491 -166.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.9 m -101.83 -62.82 1.21 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.748 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.4 OUTLIER -29.58 -68.95 0.07 Allowed 'General case' 0 C--O 1.242 0.692 0 C-N-CA 130.571 3.549 . . . . 0.0 111.004 166.814 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.475 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 11.8 mm-40 -86.31 19.19 2.83 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 119.384 -2.073 . . . . 0.0 112.679 -170.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -110.6 130.64 22.68 Favored Pre-proline 0 CA--C 1.543 0.71 0 CA-C-O 115.538 -2.172 . . . . 0.0 107.406 157.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -68.82 21.04 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.97 1 C-N-CA 125.845 4.363 . . . . 0.0 114.656 -170.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.94 -21.14 60.93 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.858 0.863 . . . . 0.0 110.395 154.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -118.36 -79.37 0.59 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.584 1.554 . . . . 0.0 108.595 175.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 14.8 t -134.79 -66.38 0.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.6 t60 . . . . . 0 N--CA 1.471 0.608 0 C-N-CA 125.577 1.551 . . . . 0.0 113.612 -163.924 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -135.69 -167.54 0.15 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.144 3.378 . . . . 0.0 106.023 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -77.09 81.13 2.69 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 CA-C-N 123.734 2.369 . . . . 0.0 110.183 170.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 115.83 56.74 0.34 Allowed Glycine 0 C--N 1.347 1.18 0 N-CA-C 117.923 1.929 . . . . 0.0 117.923 173.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -124.55 -154.49 0.62 Allowed 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.783 . . . . 0.0 111.204 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -117.31 125.3 50.84 Favored 'General case' 0 CA--C 1.56 1.337 0 CA-C-O 128.349 3.928 . . . . 0.0 116.95 177.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.86 110.77 23.12 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 117.95 -2.969 . . . . 0.0 113.269 171.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 20.4 t -80.94 124.18 28.92 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 127.552 2.341 . . . . 0.0 110.733 175.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.33 -16.93 3.94 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 174.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -68.47 -26.85 65.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.363 1.438 . . . . 0.0 111.922 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.4 m 126.23 53.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.315 1 C-N-CA 131.929 4.092 . . . . 0.0 110.907 168.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.91 135.04 48.51 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 123.622 1.677 . . . . 0.0 115.525 -170.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.368 0.5 OUTLIER -104.1 116.95 33.13 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 119.132 -2.23 . . . . 0.0 112.09 163.048 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -133.01 160.88 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 115.139 -2.362 . . . . 0.0 104.838 176.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.86 153.42 30.61 Favored 'General case' 0 N--CA 1.442 -0.853 0 O-C-N 128.847 3.842 . . . . 0.0 112.567 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -59.68 -17.49 34.65 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 127.785 3.178 . . . . 0.0 113.863 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.05 -20.67 1.02 Allowed 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.452 -2.03 . . . . 0.0 113.969 162.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -98.99 -4.3 32.9 Favored 'General case' 0 CA--C 1.564 1.491 0 CA-C-O 125.597 2.618 . . . . 0.0 112.403 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -78.33 121.61 24.69 Favored 'General case' 0 C--N 1.352 0.714 0 O-C-N 116.935 -3.603 . . . . 0.0 109.425 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.261 4.2 p 39.14 58.66 1.81 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -89.79 -16.79 29.45 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 159.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 107.69 -12.67 38.82 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-O 115.74 -2.7 . . . . 0.0 116.502 -170.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -119.27 146.98 44.79 Favored 'General case' 0 N--CA 1.477 0.917 1 CA-C-O 129.343 4.401 . . . . 0.0 117.601 -176.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.514 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -66.96 52.91 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 O-C-N 118.031 -2.918 . . . . 0.0 111.37 172.549 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.668 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.5 OUTLIER -51.63 -31.97 27.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.572 1.949 . . . . 0.0 110.075 172.481 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 46.8 t -79.43 -13.36 59.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 127.66 2.384 . . . . 0.0 115.894 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.81 -34.27 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 127.391 2.276 . . . . 0.0 114.876 -171.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -20.33 60.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 128.15 2.58 . . . . 0.0 110.765 171.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 51.63 81.15 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.552 1.941 . . . . 0.0 110.035 -162.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.5 m -85.62 -81.89 0.2 Allowed 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.814 -2.291 . . . . 0.0 104.814 168.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.668 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.1 OUTLIER -16.12 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.062 2 C-N-CA 135.422 5.489 . . . . 0.0 112.129 175.891 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -74.84 1.68 12.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.759 -2.019 . . . . 0.0 114.451 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -105.51 131.64 21.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 115.527 -2.178 . . . . 0.0 107.668 169.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -69.76 19.79 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.937 1 C-N-CA 126.639 4.892 . . . . 0.0 114.481 -167.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.45 -23.51 61.85 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.105 0.962 . . . . 0.0 110.507 154.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -117.48 -81.48 0.62 Allowed 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.366 1.866 . . . . 0.0 107.93 170.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 t -142.33 -171.53 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.313 0.506 . . . . 0.0 110.494 170.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 85.1 t60 . . . . . 0 N--CA 1.467 0.425 0 O-C-N 120.032 -1.668 . . . . 0.0 108.977 168.824 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 122.134 0.968 . . . . 0.0 109.046 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -138.85 171.75 7.67 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 130.473 3.509 . . . . 0.0 105.164 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.33 79.96 2.02 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.431 2.088 . . . . 0.0 112.146 -177.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.78 50.76 0.1 OUTLIER Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.407 1.003 . . . . 0.0 114.317 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -134.41 -166.47 1.81 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.508 1.123 . . . . 0.0 111.337 -169.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -115.84 122.66 46.06 Favored 'General case' 0 CA--C 1.558 1.283 1 CA-C-O 128.66 4.076 . . . . 0.0 117.115 177.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.22 106.67 18.37 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 118.355 -2.716 . . . . 0.0 111.707 171.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.409 ' SG ' ' HB3' ' A' ' 15' ' ' ASN . 19.8 t -85.47 129.6 34.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 126.217 1.807 . . . . 0.0 112.082 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.87 -22.22 2.09 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.409 ' HB3' ' SG ' ' A' ' 13' ' ' CYS . 24.5 t-20 -65.48 -25.21 67.39 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 120.256 1.389 . . . . 0.0 112.288 169.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m 125.57 44.91 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.441 1 C-N-CA 132.145 4.178 . . . . 0.0 111.056 166.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 mmm-85 -127.63 134.4 49.66 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-O 123.628 1.68 . . . . 0.0 114.943 -157.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.312 0.5 OUTLIER -102.54 115.22 30.14 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 119.422 -2.049 . . . . 0.0 111.147 167.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -135.92 169.0 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 114.637 -2.602 . . . . 0.0 106.073 174.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -93.95 149.09 21.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 128.595 3.685 . . . . 0.0 113.105 -168.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -59.66 -17.29 32.71 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 126.882 2.614 . . . . 0.0 114.008 -167.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -46.09 -26.68 0.79 Allowed 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.172 -1.58 . . . . 0.0 113.247 162.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -99.91 -10.75 21.34 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-O 126.081 2.848 . . . . 0.0 110.19 -172.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.5 mtpt -72.03 139.75 48.69 Favored 'General case' 0 C--N 1.355 0.837 1 O-C-N 115.537 -4.477 . . . . 0.0 107.153 165.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 m 64.35 10.1 5.42 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -41.34 50.99 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.768 1.627 . . . . 0.0 110.622 -170.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.428 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 119.16 -1.39 14.59 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-O 116.553 -2.248 . . . . 0.0 115.444 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . 0.531 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 36.2 t0 -118.23 151.32 37.87 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 127.398 3.475 . . . . 0.0 113.965 166.544 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.507 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -62.39 63.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 O-C-N 119.43 -2.044 . . . . 0.0 109.388 163.514 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.659 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 1.3 p30 -65.82 -24.57 66.93 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 120.631 -1.293 . . . . 0.0 109.47 179.215 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.7 t -67.33 -13.0 61.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.54 2.736 . . . . 0.0 115.705 166.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 65.06 -38.42 0.24 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.147 2.579 . . . . 0.0 114.56 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -86.65 -9.82 55.18 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.175 2.19 . . . . 0.0 111.028 174.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.0 t30 62.86 128.4 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 129.211 3.004 . . . . 0.0 112.546 -167.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.5 m -147.47 -52.15 0.2 Allowed 'General case' 0 C--O 1.212 -0.873 0 O-C-N 120.214 -1.554 . . . . 0.0 111.925 164.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.659 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.1 p-10 -28.41 -69.46 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 CA-C-O 127.912 3.72 . . . . 0.0 111.84 157.428 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 6.0 mm-40 -92.99 23.17 4.4 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.434 -2.666 . . . . 0.0 112.244 -173.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.99 119.62 54.89 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-O 114.458 -2.687 . . . . 0.0 106.045 152.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.52 19.63 0.08 OUTLIER 'Trans proline' 0 CA--C 1.543 0.926 1 C-N-CA 126.488 4.792 . . . . 0.0 115.497 -168.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -21.08 56.51 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.567 1.147 . . . . 0.0 110.319 156.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tt -108.11 -81.2 0.57 Allowed 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.179 1.392 . . . . 0.0 108.559 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 5.4 t -138.86 -59.03 0.61 Allowed 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 . . . . . 0 N--CA 1.473 0.722 0 C-N-CA 125.62 1.568 . . . . 0.0 114.395 -170.832 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.9 t . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 122.181 0.991 . . . . 0.0 110.524 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -135.01 178.6 1.69 Allowed Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 131.085 3.754 . . . . 0.0 104.951 171.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.76 71.39 4.84 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 CA-C-N 123.331 2.225 . . . . 0.0 113.297 -173.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.81 50.4 0.06 OUTLIER Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.855 1.217 . . . . 0.0 114.871 177.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -129.37 -166.03 1.6 Allowed 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.885 1.342 . . . . 0.0 112.914 -165.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -117.09 123.54 47.04 Favored 'General case' 0 CA--C 1.561 1.367 1 CA-C-O 128.542 4.02 . . . . 0.0 117.166 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.57 108.17 20.71 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 117.871 -3.018 . . . . 0.0 112.374 168.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 13.5 t -79.78 126.39 30.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.31 1.844 . . . . 0.0 110.471 176.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -17.4 2.76 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 173.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.07 -24.33 64.15 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 120.459 1.481 . . . . 0.0 111.733 168.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.7 m 122.94 51.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 C-N-CA 131.897 4.079 . . . . 0.0 110.171 167.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -127.59 136.06 51.14 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 123.605 1.669 . . . . 0.0 115.445 -167.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.283 0.2 OUTLIER -99.17 115.87 30.06 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 119.455 -2.028 . . . . 0.0 111.068 165.004 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.67 163.31 37.8 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 115.096 -2.383 . . . . 0.0 105.81 173.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -85.48 142.06 29.48 Favored 'General case' 0 N--CA 1.442 -0.849 1 O-C-N 130.105 4.628 . . . . 0.0 111.799 -174.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -58.2 -16.86 15.25 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 127.295 2.872 . . . . 0.0 113.909 -169.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -52.87 -19.85 2.85 Favored 'General case' 0 CA--C 1.553 1.062 0 O-C-N 119.591 -1.943 . . . . 0.0 113.253 163.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -92.7 -10.29 37.69 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 126.077 2.846 . . . . 0.0 112.001 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -75.96 120.68 21.63 Favored 'General case' 0 C--N 1.353 0.731 1 O-C-N 116.009 -4.182 . . . . 0.0 108.343 171.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.257 1.6 p 42.83 57.76 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -164.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.83 -26.5 22.78 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.105 162.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.421 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 104.84 -3.17 41.62 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 116.966 -2.019 . . . . 0.0 114.712 -174.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -123.99 152.39 42.61 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 127.862 3.696 . . . . 0.0 114.471 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.468 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -64.09 55.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 127.877 2.471 . . . . 0.0 110.472 168.557 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.757 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 1.0 OUTLIER -57.49 -27.7 62.77 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.704 1.601 . . . . 0.0 110.139 176.652 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.5 t -80.52 -13.69 58.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 128.263 2.625 . . . . 0.0 115.897 173.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.0 -32.62 0.11 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.479 2.312 . . . . 0.0 115.06 -172.093 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -22.39 59.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 127.69 2.396 . . . . 0.0 110.903 169.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 58.6 87.06 0.08 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.352 2.261 . . . . 0.0 111.044 -168.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -106.44 -62.89 1.33 Allowed 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.162 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.757 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.5 OUTLIER -28.86 -67.9 0.07 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-O 127.369 3.462 . . . . 0.0 111.569 164.104 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 26.9 mm-40 -82.37 11.82 5.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 112.676 -2.056 . . . . 0.0 113.752 -170.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.46 131.67 21.54 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-O 115.183 -2.341 . . . . 0.0 107.074 163.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -68.51 22.1 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 126.073 4.516 . . . . 0.0 114.498 -171.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.6 59.69 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.141 0.976 . . . . 0.0 110.227 154.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -119.83 -82.05 0.64 Allowed 'General case' 0 C--N 1.344 0.333 0 C-N-CA 125.614 1.566 . . . . 0.0 108.977 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 15.1 t -140.02 -50.61 0.48 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 37.1 t-80 . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -173.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.475 0.813 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -152.1 174.29 3.76 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 130.989 3.716 . . . . 0.0 105.605 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.08 84.41 0.44 Allowed 'Trans proline' 0 CA--C 1.545 1.069 0 CA-C-N 123.275 2.205 . . . . 0.0 113.981 -174.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.16 2.08 1.41 Allowed Glycine 0 CA--C 1.534 1.265 0 N-CA-C 117.168 1.627 . . . . 0.0 117.168 171.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.2 -162.12 0.76 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.597 1.199 . . . . 0.0 113.764 -153.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -113.71 124.11 51.5 Favored 'General case' 0 CA--C 1.559 1.299 1 CA-C-O 128.671 4.081 . . . . 0.0 117.157 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.77 110.85 23.39 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 117.958 -2.964 . . . . 0.0 113.071 166.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.6 t -79.14 122.8 26.7 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 125.515 1.526 . . . . 0.0 110.682 171.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.2 -13.57 5.28 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 173.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.99 -27.23 67.27 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.523 1.51 . . . . 0.0 111.996 166.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.7 m 128.31 52.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.389 1 C-N-CA 132.01 4.124 . . . . 0.0 111.319 166.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -130.27 132.18 45.8 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 123.615 1.674 . . . . 0.0 115.497 -168.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.314 0.5 OUTLIER -100.42 117.67 35.07 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 118.911 -2.368 . . . . 0.0 111.015 165.428 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.83 165.48 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 115.146 -2.359 . . . . 0.0 106.059 174.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -91.23 152.1 20.66 Favored 'General case' 0 N--CA 1.446 -0.633 1 O-C-N 129.16 4.037 . . . . 0.0 112.909 -170.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -60.63 -16.83 42.65 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 126.831 2.582 . . . . 0.0 114.123 -167.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -44.09 -27.06 0.35 Allowed 'General case' 0 CA--C 1.552 1.022 0 O-C-N 119.655 -1.903 . . . . 0.0 113.562 160.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.618 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 2.6 m0 -101.47 -6.67 23.66 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 126.354 2.978 . . . . 0.0 110.693 -172.669 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -76.4 118.33 18.97 Favored 'General case' 0 C--N 1.356 0.855 1 O-C-N 116.189 -4.07 . . . . 0.0 108.045 172.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.251 2.0 p 46.98 46.42 15.8 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -174.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -75.76 -23.58 55.98 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.145 -0.972 . . . . 0.0 111.693 151.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.56 5.0 65.36 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 117.262 -1.854 . . . . 0.0 114.101 -165.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -90.65 128.28 36.57 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 124.383 2.039 . . . . 0.0 110.094 175.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -44.26 -36.85 2.92 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-O 116.549 -1.691 . . . . 0.0 113.561 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 34.74 -50.1 0.0 OUTLIER 'General case' 0 C--N 1.35 0.624 1 C-N-CA 138.681 6.792 . . . . 0.0 114.72 173.479 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.5 t -69.92 -20.6 63.35 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.513 2.725 . . . . 0.0 115.601 166.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.63 -39.0 0.42 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.927 2.091 . . . . 0.0 112.419 -173.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -14.38 61.24 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.946 2.098 . . . . 0.0 110.311 170.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 52.41 65.44 1.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.296 2.239 . . . . 0.0 110.086 -174.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 m -78.93 -60.7 2.27 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 -176.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.618 ' OD2' ' O ' ' A' ' 23' ' ' TRP . 18.5 p-10 -57.82 -49.93 74.98 Favored 'General case' 0 C--O 1.246 0.869 0 CA-C-O 126.577 3.084 . . . . 0.0 111.478 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -71.01 9.75 0.66 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 112.631 -2.077 . . . . 0.0 114.144 176.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.58 137.69 22.28 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-O 116.411 -1.757 . . . . 0.0 108.659 157.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -69.76 21.04 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 126.145 4.563 . . . . 0.0 114.308 -171.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.36 -22.14 64.68 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.097 0.559 . . . . 0.0 110.276 151.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 5.7 tt -121.28 -76.56 0.58 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.015 1.726 . . . . 0.0 108.977 176.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 34.1 t -139.71 -68.5 0.42 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.2 t60 . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 127.383 2.273 . . . . 0.0 114.768 -164.927 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -139.14 -172.83 0.33 Allowed Pre-proline 0 CA--C 1.555 1.16 0 C-N-CA 130.862 3.665 . . . . 0.0 106.187 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.62 79.62 2.76 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 CA-C-N 123.388 2.246 . . . . 0.0 110.761 171.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 119.47 57.16 0.25 Allowed Glycine 0 C--N 1.346 1.12 0 N-CA-C 117.285 1.674 . . . . 0.0 117.285 173.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -127.39 -160.62 1.02 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 119.737 1.768 . . . . 0.0 111.504 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -108.89 122.95 48.28 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 127.915 3.721 . . . . 0.0 115.962 176.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.05 110.48 23.05 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 118.239 -2.788 . . . . 0.0 113.314 166.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.3 t -77.74 124.1 27.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.121 1.768 . . . . 0.0 110.68 171.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.04 -19.72 2.03 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 172.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -70.4 -24.25 62.9 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 120.279 1.399 . . . . 0.0 112.297 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m 125.59 52.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 131.666 3.987 . . . . 0.0 110.822 166.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.48 132.97 48.37 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 123.472 1.606 . . . . 0.0 115.141 -169.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.375 0.5 OUTLIER -105.09 117.05 33.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.022 -2.299 . . . . 0.0 112.45 167.206 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.68 166.14 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 114.203 -2.808 . . . . 0.0 106.318 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -88.81 144.41 26.24 Favored 'General case' 0 N--CA 1.449 -0.476 1 O-C-N 129.311 4.132 . . . . 0.0 113.103 -170.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -58.3 -15.22 9.45 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 127.12 2.763 . . . . 0.0 114.318 -167.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.7 ttp85 -50.64 -28.12 8.23 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.218 -1.551 . . . . 0.0 112.449 164.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -91.99 -4.3 54.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 126.146 2.879 . . . . 0.0 110.132 -172.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HB3' HD21 ' A' ' 41' ' ' LEU . 17.8 mttt -78.82 105.91 10.46 Favored 'General case' 0 C--N 1.351 0.672 0 O-C-N 116.425 -3.922 . . . . 0.0 108.265 170.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 12.8 p 48.08 57.16 6.38 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -168.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -81.06 -37.78 28.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.231 145.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.14 -19.96 8.12 Favored Glycine 0 CA--C 1.537 1.457 0 CA-C-O 117.09 -1.95 . . . . 0.0 116.036 -173.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -78.95 139.82 38.16 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 125.941 2.782 . . . . 0.0 111.864 173.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -54.79 8.45 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 118.536 -2.603 . . . . 0.0 117.572 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.655 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 2.1 p30 -55.18 -24.18 25.58 Favored 'General case' 0 C--N 1.325 -0.487 1 C-N-CA 133.002 4.521 . . . . 0.0 112.728 -120.746 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.2 t -61.63 -20.68 63.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 130.192 3.397 . . . . 0.0 117.894 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 66.45 -32.28 0.17 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 128.106 2.563 . . . . 0.0 113.777 -171.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -15.98 62.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.395 1.878 . . . . 0.0 110.649 160.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.83 63.49 2.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.285 1.834 . . . . 0.0 110.336 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -79.33 -59.02 2.93 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.674 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -38.93 -66.0 0.32 Allowed 'General case' 0 C--O 1.249 1.039 1 CA-C-O 128.55 4.024 . . . . 0.0 110.974 177.216 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -82.08 19.66 1.12 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 110.473 -3.058 . . . . 0.0 112.909 -175.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -116.2 136.64 23.06 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 115.449 -2.215 . . . . 0.0 108.076 153.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -67.61 19.69 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.987 1 C-N-CA 125.911 4.407 . . . . 0.0 114.688 -173.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.62 -21.86 62.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.863 0.865 . . . . 0.0 110.64 154.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.674 HD22 ' HA ' ' A' ' 36' ' ' ASP . 9.1 tt -119.19 -75.98 0.58 Allowed 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 126.02 1.728 . . . . 0.0 108.23 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 50.9 t -145.92 -59.83 0.32 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 t60 . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 -160.132 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.499 0 CA-C-O 119.537 -0.268 . . . . 0.0 110.789 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -150.35 167.03 13.81 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.787 2.035 . . . . 0.0 108.808 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.14 78.19 0.81 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.154 2.569 . . . . 0.0 112.194 173.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.72 38.96 0.11 Allowed Glycine 0 N--CA 1.47 0.91 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -132.26 -170.46 2.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.657 1.183 . . . . 0.0 111.537 -171.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -111.93 121.64 45.57 Favored 'General case' 0 CA--C 1.56 1.359 1 CA-C-O 128.844 4.164 . . . . 0.0 116.675 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.23 107.48 19.96 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 118.216 -2.802 . . . . 0.0 112.824 170.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.6 t -83.55 123.56 29.88 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.752 1.621 . . . . 0.0 111.334 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.36 -12.76 4.1 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -66.74 -29.6 69.62 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 120.858 1.663 . . . . 0.0 111.775 165.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m 127.95 55.92 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 1 C-N-CA 132.052 4.141 . . . . 0.0 110.732 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -132.51 132.46 42.67 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 124.19 1.948 . . . . 0.0 115.344 -168.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.255 0.3 OUTLIER -98.66 119.38 37.3 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 118.863 -2.398 . . . . 0.0 110.493 161.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.24 168.47 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 115.028 -2.415 . . . . 0.0 105.993 171.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -93.84 150.81 20.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 128.366 3.541 . . . . 0.0 112.979 -169.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.2 -16.1 30.19 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 126.756 2.535 . . . . 0.0 114.305 -166.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -45.92 -26.82 0.76 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.117 -1.614 . . . . 0.0 113.297 161.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.8 m0 -99.03 -5.44 30.37 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-O 126.844 3.211 . . . . 0.0 110.377 -172.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.52 ' HG2' HD21 ' A' ' 41' ' ' LEU . 15.7 mttt -76.99 109.94 11.21 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 115.683 -4.385 . . . . 0.0 109.255 171.327 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 p 42.47 53.88 4.53 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 115.983 1.845 . . . . 0.0 115.983 -169.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -68.05 -25.87 65.57 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.251 140.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.37 14.38 51.05 Favored Glycine 0 CA--C 1.53 0.976 0 CA-C-O 117.179 -1.901 . . . . 0.0 113.313 -167.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -110.35 139.32 45.66 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-O 126.555 3.074 . . . . 0.0 113.68 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -40.59 -40.3 1.23 Allowed 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.706 2.402 . . . . 0.0 114.363 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.617 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.0 OUTLIER 30.42 -47.52 0.0 OUTLIER 'General case' 0 C--N 1.348 0.504 1 C-N-CA 139.146 6.978 . . . . 0.0 114.857 178.611 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 44.0 t -73.88 -24.81 59.78 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.982 3.313 . . . . 0.0 116.29 169.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.0 -27.52 0.16 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 126.994 2.118 . . . . 0.0 113.941 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -13.96 59.64 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.87 2.068 . . . . 0.0 110.788 158.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 49.82 58.12 5.79 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.376 2.27 . . . . 0.0 110.793 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -69.78 -58.61 3.69 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.617 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.3 OUTLIER -36.66 -65.11 0.3 Allowed 'General case' 0 C--O 1.248 0.987 1 C-N-CA 131.798 4.039 . . . . 0.0 110.669 173.069 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.27 16.58 1.96 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 111.035 -2.802 . . . . 0.0 113.513 -173.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.68 136.53 22.02 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-O 115.689 -2.1 . . . . 0.0 108.174 155.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -68.89 20.9 0.15 Allowed 'Trans proline' 0 CA--C 1.543 0.959 1 C-N-CA 125.768 4.312 . . . . 0.0 114.552 -173.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.34 -21.35 62.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.629 0.772 . . . . 0.0 110.403 152.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 36' ' ' ASP . 6.3 tt -120.42 -76.86 0.58 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 125.78 1.632 . . . . 0.0 108.828 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.2 t -142.38 -61.5 0.44 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.8 t60 . . . . . 0 CA--C 1.541 0.619 0 C-N-CA 126.726 2.01 . . . . 0.0 115.565 -166.281 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 119.635 -0.221 . . . . 0.0 110.85 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -150.48 166.11 15.88 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 126.986 2.114 . . . . 0.0 108.78 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.22 78.95 1.13 Allowed 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.05 2.5 . . . . 0.0 112.547 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.26 37.55 0.09 OUTLIER Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.685 1.136 . . . . 0.0 115.209 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -131.03 -170.14 2.3 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.0 1.32 . . . . 0.0 111.598 -168.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -113.75 122.41 47.0 Favored 'General case' 0 CA--C 1.56 1.33 1 CA-C-O 128.987 4.232 . . . . 0.0 116.546 -178.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.88 109.6 22.28 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 118.233 -2.792 . . . . 0.0 112.394 170.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 36.5 t -83.48 124.24 30.52 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.352 1.861 . . . . 0.0 111.307 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.53 -12.91 4.5 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 174.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.5 -29.34 69.42 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.871 1.669 . . . . 0.0 111.84 165.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 m 128.02 52.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.354 1 C-N-CA 132.186 4.194 . . . . 0.0 110.901 169.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -130.08 134.83 47.63 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 124.419 2.057 . . . . 0.0 115.66 -167.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 121.39 39.58 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 118.77 -2.456 . . . . 0.0 110.428 162.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.22 164.15 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 114.765 -2.541 . . . . 0.0 105.964 169.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -88.84 151.21 22.5 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.541 3.65 . . . . 0.0 112.721 -172.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -61.21 -16.0 40.4 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 126.39 2.306 . . . . 0.0 114.697 -166.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.39 -38.14 2.62 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.692 1.587 . . . . 0.0 110.792 161.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.807 ' O ' ' OD2' ' A' ' 36' ' ' ASP . 5.7 m95 -88.87 -5.5 57.98 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 124.788 2.232 . . . . 0.0 108.982 -164.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HA ' ' HB2' ' A' ' 36' ' ' ASP . 18.3 mttt -77.97 134.91 37.76 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 117.983 -2.948 . . . . 0.0 109.443 165.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.8 m 60.33 15.29 5.29 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -175.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -11.15 58.65 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.263 1.825 . . . . 0.0 112.104 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.96 -3.51 28.24 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-O 116.997 -2.001 . . . . 0.0 114.481 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -91.16 133.97 34.93 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 126.479 3.037 . . . . 0.0 111.18 165.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -35.3 -44.92 0.29 Allowed 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 128.368 2.667 . . . . 0.0 112.872 169.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 35.64 -49.87 0.0 OUTLIER 'General case' 0 C--N 1.349 0.546 1 C-N-CA 138.746 6.818 . . . . 0.0 114.288 175.498 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 25.5 t -65.09 -23.87 67.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.469 3.108 . . . . 0.0 115.518 163.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.62 -25.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.997 2.119 . . . . 0.0 113.881 -178.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.7 -11.89 56.59 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.223 2.209 . . . . 0.0 110.762 163.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.0 m120 51.1 64.06 1.99 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 127.191 2.196 . . . . 0.0 109.891 -174.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 m -77.13 -60.86 2.19 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 -176.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.807 ' OD2' ' O ' ' A' ' 23' ' ' TRP . 17.4 p-10 -57.03 -52.0 67.0 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 126.111 2.863 . . . . 0.0 111.234 -175.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.465 ' OE2' ' OD2' ' A' ' 36' ' ' ASP . 12.1 mm-40 -75.09 15.58 0.4 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 113.091 -1.868 . . . . 0.0 113.31 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -118.09 143.44 32.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-O 117.06 -1.448 . . . . 0.0 109.634 155.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -71.05 21.66 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.847 1 C-N-CA 125.823 4.349 . . . . 0.0 114.25 -171.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.65 -21.42 64.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 110.235 151.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 8.5 tt -128.72 -75.97 0.56 Allowed 'General case' 0 C--N 1.343 0.295 0 C-N-CA 125.743 1.617 . . . . 0.0 108.792 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 35.5 t -132.41 -76.42 0.5 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.6 t60 . . . . . 0 N--CA 1.476 0.865 0 C-N-CA 127.118 2.167 . . . . 0.0 115.0 -160.289 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.483 1.197 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -143.43 168.02 14.06 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.694 2.398 . . . . 0.0 107.276 175.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -72.91 72.14 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.99 2.46 . . . . 0.0 112.187 178.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.53 41.7 0.04 OUTLIER Glycine 0 CA--C 1.531 1.035 0 C-N-CA 124.8 1.19 . . . . 0.0 114.652 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -136.2 -172.1 3.05 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.158 1.383 . . . . 0.0 111.578 -168.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -127.13 141.95 51.63 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 111.819 -3.943 . . . . 0.0 112.715 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.404 ' HA ' ' O ' ' A' ' 17' ' ' ARG . . . -121.8 140.36 52.46 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 128.301 3.501 . . . . 0.0 114.861 166.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . 0.416 ' SG ' ' HB3' ' A' ' 15' ' ' ASN . 27.6 t -86.16 126.9 34.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.266 3.426 . . . . 0.0 110.674 -175.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.91 -15.69 5.36 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 173.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.416 ' HB3' ' SG ' ' A' ' 13' ' ' CYS . 28.4 t-20 -67.88 -26.22 65.9 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 120.392 1.451 . . . . 0.0 112.069 167.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m 127.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.475 1 C-N-CA 131.938 4.095 . . . . 0.0 111.317 164.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.404 ' O ' ' HA ' ' A' ' 12' ' ' ALA . 1.4 mmm180 -132.38 133.21 43.67 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -166.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 p -99.37 123.74 43.9 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 117.623 -3.173 . . . . 0.0 111.043 169.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.66 169.37 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-O 115.286 -2.292 . . . . 0.0 111.183 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.566 ' H ' ' NE2' ' A' ' 20' ' ' GLN . 1.8 pm0 -88.23 147.39 24.86 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.195 2.809 . . . . 0.0 114.279 -173.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -53.25 -18.33 2.31 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 129.045 2.938 . . . . 0.0 115.224 -169.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.75 -33.8 3.25 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 121.215 1.825 . . . . 0.0 110.963 163.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -85.87 -8.56 57.98 Favored 'General case' 0 CA--C 1.558 1.26 0 CA-C-O 124.761 2.219 . . . . 0.0 109.825 -167.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -76.23 108.02 8.88 Favored 'General case' 0 C--N 1.351 0.67 0 O-C-N 117.543 -3.223 . . . . 0.0 110.525 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.0 p 41.19 58.78 2.5 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -169.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -80.17 -27.0 39.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.891 143.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.6 4.37 67.9 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.103 -1.387 . . . . 0.0 113.555 -165.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.11 123.52 27.43 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 124.017 1.865 . . . . 0.0 108.139 168.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -52.71 -24.66 9.09 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 118.894 -2.379 . . . . 0.0 114.154 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.795 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.0 OUTLIER 28.54 -48.41 0.0 OUTLIER 'General case' 0 C--N 1.347 0.467 1 C-N-CA 139.61 7.164 . . . . 0.0 114.65 175.149 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.5 t -70.47 -20.92 62.84 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 127.444 2.297 . . . . 0.0 115.915 168.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 70.36 -30.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.939 2.096 . . . . 0.0 113.236 -176.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.27 -13.83 59.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 128.083 2.553 . . . . 0.0 111.415 170.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.9 m120 48.62 88.83 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.702 2.001 . . . . 0.0 110.814 -159.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.6 m -98.34 -68.24 0.81 Allowed 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.795 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 1.9 p-10 -26.65 -66.6 0.06 Allowed 'General case' 0 C--O 1.248 1.009 0 CA-C-O 127.734 3.635 . . . . 0.0 111.952 153.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -91.46 25.81 2.49 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.634 -172.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -112.93 139.94 23.51 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 115.268 -2.301 . . . . 0.0 108.799 148.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.75 21.76 0.14 Allowed 'Trans proline' 0 CA--C 1.545 1.026 1 C-N-CA 125.789 4.326 . . . . 0.0 114.356 -175.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.32 -20.59 60.76 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.107 0.963 . . . . 0.0 110.27 154.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 tt -121.58 -81.11 0.63 Allowed 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.268 1.427 . . . . 0.0 108.782 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.2 t -146.37 -43.0 0.2 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 . . . . . 0 N--CA 1.478 0.944 0 CA-C-N 121.167 1.803 . . . . 0.0 114.626 177.263 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.534 0.345 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -145.25 162.01 39.23 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 126.73 2.012 . . . . 0.0 108.759 177.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.93 75.18 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.349 2.699 . . . . 0.0 112.25 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.6 21.64 0.03 OUTLIER Glycine 0 CA--C 1.531 1.087 0 C-N-CA 125.006 1.289 . . . . 0.0 115.632 -176.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.53 -171.45 2.38 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.658 1.229 . . . . 0.0 112.318 -165.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -106.6 122.34 46.14 Favored 'General case' 0 CA--C 1.557 1.223 1 CA-C-O 128.768 4.127 . . . . 0.0 116.109 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.15 106.18 18.34 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 118.385 -2.697 . . . . 0.0 112.891 170.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 t -82.59 124.71 30.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.716 1.606 . . . . 0.0 111.173 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.08 -14.75 1.7 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -35.81 81.88 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.186 1.357 . . . . 0.0 111.079 166.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.9 m 132.45 49.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.282 1 C-N-CA 132.284 4.233 . . . . 0.0 111.488 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -125.11 135.8 53.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 116.037 1.866 . . . . 0.0 116.037 -167.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.96 120.12 37.8 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.688 -1.883 . . . . 0.0 110.944 163.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.09 171.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 114.532 -2.651 . . . . 0.0 106.37 171.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -94.7 147.04 23.72 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 128.502 3.626 . . . . 0.0 113.287 -168.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -59.38 -15.92 19.65 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 126.759 2.537 . . . . 0.0 114.333 -168.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -48.57 -25.89 1.95 Allowed 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.336 -1.477 . . . . 0.0 112.84 163.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -98.97 -2.84 36.42 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-O 126.227 2.917 . . . . 0.0 109.876 -171.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -79.38 121.92 25.75 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 116.209 -4.057 . . . . 0.0 109.45 168.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.271 1.9 p 45.07 51.56 8.84 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -172.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.8 -16.16 28.82 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 164.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.403 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 107.54 -11.54 39.14 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-O 115.721 -2.71 . . . . 0.0 116.484 -172.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -117.35 145.12 44.26 Favored 'General case' 0 N--CA 1.477 0.911 1 CA-C-O 129.27 4.367 . . . . 0.0 117.342 -178.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.507 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.78 55.59 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 O-C-N 118.044 -2.91 . . . . 0.0 111.145 170.104 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.538 ' OD2' ' OD2' ' A' ' 36' ' ' ASP . 0.4 OUTLIER -55.72 -31.48 62.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.532 1.933 . . . . 0.0 109.857 173.467 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.5 t -76.12 -15.05 60.16 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 127.928 2.491 . . . . 0.0 115.662 174.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.2 -39.2 0.14 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.653 2.381 . . . . 0.0 113.732 -167.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -16.64 62.82 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.26 2.224 . . . . 0.0 111.256 175.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 49.7 78.76 0.09 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.359 2.264 . . . . 0.0 110.297 -166.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.6 m -84.75 -76.49 0.31 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 115.386 -2.245 . . . . 0.0 105.421 167.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.538 ' OD2' ' OD2' ' A' ' 30' ' ' ASP . 0.0 OUTLIER -22.55 -71.02 0.02 OUTLIER 'General case' 0 C--O 1.247 0.956 2 C-N-CA 134.936 5.294 . . . . 0.0 112.698 179.963 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.403 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 41.4 mm-40 -73.44 7.01 2.55 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 110.761 -2.927 . . . . 0.0 114.248 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.68 143.18 34.34 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 116.483 -1.722 . . . . 0.0 108.419 167.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.73 20.72 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.907 1 C-N-CA 125.904 4.403 . . . . 0.0 114.149 -170.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.25 -21.14 63.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.104 0.562 . . . . 0.0 110.132 152.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 36' ' ' ASP . 6.2 tt -126.64 -77.79 0.58 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 125.61 1.564 . . . . 0.0 109.414 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 49.0 t -136.25 -62.94 0.65 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 . . . . . 0 N--CA 1.481 1.109 0 C-N-CA 126.621 1.968 . . . . 0.0 115.584 -166.536 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.482 1.167 0 N-CA-C 113.831 1.049 . . . . 0.0 113.831 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -141.74 -166.2 0.12 Allowed Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.07 3.348 . . . . 0.0 105.889 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.94 79.99 3.09 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 CA-C-N 123.99 2.461 . . . . 0.0 110.404 170.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 126.64 45.95 0.22 Allowed Glycine 0 C--N 1.348 1.206 0 N-CA-C 119.224 2.45 . . . . 0.0 119.224 169.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -125.83 -156.96 0.76 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.194 1.997 . . . . 0.0 111.228 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -114.93 126.84 55.25 Favored 'General case' 0 CA--C 1.558 1.288 1 CA-C-O 128.975 4.226 . . . . 0.0 116.785 174.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -103.93 111.68 24.33 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 117.995 -2.941 . . . . 0.0 111.92 173.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.2 t -84.39 125.56 32.43 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 128.626 2.77 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.02 -13.47 2.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 174.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -66.4 -30.51 70.9 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.764 1.62 . . . . 0.0 111.768 165.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m 127.56 51.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.322 1 C-N-CA 132.258 4.223 . . . . 0.0 110.558 169.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -130.12 138.03 50.47 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 123.71 1.719 . . . . 0.0 115.389 -165.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.444 0.5 OUTLIER -111.3 119.83 40.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 118.577 -2.577 . . . . 0.0 114.12 168.439 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.75 162.36 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 128.527 2.731 . . . . 0.0 105.418 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -86.35 147.13 26.18 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 128.579 3.674 . . . . 0.0 112.906 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -60.41 -13.81 15.49 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 128.102 2.561 . . . . 0.0 113.987 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -35.83 3.01 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 119.75 -1.844 . . . . 0.0 111.336 160.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -90.26 -3.72 57.62 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-O 124.864 2.269 . . . . 0.0 108.883 -166.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -79.49 124.47 28.51 Favored 'General case' 0 C--N 1.358 0.948 0 O-C-N 117.765 -3.084 . . . . 0.0 109.509 165.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.5 p 37.88 65.62 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.942 2.097 . . . . 0.0 116.234 -163.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.739 ' OD1' ' OE2' ' A' ' 37' ' ' GLU . 19.5 p30 -99.2 -4.21 32.59 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 160.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 75.84 12.71 83.71 Favored Glycine 0 CA--C 1.538 1.531 0 CA-C-O 116.55 -2.25 . . . . 0.0 115.089 -162.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -105.76 122.79 46.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.769 2.785 . . . . 0.0 112.908 177.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -24.59 -50.02 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 127.52 2.328 . . . . 0.0 113.633 162.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 30.75 -49.55 0.0 OUTLIER 'General case' 0 C--N 1.352 0.682 1 C-N-CA 139.109 6.964 . . . . 0.0 114.621 -179.56 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.0 t -66.21 -23.19 66.39 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 129.42 3.088 . . . . 0.0 115.384 167.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.46 -29.55 0.18 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.638 1.975 . . . . 0.0 113.563 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -19.4 61.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.177 1.791 . . . . 0.0 110.494 164.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.7 t30 45.61 87.55 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.808 1.643 . . . . 0.0 110.812 -155.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.6 m -86.26 -73.86 0.44 Allowed 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 114.44 -2.695 . . . . 0.0 104.157 163.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.449 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -59.83 -44.51 94.01 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 128.029 3.33 . . . . 0.0 111.137 -154.559 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.739 ' OE2' ' OD1' ' A' ' 26' ' ' ASP . 34.1 mm-40 -74.94 6.15 4.39 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 119.27 -2.143 . . . . 0.0 111.907 -173.602 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -104.12 135.62 19.31 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 116.656 -1.64 . . . . 0.0 108.044 161.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.79 20.28 0.15 Allowed 'Trans proline' 0 C--N 1.356 0.957 1 C-N-CA 126.459 4.772 . . . . 0.0 114.303 -171.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 -23.16 65.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.298 0.639 . . . . 0.0 110.308 152.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 8.5 tt -125.89 -79.98 0.61 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.99 1.716 . . . . 0.0 108.936 177.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 21.3 t -157.26 118.3 3.62 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 . . . . . 0 N--CA 1.466 0.361 0 O-C-N 120.539 -1.351 . . . . 0.0 109.039 172.605 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.496 0 N-CA-C 109.973 -0.381 . . . . 0.0 109.973 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -149.76 158.74 37.09 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.931 2.092 . . . . 0.0 108.0 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -64.14 92.8 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.443 2.762 . . . . 0.0 112.225 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.61 -17.97 2.62 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 126.033 1.778 . . . . 0.0 114.482 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -78.68 -167.94 1.25 Allowed 'General case' 0 C--O 1.239 0.525 0 C-N-CA 125.435 1.494 . . . . 0.0 111.753 -171.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -113.43 120.94 42.78 Favored 'General case' 0 CA--C 1.561 1.368 1 CA-C-O 129.143 4.306 . . . . 0.0 116.323 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.93 109.18 20.62 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 117.955 -2.965 . . . . 0.0 112.642 167.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.01 29.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.898 1.679 . . . . 0.0 110.888 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -12.05 3.55 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -65.29 -31.56 72.76 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.739 1.609 . . . . 0.0 111.845 164.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.5 m 128.55 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 C-N-CA 132.131 4.172 . . . . 0.0 110.61 170.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -129.19 134.8 48.17 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 124.079 1.895 . . . . 0.0 115.311 -168.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.37 119.8 36.57 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 119.044 -2.285 . . . . 0.0 110.731 161.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.71 160.82 39.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 115.019 -2.42 . . . . 0.0 105.979 170.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -83.1 150.47 26.27 Favored 'General case' 0 N--CA 1.448 -0.532 1 O-C-N 129.379 4.174 . . . . 0.0 112.515 -173.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.404 ' HG3' ' HE2' ' A' ' 24' ' ' LYS . 6.8 tt0 -49.73 -24.56 2.38 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 127.42 2.95 . . . . 0.0 115.119 -171.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -38.55 7.23 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 121.441 1.928 . . . . 0.0 110.183 169.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -83.6 -7.99 59.4 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-O 124.781 2.229 . . . . 0.0 108.089 -163.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.404 ' HE2' ' HG3' ' A' ' 21' ' ' GLU . 43.0 mtmt -77.02 131.44 38.43 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 118.006 -2.934 . . . . 0.0 110.381 166.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 m 63.4 17.59 10.41 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.031 2.132 . . . . 0.0 114.457 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.43 -11.19 59.92 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 128.193 2.597 . . . . 0.0 113.382 -165.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.37 6.59 85.88 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 116.45 -2.306 . . . . 0.0 114.908 -173.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.88 146.6 43.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 128.438 3.97 . . . . 0.0 117.061 175.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.506 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -64.65 48.42 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.43 2.692 . . . . 0.0 111.363 165.262 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -45.31 -34.71 3.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.958 2.503 . . . . 0.0 110.247 164.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 t -78.99 -14.89 58.93 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 128.4 2.68 . . . . 0.0 115.097 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.19 -30.16 0.08 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.386 2.275 . . . . 0.0 114.945 -172.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -20.87 46.1 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 127.542 2.337 . . . . 0.0 110.601 171.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 52.83 82.31 0.07 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.123 1.769 . . . . 0.0 109.909 -163.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -88.56 -72.49 0.54 Allowed 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 113.814 -2.994 . . . . 0.0 103.885 168.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.493 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -59.57 -45.04 93.01 Favored 'General case' 0 C--O 1.241 0.618 0 O-C-N 127.921 3.263 . . . . 0.0 111.654 -156.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -70.97 5.41 2.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.29 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.78 140.72 25.05 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 117.016 -1.469 . . . . 0.0 108.941 165.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -71.13 21.45 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.859 1 C-N-CA 126.034 4.489 . . . . 0.0 114.162 -170.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -22.25 65.45 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.956 -0.465 . . . . 0.0 110.231 151.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.518 HD23 ' HB2' ' A' ' 42' ' ' CYS . 8.9 tt -129.15 -76.19 0.55 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 125.983 1.713 . . . . 0.0 109.201 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.518 ' HB2' HD23 ' A' ' 41' ' ' LEU . 7.3 t -134.57 -65.76 0.63 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 116.056 1.872 . . . . 0.0 116.056 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 12.8 t-80 . . . . . 0 CA--C 1.554 1.105 0 C-N-CA 124.606 1.162 . . . . 0.0 113.121 -160.797 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.223 0 CA-C-O 119.725 -0.486 . . . . 0.0 114.043 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.8 t -134.25 85.58 38.46 Favored Pre-proline 0 CA--C 1.539 0.545 0 C-N-CA 125.262 1.425 . . . . 0.0 109.761 175.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -82.85 110.1 1.81 Allowed 'Trans proline' 0 CA--C 1.549 1.231 0 C-N-CA 124.087 3.191 . . . . 0.0 112.301 -176.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.68 -62.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.759 0 C-N-CA 122.263 1.975 . . . . 0.0 111.003 174.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.424 ' O ' ' HB2' ' A' ' 18' ' ' CYS . 72.3 mt-30 81.48 -11.48 1.08 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.755 2.822 . . . . 0.0 117.288 168.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.8 t -162.94 -50.05 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 126.059 1.744 . . . . 0.0 109.764 165.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.469 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 13.6 mt-30 -129.8 -174.59 0.39 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.171 3.388 . . . . 0.0 105.068 168.176 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -77.37 66.7 7.87 Favored 'Trans proline' 0 CA--C 1.549 1.269 0 CA-C-N 123.717 2.363 . . . . 0.0 112.867 -175.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.01 59.89 0.04 OUTLIER Glycine 0 C--N 1.345 1.064 0 C-N-CA 124.345 0.974 . . . . 0.0 115.065 175.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.469 ' HG3' ' H ' ' A' ' 7' ' ' GLN . 6.2 mm-40 -133.29 -158.9 0.92 Allowed 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.069 1.348 . . . . 0.0 111.495 -166.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -121.86 127.81 50.92 Favored 'General case' 0 CA--C 1.569 1.703 1 CA-C-O 129.295 4.379 . . . . 0.0 117.879 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.33 111.63 23.96 Favored 'General case' 0 CA--C 1.544 0.724 0 O-C-N 117.154 -3.466 . . . . 0.0 112.275 171.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 38.1 t -87.35 127.98 35.19 Favored 'General case' 0 C--O 1.232 0.173 0 C-N-CA 125.971 1.708 . . . . 0.0 111.017 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.64 -11.45 4.95 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 174.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -63.38 -28.37 69.94 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 120.858 1.663 . . . . 0.0 112.032 163.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.7 m 126.55 45.42 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.425 1 C-N-CA 132.239 4.215 . . . . 0.0 110.885 166.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 16.8 mmm-85 -126.53 135.94 51.95 Favored 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 123.706 1.717 . . . . 0.0 114.641 -158.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 0.1 OUTLIER -97.99 116.46 30.25 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 119.791 -1.818 . . . . 0.0 110.519 166.08 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.42 HG21 ' CZ3' ' A' ' 23' ' ' TRP . 0.1 OUTLIER -139.07 176.49 6.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-O 115.381 -2.247 . . . . 0.0 105.733 174.486 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -103.15 149.4 24.68 Favored 'General case' 0 N--CA 1.444 -0.758 0 O-C-N 128.501 3.626 . . . . 0.0 112.429 -162.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -53.16 -19.36 2.9 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 127.714 3.134 . . . . 0.0 113.942 -167.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.38 -42.0 9.69 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-N 120.668 1.576 . . . . 0.0 109.632 169.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.42 ' CZ3' HG21 ' A' ' 19' ' ' ILE . 9.3 m0 -73.49 -17.58 61.21 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-O 123.928 1.823 . . . . 0.0 108.386 -163.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.415 ' HA ' ' HB2' ' A' ' 36' ' ' ASP . 46.1 mtmt -80.47 110.1 15.61 Favored 'General case' 0 C--N 1.357 0.917 0 O-C-N 119.879 -1.763 . . . . 0.0 108.881 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.0 m 71.85 24.35 3.39 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.63 1.172 . . . . 0.0 112.376 -170.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.57 -30.36 52.55 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.667 -1.271 . . . . 0.0 110.752 173.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.79 -1.41 71.3 Favored Glycine 0 CA--C 1.528 0.853 0 CA-C-O 117.609 -1.662 . . . . 0.0 114.137 178.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 30' ' ' ASP . 38.7 t70 -96.09 150.58 20.34 Favored 'General case' 0 C--O 1.247 0.924 0 CA-C-O 125.944 2.783 . . . . 0.0 111.891 162.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -48.92 -42.42 37.11 Favored 'General case' 0 C--N 1.346 0.432 0 CA-C-N 111.842 -2.436 . . . . 0.0 113.018 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 28' ' ' ASP . 17.1 t0 59.61 -60.89 0.05 Allowed 'General case' 0 N--CA 1.477 0.904 1 C-N-CA 133.174 4.59 . . . . 0.0 110.914 151.398 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 3.6 t -52.11 -20.33 2.44 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 128.146 2.579 . . . . 0.0 116.942 150.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 71.15 -34.03 0.29 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 126.646 1.978 . . . . 0.0 113.035 -172.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -85.16 -12.1 53.53 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.885 1.674 . . . . 0.0 110.816 172.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.79 63.86 1.92 Allowed 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.862 1.665 . . . . 0.0 109.951 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 m -85.68 -56.1 3.66 Favored 'General case' 0 CA--C 1.508 -0.644 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -177.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.444 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 16.7 p-10 -55.8 -47.26 77.43 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 126.411 3.005 . . . . 0.0 110.655 179.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.457 ' HA ' ' HA ' ' A' ' 43' ' ' HIS 0.261 8.9 mm-40 -83.6 17.89 2.08 Favored 'General case' 0 N--CA 1.445 -0.695 0 O-C-N 119.13 -2.231 . . . . 0.0 113.468 -178.37 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -106.44 132.85 20.56 Favored Pre-proline 0 CA--C 1.548 0.901 0 CA-C-O 116.76 -1.59 . . . . 0.0 108.06 150.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -69.89 20.99 0.18 Allowed 'Trans proline' 0 CA--C 1.542 0.878 1 C-N-CA 126.177 4.585 . . . . 0.0 114.334 -169.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.28 -22.22 64.75 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.314 0.646 . . . . 0.0 110.378 152.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 9.6 tt -120.61 -74.39 0.61 Allowed 'General case' 0 C--N 1.343 0.31 0 C-N-CA 125.471 1.508 . . . . 0.0 108.935 177.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.0 t -139.92 -70.12 0.4 Allowed 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 116.311 1.967 . . . . 0.0 116.311 176.262 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 1.0 OUTLIER 63.87 86.19 0.12 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.532 1.933 . . . . 0.0 114.197 -164.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.8 tt0 -70.43 142.89 51.96 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.257 151.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 . . . . . 0 CA--C 1.534 0.363 0 C-N-CA 124.733 1.213 . . . . 0.0 109.671 -179.32 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.078 0 CA-C-O 118.875 -0.958 . . . . 0.0 114.533 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.9 m 105.66 -36.27 0.0 OUTLIER Pre-proline 0 N--CA 1.479 1.004 0 C-N-CA 130.69 3.596 . . . . 0.0 117.299 169.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -73.97 159.96 43.89 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 CA-C-N 123.892 2.426 . . . . 0.0 112.534 -175.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -76.88 54.69 4.63 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 125.09 3.86 . . . . 0.0 111.793 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.4 tp60 -66.41 -19.64 65.85 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.526 1.931 . . . . 0.0 114.756 -161.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -120.93 -55.5 1.98 Allowed 'General case' 0 N--CA 1.465 0.3 0 C-N-CA 126.051 1.74 . . . . 0.0 109.294 178.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -145.01 167.7 13.96 Favored Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 128.162 2.585 . . . . 0.0 107.33 176.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -74.44 70.66 4.79 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 123.154 2.57 . . . . 0.0 112.913 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.18 46.02 0.03 OUTLIER Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.898 1.237 . . . . 0.0 113.756 179.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -133.3 -172.69 3.01 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.606 1.162 . . . . 0.0 112.155 -166.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -109.86 124.55 51.53 Favored 'General case' 0 CA--C 1.56 1.354 1 CA-C-O 128.681 4.086 . . . . 0.0 116.449 179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.4 108.11 20.73 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 118.421 -2.674 . . . . 0.0 112.627 170.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 31.0 t -85.55 125.01 32.76 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 125.51 1.524 . . . . 0.0 111.233 178.313 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.71 -16.63 4.51 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 173.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -68.5 -24.45 64.67 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 120.635 1.561 . . . . 0.0 112.031 167.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.7 m 126.28 50.75 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 131.84 4.056 . . . . 0.0 111.221 165.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 18.8 mmm180 -128.38 135.72 49.93 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 124.231 1.967 . . . . 0.0 115.53 -166.263 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.18 121.12 38.72 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 119.353 -2.092 . . . . 0.0 110.413 160.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.34 167.69 16.51 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 114.087 -2.863 . . . . 0.0 106.729 173.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -87.24 144.73 26.68 Favored 'General case' 0 N--CA 1.45 -0.469 1 O-C-N 129.395 4.185 . . . . 0.0 113.301 -170.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -57.54 -16.4 9.89 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 128.122 2.569 . . . . 0.0 114.249 -170.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 16.0 ttp85 -50.19 -27.13 5.4 Favored 'General case' 0 CA--C 1.542 0.651 0 O-C-N 120.587 -1.321 . . . . 0.0 112.614 165.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -93.9 -4.34 50.09 Favored 'General case' 0 CA--C 1.566 1.592 0 CA-C-O 126.33 2.967 . . . . 0.0 109.579 -171.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.2 mttt -78.55 111.29 14.45 Favored 'General case' 0 C--N 1.355 0.814 0 O-C-N 116.471 -3.893 . . . . 0.0 109.029 170.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.283 8.1 p 41.75 53.27 4.01 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -166.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.5 p-10 -76.8 -24.85 52.8 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 118.756 -0.64 . . . . 0.0 112.269 145.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.6 -8.49 40.31 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-O 117.063 -1.965 . . . . 0.0 115.339 -176.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -98.1 144.77 27.23 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 125.987 2.803 . . . . 0.0 113.887 179.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -71.84 58.42 0.33 Allowed 'General case' 0 N--CA 1.469 0.506 0 O-C-N 118.616 -2.552 . . . . 0.0 110.878 170.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -56.22 -30.66 62.63 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 127.206 2.202 . . . . 0.0 110.12 175.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 51.6 t -80.38 -15.38 56.96 Favored 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 126.69 1.996 . . . . 0.0 115.779 175.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.37 -36.55 0.13 Allowed 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 127.321 2.248 . . . . 0.0 114.849 -170.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.72 -19.22 61.43 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 128.19 2.596 . . . . 0.0 111.014 169.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.7 74.56 0.44 Allowed 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 127.365 2.266 . . . . 0.0 111.003 -177.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.1 m -102.24 -58.41 1.88 Allowed 'General case' 0 C--O 1.214 -0.794 0 C-N-CA 123.728 0.811 . . . . 0.0 110.237 -177.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -28.6 -67.65 0.07 Allowed 'General case' 0 C--O 1.247 0.923 0 CA-C-O 128.012 3.767 . . . . 0.0 111.631 158.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.453 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 20.4 mm-40 -86.77 21.0 2.35 Favored 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 112.151 -2.295 . . . . 0.0 112.863 -173.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.6 135.52 21.1 Favored Pre-proline 0 CA--C 1.542 0.658 0 CA-C-O 115.085 -2.388 . . . . 0.0 107.994 154.469 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -68.31 21.66 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.074 1 C-N-CA 125.735 4.29 . . . . 0.0 114.614 -173.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.05 -20.87 60.89 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.052 0.941 . . . . 0.0 110.293 153.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.8 tt -120.15 -80.5 0.62 Allowed 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.716 1.607 . . . . 0.0 108.576 176.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 38.8 t -141.74 -54.36 0.45 Allowed 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 116.097 1.888 . . . . 0.0 116.097 174.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.453 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 32.2 t-80 57.15 99.25 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.536 1.534 . . . . 0.0 114.777 -171.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -62.22 109.5 1.34 Allowed 'General case' 0 CA--C 1.541 0.609 0 O-C-N 121.833 -0.542 . . . . 0.0 111.312 175.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 83.7 t60 . . . . . 0 N--CA 1.466 0.355 0 C-N-CA 125.374 1.47 . . . . 0.0 112.11 -173.615 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.064 0 CA-C-O 119.182 -0.788 . . . . 0.0 113.651 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.7 m 110.55 -58.47 0.0 OUTLIER Pre-proline 0 N--CA 1.476 0.867 0 C-N-CA 131.609 3.964 . . . . 0.0 114.399 173.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -72.29 159.38 49.68 Favored 'Trans proline' 0 CA--C 1.55 1.292 0 C-N-CA 122.226 1.951 . . . . 0.0 114.706 -168.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -78.42 60.31 7.47 Favored 'Trans proline' 0 CA--C 1.544 1.022 1 C-N-CA 125.393 4.062 . . . . 0.0 113.972 -169.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -19.18 63.19 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 115.532 1.679 . . . . 0.0 115.532 -176.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.89 -58.54 1.96 Allowed 'General case' 0 N--CA 1.467 0.411 0 C-N-CA 124.227 1.011 . . . . 0.0 110.477 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -150.13 167.83 12.22 Favored Pre-proline 0 CA--C 1.552 1.019 0 C-N-CA 128.883 2.873 . . . . 0.0 106.908 -178.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.66 76.89 1.45 Allowed 'Trans proline' 0 CA--C 1.544 0.996 0 C-N-CA 123.323 2.682 . . . . 0.0 113.461 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.7 43.8 0.07 OUTLIER Glycine 0 N--CA 1.473 1.115 0 C-N-CA 124.441 1.02 . . . . 0.0 114.577 176.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -128.25 -174.51 3.24 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 118.271 1.035 . . . . 0.0 113.181 -162.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -109.14 121.29 44.83 Favored 'General case' 0 CA--C 1.563 1.465 1 CA-C-O 128.964 4.221 . . . . 0.0 116.214 178.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.8 107.79 20.32 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 118.223 -2.798 . . . . 0.0 112.75 172.383 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 18.5 t -82.59 124.09 29.82 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 125.302 1.441 . . . . 0.0 111.508 175.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.83 -12.53 3.18 Favored 'General case' 0 CA--C 1.551 1.003 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 173.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -67.38 -30.62 70.45 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 120.925 1.693 . . . . 0.0 111.684 165.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.9 m 128.03 53.78 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.273 1 C-N-CA 132.186 4.194 . . . . 0.0 110.741 170.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -129.28 132.16 47.12 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-O 124.341 2.02 . . . . 0.0 114.835 -167.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -101.49 117.57 35.19 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 118.739 -2.476 . . . . 0.0 110.212 167.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -139.18 169.41 17.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.528 0 CA-C-O 114.961 -2.447 . . . . 0.0 105.987 172.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.98 154.45 18.15 Favored 'General case' 0 N--CA 1.449 -0.5 0 O-C-N 127.547 3.029 . . . . 0.0 113.704 -171.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.05 -15.38 31.74 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 127.162 2.789 . . . . 0.0 114.196 -168.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -43.27 -33.52 0.99 Allowed 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.545 -1.347 . . . . 0.0 112.82 160.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 22.9 m95 -95.41 -0.29 52.64 Favored 'General case' 0 CA--C 1.557 1.227 0 CA-C-O 125.704 2.669 . . . . 0.0 111.825 -171.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.463 ' HG2' HD21 ' A' ' 41' ' ' LEU . 18.6 mttt -79.44 101.06 7.96 Favored 'General case' 0 C--N 1.351 0.636 0 O-C-N 117.398 -3.314 . . . . 0.0 108.807 173.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.337 21.2 p 49.76 57.84 6.09 Favored 'General case' 0 N--CA 1.467 0.375 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -165.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 17.1 p30 -75.61 -23.03 56.38 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 114.649 -1.16 . . . . 0.0 112.679 137.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 89.87 9.71 65.71 Favored Glycine 0 CA--C 1.533 1.207 0 CA-C-O 117.668 -1.629 . . . . 0.0 113.932 -168.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -93.98 135.37 35.4 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 120.321 2.06 . . . . 0.0 110.949 171.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 8.9 m-80 -29.29 -13.81 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.823 1 C-N-CA 132.344 4.258 . . . . 0.0 119.523 179.114 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -80.13 -23.86 40.87 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 123.591 1.663 . . . . 0.0 109.566 -85.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.5 t -56.11 -21.62 23.37 Favored 'General case' 0 N--CA 1.429 -1.494 1 C-N-CA 132.272 4.229 . . . . 0.0 116.176 164.014 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 69.66 -29.77 0.18 Allowed 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 127.663 2.385 . . . . 0.0 113.494 -177.307 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.59 -16.66 62.3 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.637 1.975 . . . . 0.0 110.545 157.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 53.19 64.24 1.93 Allowed 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 126.17 1.788 . . . . 0.0 110.233 -176.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.5 m -73.56 -64.85 0.91 Allowed 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 176.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.765 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.1 OUTLIER -39.29 -63.8 0.52 Allowed 'General case' 0 N--CA 1.441 -0.884 2 C-N-CA 132.752 4.421 . . . . 0.0 110.524 -177.998 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -84.81 21.34 1.58 Allowed 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 111.036 -2.802 . . . . 0.0 112.544 -172.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.68 139.52 26.42 Favored Pre-proline 0 CA--C 1.545 0.756 0 CA-C-O 116.136 -1.888 . . . . 0.0 108.428 153.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -69.12 20.72 0.15 Allowed 'Trans proline' 0 CA--C 1.542 0.886 1 C-N-CA 125.875 4.383 . . . . 0.0 114.596 -173.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.65 -21.29 63.55 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.213 0.605 . . . . 0.0 110.388 152.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.765 HD22 ' HA ' ' A' ' 36' ' ' ASP . 8.1 tt -123.66 -76.07 0.59 Allowed 'General case' 0 C--N 1.343 0.293 0 C-N-CA 125.917 1.687 . . . . 0.0 108.786 178.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.4 t -139.74 -67.12 0.44 Allowed 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 171.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.6 t60 56.95 -59.41 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.626 1.97 . . . . 0.0 115.043 -161.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 59.45 -65.59 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 128.116 2.566 . . . . 0.0 113.043 -168.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 51.0 t-80 . . . . . 0 CA--C 1.54 0.579 0 C-N-CA 125.67 1.588 . . . . 0.0 109.728 171.11 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.75 ' H1 ' ' H ' ' A' ' 12' ' ' ALA . . . . . . . . 0 CA--C 1.531 1.085 0 CA-C-O 120.117 -0.269 . . . . 0.0 113.354 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.1 m -167.27 -56.17 0.01 OUTLIER Pre-proline 0 CA--C 1.539 0.537 0 C-N-CA 126.785 2.034 . . . . 0.0 111.267 172.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.72 160.01 50.82 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 121.583 1.522 . . . . 0.0 111.326 169.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -77.77 58.65 6.53 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 124.451 3.434 . . . . 0.0 111.546 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.5 tp60 -69.28 -23.91 63.89 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 115.196 1.554 . . . . 0.0 115.196 -155.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.44 -57.18 2.01 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.412 1.885 . . . . 0.0 108.079 173.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 mt-30 -139.25 168.96 13.53 Favored Pre-proline 0 CA--C 1.552 1.051 0 C-N-CA 128.471 2.708 . . . . 0.0 107.454 170.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -75.2 73.31 4.47 Favored 'Trans proline' 0 CA--C 1.541 0.871 0 C-N-CA 122.816 2.344 . . . . 0.0 113.082 -177.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.41 46.58 0.02 OUTLIER Glycine 0 CA--C 1.528 0.904 0 C-N-CA 125.305 1.431 . . . . 0.0 112.988 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -134.99 -176.83 4.38 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.663 1.185 . . . . 0.0 112.47 -165.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.501 ' HA ' ' H1 ' ' A' ' 1' ' ' GLY . 8.3 t80 -105.75 121.96 45.1 Favored 'General case' 0 CA--C 1.56 1.349 1 CA-C-O 128.689 4.09 . . . . 0.0 116.268 -178.202 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.75 ' H ' ' H1 ' ' A' ' 1' ' ' GLY . . . -97.38 107.37 19.87 Favored 'General case' 0 CA--C 1.548 0.883 0 O-C-N 118.353 -2.717 . . . . 0.0 112.58 171.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.5 t -86.97 126.59 34.82 Favored 'General case' 0 C--O 1.234 0.257 0 C-N-CA 125.832 1.653 . . . . 0.0 111.725 179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.48 -13.18 3.3 Favored 'General case' 0 CA--C 1.55 0.974 0 N-CA-C 115.866 1.802 . . . . 0.0 115.866 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -66.77 -28.59 68.52 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.759 1.618 . . . . 0.0 111.744 165.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.4 m 128.36 48.49 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.382 1 C-N-CA 132.133 4.173 . . . . 0.0 110.912 166.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 17.4 mmm180 -126.85 136.04 51.8 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 124.265 1.983 . . . . 0.0 115.069 -162.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 120.01 37.34 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 119.406 -2.059 . . . . 0.0 110.326 163.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -140.6 170.82 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 114.501 -2.666 . . . . 0.0 106.341 172.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -94.07 147.44 23.13 Favored 'General case' 0 N--CA 1.446 -0.633 0 O-C-N 128.439 3.587 . . . . 0.0 113.407 -168.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -53.59 -20.57 5.3 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 127.603 3.064 . . . . 0.0 113.809 -169.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.3 ttt180 -50.46 -28.52 8.47 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 123.948 0.899 . . . . 0.0 112.265 167.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -92.82 -5.41 51.12 Favored 'General case' 0 CA--C 1.565 1.52 0 CA-C-O 126.751 3.167 . . . . 0.0 109.237 -170.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.474 ' HB3' HD21 ' A' ' 41' ' ' LEU . 34.7 mtpt -80.16 102.5 9.44 Favored 'General case' 0 C--N 1.352 0.682 0 O-C-N 116.368 -3.958 . . . . 0.0 108.493 171.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.294 21.1 p 45.99 60.04 3.4 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -165.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -71.07 -26.91 63.27 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 114.444 -1.253 . . . . 0.0 112.482 133.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.0 19.73 20.75 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-O 116.238 -2.423 . . . . 0.0 115.248 -172.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.5 t0 -128.74 152.46 48.4 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 126.726 3.155 . . . . 0.0 115.139 169.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.497 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.23 52.83 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 O-C-N 118.567 -2.583 . . . . 0.0 111.765 171.168 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -55.63 -29.54 59.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 126.368 1.867 . . . . 0.0 110.033 176.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.3 t -78.72 -13.55 59.75 Favored 'General case' 0 N--CA 1.443 -0.789 0 C-N-CA 127.572 2.349 . . . . 0.0 116.129 175.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.6 -34.51 0.14 Allowed 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.991 2.116 . . . . 0.0 114.837 -172.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -74.63 -22.14 59.08 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 128.275 2.63 . . . . 0.0 111.074 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 56.97 86.41 0.07 Allowed 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.358 2.263 . . . . 0.0 111.31 -168.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -105.05 -61.77 1.43 Allowed 'General case' 0 C--O 1.219 -0.523 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.174 177.117 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.696 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -29.97 -67.46 0.08 Allowed 'General case' 0 C--O 1.246 0.873 1 CA-C-O 128.699 4.095 . . . . 0.0 111.763 166.634 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -86.18 17.87 3.42 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 112.069 -2.332 . . . . 0.0 112.906 -172.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.94 139.35 20.57 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.032 156.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -68.09 20.69 0.13 Allowed 'Trans proline' 0 CA--C 1.541 0.864 1 C-N-CA 126.323 4.682 . . . . 0.0 114.27 -173.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.36 -20.7 59.99 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.127 0.971 . . . . 0.0 110.421 155.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.696 HD22 ' HA ' ' A' ' 36' ' ' ASP . 9.3 tt -125.76 -76.62 0.58 Allowed 'General case' 0 C--N 1.344 0.363 0 C-N-CA 124.94 1.296 . . . . 0.0 109.218 -176.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 47.6 t -138.53 -71.23 0.42 Allowed 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.773 1.397 . . . . 0.0 114.773 171.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 24.1 t60 58.19 96.07 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.83 1.652 . . . . 0.0 113.721 -162.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 -153.58 68.57 0.79 Allowed 'General case' 0 N--CA 1.473 0.684 0 O-C-N 121.131 -0.981 . . . . 0.0 111.793 171.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 17.5 t60 . . . . . 0 CA--C 1.536 0.42 0 C-N-CA 123.708 0.803 . . . . 0.0 111.725 177.832 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.256 0 CA-C-O 119.532 -0.593 . . . . 0.0 114.215 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.4 p -145.31 157.68 52.54 Favored Pre-proline 0 CA--C 1.541 0.624 0 C-N-CA 125.529 1.532 . . . . 0.0 110.973 177.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -76.47 121.61 6.1 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 122.695 2.264 . . . . 0.0 111.05 178.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -72.31 -42.8 1.25 Allowed 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 122.972 2.448 . . . . 0.0 112.509 178.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 85.41 -27.38 0.09 Allowed 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 129.694 3.198 . . . . 0.0 116.524 166.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.2 t -152.93 -52.52 0.11 Allowed 'General case' 0 N--CA 1.485 1.276 0 CA-C-N 120.564 1.529 . . . . 0.0 110.606 172.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -132.09 -179.65 1.12 Allowed Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 130.394 3.478 . . . . 0.0 105.033 171.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -74.88 69.42 5.45 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.23 2.189 . . . . 0.0 113.165 -174.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.08 54.29 0.05 OUTLIER Glycine 0 CA--C 1.53 1.025 0 C-N-CA 124.94 1.257 . . . . 0.0 114.814 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -133.28 -165.94 1.69 Allowed 'General case' 0 N--CA 1.473 0.723 0 CA-C-N 118.766 1.283 . . . . 0.0 112.723 -166.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -117.41 125.08 50.36 Favored 'General case' 0 CA--C 1.564 1.502 1 CA-C-O 128.848 4.166 . . . . 0.0 118.205 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.3 107.09 18.35 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 117.725 -3.109 . . . . 0.0 112.678 171.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 41.6 t -74.35 127.02 31.96 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 124.851 1.26 . . . . 0.0 109.927 170.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.54 -21.91 19.11 Favored 'General case' 0 CA--C 1.549 0.919 0 N-CA-C 114.837 1.421 . . . . 0.0 114.837 170.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -69.69 -7.3 38.02 Favored 'General case' 0 CA--C 1.553 1.07 0 CA-C-N 119.849 1.204 . . . . 0.0 112.416 168.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.5 m 106.91 53.45 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.893 1 C-N-CA 132.059 4.144 . . . . 0.0 110.392 160.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 23.6 mmm-85 -130.76 131.26 44.62 Favored 'General case' 0 N--CA 1.482 1.145 0 CA-C-O 123.063 1.411 . . . . 0.0 114.526 -166.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.332 0.1 OUTLIER -101.56 115.08 29.71 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 119.65 -1.906 . . . . 0.0 111.706 168.471 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -136.41 170.68 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.217 0 CA-C-O 115.553 -2.165 . . . . 0.0 105.635 174.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 1.2 pm0 -97.76 155.38 17.05 Favored 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 128.167 3.417 . . . . 0.0 112.958 -167.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -58.63 -16.9 18.12 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 127.271 2.857 . . . . 0.0 114.626 -163.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.54 -41.11 4.31 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 121.089 1.768 . . . . 0.0 110.787 163.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.3 m0 -84.58 -7.95 59.07 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-O 125.97 2.795 . . . . 0.0 108.61 -164.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.562 ' HG2' HD21 ' A' ' 41' ' ' LEU . 13.8 mttt -77.98 123.39 26.75 Favored 'General case' 0 C--N 1.351 0.664 0 O-C-N 117.107 -3.496 . . . . 0.0 107.401 164.026 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.8 m 78.97 11.63 1.46 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.864 1.665 . . . . 0.0 114.862 168.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 34.2 p-10 -83.79 -3.61 57.98 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.07 -1.644 . . . . 0.0 112.239 -179.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 77.38 10.33 86.31 Favored Glycine 0 CA--C 1.533 1.174 0 CA-C-O 117.762 -1.577 . . . . 0.0 114.35 -175.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -103.86 125.69 50.46 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 124.188 1.947 . . . . 0.0 112.347 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.569 ' ND2' HD22 ' A' ' 34' ' ' ASN . 0.0 OUTLIER -67.77 56.93 0.06 Allowed 'General case' 0 CA--C 1.542 0.662 0 O-C-N 118.828 -2.42 . . . . 0.0 110.801 163.661 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -31.75 65.53 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 127.972 2.509 . . . . 0.0 109.459 175.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 45.0 t -75.7 -14.49 60.34 Favored 'General case' 0 N--CA 1.444 -0.753 0 C-N-CA 127.734 2.414 . . . . 0.0 115.619 174.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.16 -35.75 0.17 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 127.325 2.25 . . . . 0.0 114.485 -172.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.95 -21.66 61.57 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 128.206 2.602 . . . . 0.0 110.774 171.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.569 HD22 ' ND2' ' A' ' 29' ' ' ASN . 22.2 t-20 54.58 80.75 0.12 Allowed 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 126.824 2.05 . . . . 0.0 110.413 -164.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 m -86.12 -76.45 0.34 Allowed 'General case' 0 CA--C 1.515 -0.403 0 CA-C-O 115.335 -2.269 . . . . 0.0 105.334 170.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.692 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -22.49 -70.68 0.02 OUTLIER 'General case' 0 N--CA 1.441 -0.889 2 C-N-CA 134.074 4.95 . . . . 0.0 111.411 175.331 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -80.74 16.27 1.47 Allowed 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 111.871 -2.422 . . . . 0.0 113.228 -167.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.52 140.5 30.48 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 116.257 -1.83 . . . . 0.0 108.148 164.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -71.67 19.99 0.26 Allowed 'Trans proline' 0 CA--C 1.541 0.846 1 C-N-CA 125.66 4.24 . . . . 0.0 114.224 -168.355 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.29 -20.47 62.2 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.015 0.526 . . . . 0.0 110.189 153.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.692 HD22 ' HA ' ' A' ' 36' ' ' ASP . 2.3 tt -125.57 -77.09 0.58 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 125.417 1.487 . . . . 0.0 109.538 174.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 11.9 t -133.28 -61.52 0.82 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 115.976 1.843 . . . . 0.0 115.976 178.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 75.3 t60 57.48 87.7 0.06 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.144 1.377 . . . . 0.0 114.199 -162.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 65.97 140.77 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.458 1.903 . . . . 0.0 115.001 170.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 17.5 p80 . . . . . 0 CA--C 1.542 0.663 0 C-N-CA 125.687 1.595 . . . . 0.0 112.122 -178.014 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.222 0 CA-C-O 119.626 -0.541 . . . . 0.0 114.118 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 t -139.58 92.69 10.12 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 125.473 1.509 . . . . 0.0 110.182 178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -74.9 135.53 19.4 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 122.467 2.111 . . . . 0.0 111.0 -177.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.4 -44.49 2.29 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.394 2.062 . . . . 0.0 111.996 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 76.1 -47.98 0.57 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 127.034 2.133 . . . . 0.0 112.394 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -129.91 -55.65 1.13 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 125.908 1.683 . . . . 0.0 110.368 176.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -144.74 169.81 9.33 Favored Pre-proline 0 CA--C 1.55 0.974 0 C-N-CA 129.1 2.96 . . . . 0.0 106.463 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -73.86 70.0 4.45 Favored 'Trans proline' 0 CA--C 1.547 1.127 0 C-N-CA 122.355 2.037 . . . . 0.0 113.336 -174.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 150.16 40.36 0.03 OUTLIER Glycine 0 CA--C 1.533 1.185 0 C-N-CA 125.318 1.437 . . . . 0.0 115.282 178.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -125.58 -163.42 1.2 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 119.031 1.416 . . . . 0.0 113.145 -164.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -124.17 125.33 44.26 Favored 'General case' 0 CA--C 1.569 1.694 0 CA-C-O 128.479 3.99 . . . . 0.0 117.803 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.15 111.35 22.87 Favored 'General case' 0 N--CA 1.476 0.856 0 O-C-N 117.288 -3.383 . . . . 0.0 113.615 164.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.6 t -82.07 125.03 30.36 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 126.121 1.769 . . . . 0.0 111.035 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -59.4 -10.9 3.58 Favored 'General case' 0 CA--C 1.551 0.999 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 174.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -66.22 -30.08 70.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 120.883 1.674 . . . . 0.0 111.635 164.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.8 m 128.11 51.79 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.343 1 C-N-CA 132.076 4.15 . . . . 0.0 110.803 168.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -128.13 134.41 49.11 Favored 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 123.839 1.781 . . . . 0.0 114.772 -166.488 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.272 0.5 OUTLIER -97.89 117.9 33.25 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 119.067 -2.271 . . . . 0.0 110.697 162.995 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.42 169.74 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-O 114.749 -2.548 . . . . 0.0 106.141 173.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -93.78 146.92 23.52 Favored 'General case' 0 N--CA 1.446 -0.66 0 O-C-N 129.04 3.963 . . . . 0.0 112.964 -170.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -60.32 -16.13 31.9 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 126.926 2.641 . . . . 0.0 113.708 -166.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.3 ttt180 -46.16 -27.88 1.09 Allowed 'General case' 0 CA--C 1.546 0.819 0 O-C-N 120.143 -1.598 . . . . 0.0 113.026 162.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.6 m0 -97.47 -9.38 27.32 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 126.244 2.926 . . . . 0.0 110.117 -172.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 15.1 mttt -75.44 136.24 40.7 Favored 'General case' 0 C--N 1.353 0.735 1 O-C-N 115.92 -4.237 . . . . 0.0 107.916 166.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.1 m 63.75 13.58 7.55 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.74 -35.19 52.14 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.313 1.045 . . . . 0.0 110.642 -173.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.468 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 106.53 -3.26 36.85 Favored Glycine 0 CA--C 1.528 0.849 0 CA-C-O 117.094 -1.948 . . . . 0.0 114.615 -179.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 40.0 t0 -105.69 145.28 31.28 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 126.073 2.844 . . . . 0.0 112.487 170.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -71.64 60.85 0.35 Allowed 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.43 -2.044 . . . . 0.0 109.23 168.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -59.0 -25.68 63.86 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.352 1.861 . . . . 0.0 110.144 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 41.8 t -78.08 -16.7 57.79 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 129.107 2.963 . . . . 0.0 116.258 173.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 64.38 -33.9 0.15 Allowed 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 126.796 2.038 . . . . 0.0 115.06 -172.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -20.38 60.43 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 127.01 2.124 . . . . 0.0 111.057 168.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 51.6 t30 59.23 83.41 0.13 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.837 2.455 . . . . 0.0 112.213 -168.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -103.93 -61.78 1.39 Allowed 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -31.1 -67.99 0.09 Allowed 'General case' 0 C--O 1.242 0.702 0 CA-C-O 127.12 3.343 . . . . 0.0 110.529 163.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.468 ' CD ' ' H ' ' A' ' 27' ' ' GLY 0.326 3.7 mm-40 -92.02 25.84 2.69 Favored 'General case' 0 N--CA 1.445 -0.709 0 O-C-N 119.245 -2.159 . . . . 0.0 112.122 -170.887 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -108.86 126.84 28.51 Favored Pre-proline 0 CA--C 1.544 0.717 0 CA-C-O 114.961 -2.447 . . . . 0.0 107.189 151.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -67.78 19.87 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.978 1 C-N-CA 125.984 4.456 . . . . 0.0 114.801 -170.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.75 -21.61 61.72 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.934 0.893 . . . . 0.0 110.457 154.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -114.95 -79.5 0.59 Allowed 'General case' 0 C--N 1.343 0.311 0 C-N-CA 125.82 1.648 . . . . 0.0 108.362 173.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 3.7 t -137.28 -60.38 0.67 Allowed 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 116.314 1.968 . . . . 0.0 116.314 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 24.8 t-80 57.59 86.7 0.07 Allowed 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.491 1.517 . . . . 0.0 113.149 -165.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 60.91 -177.96 0.11 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.13 1.372 . . . . 0.0 112.587 178.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 . . . . . 0 CA--C 1.543 0.686 0 O-C-N 120.234 -1.541 . . . . 0.0 109.932 174.488 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.022 0 CA-C-O 118.878 -0.957 . . . . 0.0 114.243 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 t 128.94 -60.82 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.946 0 C-N-CA 131.198 3.799 . . . . 0.0 112.878 178.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -67.88 150.1 78.24 Favored 'Trans proline' 0 CA--C 1.548 1.189 0 C-N-CA 121.721 1.614 . . . . 0.0 113.903 -168.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -78.74 55.26 5.45 Favored 'Trans proline' 0 CA--C 1.539 0.745 1 C-N-CA 125.539 4.159 . . . . 0.0 112.666 -174.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 29.7 mm100 -65.26 -9.16 21.64 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 126.012 1.725 . . . . 0.0 115.607 -172.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.22 -59.53 1.83 Allowed 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.294 1.438 . . . . 0.0 109.696 176.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 -145.99 167.99 12.82 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.955 2.502 . . . . 0.0 107.427 176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.17 75.34 1.83 Allowed 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 123.317 2.678 . . . . 0.0 112.797 179.193 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 140.16 46.73 0.06 OUTLIER Glycine 0 N--CA 1.469 0.885 0 C-N-CA 124.284 0.945 . . . . 0.0 114.064 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -133.75 -172.23 2.92 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.421 1.088 . . . . 0.0 111.861 -168.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -110.38 121.95 46.53 Favored 'General case' 0 CA--C 1.56 1.362 1 CA-C-O 128.882 4.182 . . . . 0.0 116.568 -179.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.16 108.51 21.23 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 118.29 -2.756 . . . . 0.0 112.81 172.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 28.3 t -82.49 122.95 28.71 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 125.822 1.649 . . . . 0.0 111.226 175.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.49 -19.84 2.51 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.413 1.634 . . . . 0.0 115.413 171.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -70.98 -22.65 62.16 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 120.006 1.275 . . . . 0.0 112.366 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.4 m 125.59 51.82 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.364 1 C-N-CA 131.87 4.068 . . . . 0.0 111.425 166.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.1 mmm180 -130.46 134.95 47.49 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 124.304 2.002 . . . . 0.0 116.291 -169.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.24 121.36 39.04 Favored 'General case' 0 N--CA 1.466 0.33 0 O-C-N 119.032 -2.293 . . . . 0.0 110.445 160.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.82 169.2 18.1 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.288 0 CA-C-O 115.064 -2.398 . . . . 0.0 105.836 169.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -95.88 151.03 19.78 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 127.954 3.284 . . . . 0.0 112.918 -169.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -61.15 -15.8 37.57 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 126.662 2.476 . . . . 0.0 114.096 -166.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -45.65 -25.65 0.5 Allowed 'General case' 0 CA--C 1.55 0.978 0 O-C-N 119.991 -1.693 . . . . 0.0 113.366 160.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.3 m0 -101.67 -4.2 26.95 Favored 'General case' 0 CA--C 1.567 1.597 0 CA-C-O 126.265 2.936 . . . . 0.0 110.873 -172.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.0 mttt -78.24 114.41 17.1 Favored 'General case' 0 C--N 1.354 0.78 1 O-C-N 116.082 -4.136 . . . . 0.0 109.028 170.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.25 8.8 p 41.02 55.76 3.09 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.586 1.699 . . . . 0.0 115.586 -167.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -82.53 -29.63 30.28 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.694 145.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.68 -11.62 42.19 Favored Glycine 0 CA--C 1.534 1.272 0 CA-C-O 117.422 -1.766 . . . . 0.0 115.444 -175.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.0 t0 -81.31 142.33 33.19 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 125.371 2.51 . . . . 0.0 111.535 172.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -45.55 -2.68 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 130.296 3.438 . . . . 0.0 118.653 -169.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -75.5 -21.42 58.03 Favored 'General case' 0 C--N 1.322 -0.611 0 O-C-N 120.189 -1.569 . . . . 0.0 109.891 -91.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 47.8 t -61.02 -13.67 18.09 Favored 'General case' 0 N--CA 1.434 -1.245 0 C-N-CA 130.726 3.61 . . . . 0.0 116.085 164.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.28 -34.1 0.27 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 128.666 2.786 . . . . 0.0 113.248 -174.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -68.61 -28.42 66.9 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.655 1.982 . . . . 0.0 110.125 164.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 65.4 81.59 0.2 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 128.326 2.65 . . . . 0.0 109.689 -169.148 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.4 m -98.27 -60.84 1.47 Allowed 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -178.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -28.57 -66.31 0.08 Allowed 'General case' 0 C--O 1.247 0.957 0 CA-C-O 127.551 3.548 . . . . 0.0 112.076 157.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 22.2 mm-40 -87.18 17.76 4.1 Favored 'General case' 0 N--CA 1.443 -0.795 0 CA-C-N 112.646 -2.07 . . . . 0.0 112.953 -171.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -109.25 135.34 20.25 Favored Pre-proline 0 CA--C 1.541 0.616 0 CA-C-O 115.214 -2.327 . . . . 0.0 108.047 155.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -68.68 22.98 0.14 Allowed 'Trans proline' 0 CA--C 1.544 0.993 1 C-N-CA 125.757 4.305 . . . . 0.0 114.556 -173.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.96 -20.32 60.4 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.997 0.919 . . . . 0.0 110.165 153.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.3 tt -120.46 -82.51 0.65 Allowed 'General case' 0 C--N 1.344 0.346 0 C-N-CA 125.664 1.585 . . . . 0.0 108.868 178.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 36.4 t -144.47 -47.91 0.26 Allowed 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 177.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 11.7 t-160 56.74 95.81 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -179.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -68.03 84.33 0.23 Allowed 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.841 0.829 . . . . 0.0 112.428 174.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 45.3 t-80 . . . . . 0 CA--C 1.54 0.56 0 C-N-CA 125.835 1.654 . . . . 0.0 109.553 -179.421 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.243 0 CA-C-O 119.603 -0.554 . . . . 0.0 114.164 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 96.5 p -145.58 158.61 49.93 Favored Pre-proline 0 CA--C 1.54 0.578 0 C-N-CA 125.656 1.582 . . . . 0.0 110.893 177.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -75.98 118.97 5.19 Favored 'Trans proline' 0 CA--C 1.545 1.041 0 C-N-CA 122.87 2.38 . . . . 0.0 110.744 176.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -72.36 -47.59 0.39 Allowed 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 122.904 2.403 . . . . 0.0 112.195 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 84.4 -30.51 0.07 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 129.022 2.929 . . . . 0.0 115.976 168.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.9 t -149.89 -50.79 0.14 Allowed 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 120.393 1.452 . . . . 0.0 110.92 173.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.6 mt-30 -133.34 179.6 1.33 Allowed Pre-proline 0 CA--C 1.552 1.041 0 C-N-CA 130.128 3.371 . . . . 0.0 105.081 170.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -74.81 68.91 5.51 Favored 'Trans proline' 0 CA--C 1.548 1.221 0 CA-C-N 123.423 2.258 . . . . 0.0 113.208 -175.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.73 46.14 0.04 OUTLIER Glycine 0 CA--C 1.531 1.09 0 C-N-CA 124.636 1.112 . . . . 0.0 115.702 177.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -128.69 -162.34 1.18 Allowed 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.119 1.46 . . . . 0.0 112.782 -164.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.6 t80 -121.54 125.98 48.09 Favored 'General case' 0 CA--C 1.563 1.444 1 CA-C-O 128.547 4.022 . . . . 0.0 118.669 -178.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -101.08 107.35 18.76 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 117.801 -3.062 . . . . 0.0 113.074 170.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.7 t -74.25 122.87 23.52 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 168.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.48 -22.91 8.83 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.125 1.157 . . . . 0.0 114.125 177.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 18.6 t-20 -60.42 -25.83 66.24 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.755 1.622 . . . . 0.0 113.089 170.298 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.1 m 129.9 45.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 131.633 3.973 . . . . 0.0 112.317 161.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 26.1 mtt-85 -125.91 128.58 47.79 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 115.411 1.634 . . . . 0.0 115.411 -164.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.337 0.1 OUTLIER -98.31 116.6 30.88 Favored 'General case' 0 N--CA 1.465 0.308 0 O-C-N 120.237 -1.54 . . . . 0.0 111.951 167.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -134.25 165.32 31.94 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-O 115.249 -2.31 . . . . 0.0 105.768 171.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -88.82 146.56 24.91 Favored 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 128.922 3.888 . . . . 0.0 112.061 -177.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -60.4 -21.29 62.05 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 126.805 2.566 . . . . 0.0 113.755 -165.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 9.8 ttt180 -40.99 -28.89 0.09 Allowed 'General case' 0 CA--C 1.547 0.849 0 O-C-N 120.394 -1.441 . . . . 0.0 113.359 161.548 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.1 m0 -102.77 -5.35 23.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 111.853 -3.927 . . . . 0.0 113.622 -171.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HE2' HD11 ' A' ' 41' ' ' LEU . 25.3 mttt -72.43 143.2 48.59 Favored 'General case' 0 C--N 1.363 1.165 1 O-C-N 130.505 4.878 . . . . 0.0 109.168 166.112 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.7 p 31.57 56.89 0.3 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 115.375 1.62 . . . . 0.0 115.375 -172.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -89.26 -8.95 52.4 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.689 1.196 . . . . 0.0 111.84 157.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 85.97 10.48 75.29 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 117.099 -1.945 . . . . 0.0 112.975 -163.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -115.87 132.49 56.63 Favored 'General case' 0 C--O 1.244 0.767 0 CA-C-O 126.562 3.077 . . . . 0.0 114.591 -172.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -61.65 39.55 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.79 0 O-C-N 119.797 -1.815 . . . . 0.0 115.137 152.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.28 -47.47 4.79 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.223 2.209 . . . . 0.0 108.602 146.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.7 t -81.7 113.03 19.41 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 154.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 61.9 tp -49.41 -20.7 0.74 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 125.537 1.535 . . . . 0.0 114.615 174.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -102.29 -2.99 27.94 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 119.569 1.077 . . . . 0.0 113.297 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 51.51 68.55 0.78 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.395 1.878 . . . . 0.0 110.245 -166.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.7 m -77.65 -67.06 0.76 Allowed 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 104.503 -2.406 . . . . 0.0 104.503 177.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 11.5 p-10 -60.1 -47.21 86.86 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-O 125.796 2.712 . . . . 0.0 113.232 -170.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -61.18 2.41 0.14 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 112.62 -2.082 . . . . 0.0 114.605 172.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -117.92 141.61 29.5 Favored Pre-proline 0 CA--C 1.546 0.812 0 CA-C-N 120.178 1.354 . . . . 0.0 109.541 165.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -72.17 21.83 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.823 1 C-N-CA 125.919 4.412 . . . . 0.0 114.192 -168.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.09 -21.07 64.09 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.814 -0.554 . . . . 0.0 110.089 151.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.558 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 10.0 tt -127.21 -77.19 0.57 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 126.257 1.823 . . . . 0.0 108.732 -178.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 42.2 t -138.13 -61.99 0.59 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 83.6 t60 58.42 173.3 0.06 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.743 1.617 . . . . 0.0 114.474 -165.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 39.88 85.55 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 128.761 2.824 . . . . 0.0 116.087 171.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 61.3 t60 . . . . . 0 N--CA 1.469 0.496 0 C-N-CA 125.028 1.331 . . . . 0.0 112.02 173.82 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.242 0 N-CA-C 112.242 -0.343 . . . . 0.0 112.242 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.8 m 65.21 160.35 0.12 Allowed Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 127.477 2.311 . . . . 0.0 113.859 -174.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -72.1 111.0 3.07 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 C-N-CA 123.035 2.49 . . . . 0.0 110.229 172.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -67.92 -54.82 0.3 Allowed 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 123.237 2.624 . . . . 0.0 112.788 -169.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 68.74 114.21 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 127.084 2.154 . . . . 0.0 111.323 173.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 67.36 -60.68 0.37 Allowed 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 126.696 1.998 . . . . 0.0 113.476 -176.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -142.2 -170.69 0.25 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.3 3.44 . . . . 0.0 106.396 -177.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -78.35 70.8 7.06 Favored 'Trans proline' 0 CA--C 1.546 1.119 0 CA-C-N 123.791 2.39 . . . . 0.0 111.464 177.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 134.73 53.36 0.07 OUTLIER Glycine 0 C--N 1.347 1.145 0 N-CA-C 118.203 2.041 . . . . 0.0 118.203 171.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -127.91 -159.0 0.91 Allowed 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 119.913 1.857 . . . . 0.0 111.626 179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -111.85 124.25 51.96 Favored 'General case' 0 CA--C 1.56 1.334 0 CA-C-O 127.911 3.719 . . . . 0.0 116.727 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -95.84 108.83 21.21 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 118.015 -2.928 . . . . 0.0 113.442 167.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 16.2 t -81.56 128.3 33.77 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 127.646 2.378 . . . . 0.0 111.515 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.93 -11.93 3.93 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 174.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -66.63 -25.83 66.78 Favored 'General case' 0 CA--C 1.546 0.822 0 CA-C-N 120.884 1.674 . . . . 0.0 111.911 164.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 m 126.77 44.05 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.487 1 C-N-CA 132.168 4.187 . . . . 0.0 111.281 165.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 14.4 mmm-85 -128.41 136.41 50.85 Favored 'General case' 0 N--CA 1.485 1.285 0 CA-C-O 123.708 1.718 . . . . 0.0 114.967 -156.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.379 0.6 OUTLIER -104.04 114.51 28.81 Favored 'General case' 0 N--CA 1.467 0.389 0 O-C-N 119.133 -2.23 . . . . 0.0 112.538 170.418 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.55 167.34 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 114.074 -2.87 . . . . 0.0 106.46 176.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -87.38 145.57 26.25 Favored 'General case' 0 N--CA 1.449 -0.524 1 O-C-N 129.466 4.229 . . . . 0.0 113.235 -171.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -58.12 -17.18 16.56 Favored 'General case' 0 C--O 1.224 -0.242 0 O-C-N 126.988 2.68 . . . . 0.0 114.212 -167.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.54 -37.75 8.43 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.726 1.603 . . . . 0.0 110.217 165.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.9 m0 -83.4 -10.52 58.37 Favored 'General case' 0 CA--C 1.565 1.526 0 CA-C-O 125.849 2.738 . . . . 0.0 108.685 -165.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.2 mttt -76.34 126.91 31.85 Favored 'General case' 0 C--N 1.355 0.82 0 O-C-N 116.67 -3.768 . . . . 0.0 107.786 166.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.2 m 66.94 15.59 10.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.135 1.161 . . . . 0.0 114.135 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -18.66 51.39 Favored 'General case' 0 C--N 1.33 -0.281 0 O-C-N 120.319 -1.488 . . . . 0.0 112.578 -175.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.475 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 93.63 -0.17 67.48 Favored Glycine 0 CA--C 1.529 0.923 0 CA-C-O 116.992 -2.004 . . . . 0.0 114.6 177.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 38.1 t0 -118.23 150.94 38.59 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 126.871 3.224 . . . . 0.0 113.901 170.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.493 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -61.95 53.48 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 127.741 2.417 . . . . 0.0 110.956 162.479 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -55.93 -28.97 59.31 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 125.754 1.622 . . . . 0.0 109.981 175.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.0 t -78.25 -14.03 59.61 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.91 2.884 . . . . 0.0 115.778 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.98 -32.68 0.13 Allowed 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 127.115 2.166 . . . . 0.0 114.879 -172.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.4 -22.14 55.12 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 127.542 2.337 . . . . 0.0 110.964 169.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 57.31 85.72 0.08 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 127.085 2.154 . . . . 0.0 111.491 -166.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.9 m -101.83 -62.82 1.21 Allowed 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 177.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -29.58 -68.95 0.07 Allowed 'General case' 0 C--O 1.242 0.692 0 C-N-CA 130.571 3.549 . . . . 0.0 111.004 166.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.475 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 11.8 mm-40 -86.31 19.19 2.83 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 119.384 -2.073 . . . . 0.0 112.679 -170.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -110.6 130.64 22.68 Favored Pre-proline 0 CA--C 1.543 0.71 0 CA-C-O 115.538 -2.172 . . . . 0.0 107.406 157.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -68.82 21.04 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.97 1 C-N-CA 125.845 4.363 . . . . 0.0 114.656 -170.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.94 -21.14 60.93 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.858 0.863 . . . . 0.0 110.395 154.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -118.36 -79.37 0.59 Allowed 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.584 1.554 . . . . 0.0 108.595 175.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 14.8 t -134.79 -66.38 0.59 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 177.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 26.6 t60 54.92 91.57 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.577 1.551 . . . . 0.0 113.612 -163.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.0 tt0 -74.13 -41.21 61.93 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.112 161.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 . . . . . 0 CA--C 1.535 0.385 0 C-N-CA 123.737 0.815 . . . . 0.0 110.601 175.775 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.248 0 N-CA-C 113.911 0.325 . . . . 0.0 113.911 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.1 m -167.75 160.9 9.98 Favored Pre-proline 0 N--CA 1.468 0.473 0 C-N-CA 126.439 1.896 . . . . 0.0 110.01 174.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -68.91 133.7 27.84 Favored 'Trans proline' 0 CA--C 1.544 0.988 0 C-N-CA 121.952 1.768 . . . . 0.0 110.119 173.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -69.76 -38.52 7.69 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 122.952 2.435 . . . . 0.0 112.035 177.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.619 HE21 ' HB3' ' A' ' 12' ' ' ALA . 55.4 mt-30 63.67 111.15 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.757 2.023 . . . . 0.0 110.892 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 60.9 -58.2 0.09 Allowed 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 128.85 2.86 . . . . 0.0 116.192 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.3 mt-30 -135.69 -167.54 0.15 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 130.144 3.378 . . . . 0.0 106.023 -178.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -77.09 81.13 2.69 Favored 'Trans proline' 0 CA--C 1.544 1.011 0 CA-C-N 123.734 2.369 . . . . 0.0 110.183 170.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 115.83 56.74 0.34 Allowed Glycine 0 C--N 1.347 1.18 0 N-CA-C 117.923 1.929 . . . . 0.0 117.923 173.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -124.55 -154.49 0.62 Allowed 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 119.765 1.783 . . . . 0.0 111.204 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -117.31 125.3 50.84 Favored 'General case' 0 CA--C 1.56 1.337 0 CA-C-O 128.349 3.928 . . . . 0.0 116.95 177.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.619 ' HB3' HE21 ' A' ' 5' ' ' GLN . . . -99.86 110.77 23.12 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 117.95 -2.969 . . . . 0.0 113.269 171.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 20.4 t -80.94 124.18 28.92 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 127.552 2.341 . . . . 0.0 110.733 175.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.33 -16.93 3.94 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 115.474 1.657 . . . . 0.0 115.474 174.06 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -68.47 -26.85 65.7 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 120.363 1.438 . . . . 0.0 111.922 169.012 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.4 m 126.23 53.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.315 1 C-N-CA 131.929 4.092 . . . . 0.0 110.907 168.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.91 135.04 48.51 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 123.622 1.677 . . . . 0.0 115.525 -170.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.368 0.5 OUTLIER -104.1 116.95 33.13 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 119.132 -2.23 . . . . 0.0 112.09 163.048 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -133.01 160.88 42.39 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 CA-C-O 115.139 -2.362 . . . . 0.0 104.838 176.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.86 153.42 30.61 Favored 'General case' 0 N--CA 1.442 -0.853 0 O-C-N 128.847 3.842 . . . . 0.0 112.567 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -59.68 -17.49 34.65 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 127.785 3.178 . . . . 0.0 113.863 -173.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.05 -20.67 1.02 Allowed 'General case' 0 CA--C 1.547 0.84 0 O-C-N 119.452 -2.03 . . . . 0.0 113.969 162.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 44.4 m0 -98.99 -4.3 32.9 Favored 'General case' 0 CA--C 1.564 1.491 0 CA-C-O 125.597 2.618 . . . . 0.0 112.403 -179.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -78.33 121.61 24.69 Favored 'General case' 0 C--N 1.352 0.714 0 O-C-N 116.935 -3.603 . . . . 0.0 109.425 168.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.261 4.2 p 39.14 58.66 1.81 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 116.069 1.877 . . . . 0.0 116.069 -169.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -89.79 -16.79 29.45 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.986 0.736 . . . . 0.0 112.986 159.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 107.69 -12.67 38.82 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-O 115.74 -2.7 . . . . 0.0 116.502 -170.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -119.27 146.98 44.79 Favored 'General case' 0 N--CA 1.477 0.917 1 CA-C-O 129.343 4.401 . . . . 0.0 117.601 -176.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.514 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -66.96 52.91 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.646 0 O-C-N 118.031 -2.918 . . . . 0.0 111.37 172.549 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.63 -31.97 27.28 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 126.572 1.949 . . . . 0.0 110.075 172.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 46.8 t -79.43 -13.36 59.64 Favored 'General case' 0 N--CA 1.442 -0.853 0 C-N-CA 127.66 2.384 . . . . 0.0 115.894 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.81 -34.27 0.12 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 127.391 2.276 . . . . 0.0 114.876 -171.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.39 -20.33 60.77 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 128.15 2.58 . . . . 0.0 110.765 171.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 51.63 81.15 0.08 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 126.552 1.941 . . . . 0.0 110.035 -162.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.5 m -85.62 -81.89 0.2 Allowed 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 104.814 -2.291 . . . . 0.0 104.814 168.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -16.12 -71.33 0.01 OUTLIER 'General case' 0 N--CA 1.438 -1.062 2 C-N-CA 135.422 5.489 . . . . 0.0 112.129 175.891 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 -74.84 1.68 12.02 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 112.759 -2.019 . . . . 0.0 114.451 -168.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -105.51 131.64 21.58 Favored Pre-proline 0 CA--C 1.539 0.541 0 CA-C-O 115.527 -2.178 . . . . 0.0 107.668 169.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -69.76 19.79 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.937 1 C-N-CA 126.639 4.892 . . . . 0.0 114.481 -167.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.45 -23.51 61.85 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.105 0.962 . . . . 0.0 110.507 154.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -117.48 -81.48 0.62 Allowed 'General case' 0 C--N 1.341 0.23 0 C-N-CA 126.366 1.866 . . . . 0.0 107.93 170.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 t -142.33 -171.53 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 118.313 0.506 . . . . 0.0 110.494 170.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -168.28 122.14 0.9 Allowed 'General case' 0 N--CA 1.467 0.425 0 O-C-N 120.032 -1.668 . . . . 0.0 108.977 168.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -78.16 68.92 4.29 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-O 122.019 0.914 . . . . 0.0 111.876 -177.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 . . . . . 0 CA--C 1.539 0.541 0 C-N-CA 126.947 2.099 . . . . 0.0 112.441 -179.98 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.482 ' N ' HE21 ' A' ' 5' ' ' GLN . . . . . . . . 0 CA--C 1.534 1.233 0 N-CA-C 114.619 0.608 . . . . 0.0 114.619 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.8 m -168.37 -58.27 0.01 OUTLIER Pre-proline 0 N--CA 1.474 0.747 0 C-N-CA 126.385 1.874 . . . . 0.0 111.451 172.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 98.7 Cg_endo -71.25 165.36 32.68 Favored 'Trans proline' 0 CA--C 1.547 1.15 0 C-N-CA 122.134 1.889 . . . . 0.0 111.7 171.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 98.0 Cg_endo -72.67 69.4 3.58 Favored 'Trans proline' 0 CA--C 1.543 0.973 0 C-N-CA 125.029 3.819 . . . . 0.0 111.301 174.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.482 HE21 ' N ' ' A' ' 1' ' ' GLY . 20.9 mp0 -17.0 -53.36 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.594 1 C-N-CA 133.731 4.812 . . . . 0.0 117.497 -175.648 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 1.7 t -137.27 -45.43 0.56 Allowed 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.627 2.371 . . . . 0.0 109.046 -179.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 10.3 mt-30 -138.85 171.75 7.67 Favored Pre-proline 0 CA--C 1.554 1.113 0 C-N-CA 130.473 3.509 . . . . 0.0 105.164 169.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -73.33 79.96 2.02 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.431 2.088 . . . . 0.0 112.146 -177.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 131.78 50.76 0.1 OUTLIER Glycine 0 C--N 1.341 0.848 0 C-N-CA 124.407 1.003 . . . . 0.0 114.317 -177.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -134.41 -166.47 1.81 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.508 1.123 . . . . 0.0 111.337 -169.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -115.84 122.66 46.06 Favored 'General case' 0 CA--C 1.558 1.283 1 CA-C-O 128.66 4.076 . . . . 0.0 117.115 177.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -100.22 106.67 18.37 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 118.355 -2.716 . . . . 0.0 111.707 171.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.409 ' SG ' ' HB3' ' A' ' 15' ' ' ASN . 19.8 t -85.47 129.6 34.78 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 126.217 1.807 . . . . 0.0 112.082 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.87 -22.22 2.09 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 171.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.409 ' HB3' ' SG ' ' A' ' 13' ' ' CYS . 24.5 t-20 -65.48 -25.21 67.39 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 120.256 1.389 . . . . 0.0 112.288 169.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.5 m 125.57 44.91 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.441 1 C-N-CA 132.145 4.178 . . . . 0.0 111.056 166.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 13.6 mmm-85 -127.63 134.4 49.66 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-O 123.628 1.68 . . . . 0.0 114.943 -157.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.312 0.5 OUTLIER -102.54 115.22 30.14 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 119.422 -2.049 . . . . 0.0 111.147 167.749 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -135.92 169.0 21.46 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.321 0 CA-C-O 114.637 -2.602 . . . . 0.0 106.073 174.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -93.95 149.09 21.54 Favored 'General case' 0 N--CA 1.447 -0.607 0 O-C-N 128.595 3.685 . . . . 0.0 113.105 -168.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -59.66 -17.29 32.71 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 126.882 2.614 . . . . 0.0 114.008 -167.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -46.09 -26.68 0.79 Allowed 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.172 -1.58 . . . . 0.0 113.247 162.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.7 m0 -99.91 -10.75 21.34 Favored 'General case' 0 CA--C 1.565 1.557 0 CA-C-O 126.081 2.848 . . . . 0.0 110.19 -172.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.5 mtpt -72.03 139.75 48.69 Favored 'General case' 0 C--N 1.355 0.837 1 O-C-N 115.537 -4.477 . . . . 0.0 107.153 165.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 3.9 m 64.35 10.1 5.42 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 173.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -76.05 -41.34 50.99 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.768 1.627 . . . . 0.0 110.622 -170.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.428 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 119.16 -1.39 14.59 Favored Glycine 0 CA--C 1.528 0.868 0 CA-C-O 116.553 -2.248 . . . . 0.0 115.444 -179.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -118.23 151.32 37.87 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 127.398 3.475 . . . . 0.0 113.965 166.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.507 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -62.39 63.31 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 O-C-N 119.43 -2.044 . . . . 0.0 109.388 163.514 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -65.82 -24.57 66.93 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 120.631 -1.293 . . . . 0.0 109.47 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.7 t -67.33 -13.0 61.59 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 128.54 2.736 . . . . 0.0 115.705 166.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 65.06 -38.42 0.24 Allowed 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 128.147 2.579 . . . . 0.0 114.56 -173.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -86.65 -9.82 55.18 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.175 2.19 . . . . 0.0 111.028 174.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 43.0 t30 62.86 128.4 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 129.211 3.004 . . . . 0.0 112.546 -167.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.5 m -147.47 -52.15 0.2 Allowed 'General case' 0 C--O 1.212 -0.873 0 O-C-N 120.214 -1.554 . . . . 0.0 111.925 164.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -28.41 -69.46 0.05 Allowed 'General case' 0 C--O 1.244 0.809 0 CA-C-O 127.912 3.72 . . . . 0.0 111.84 157.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.428 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 6.0 mm-40 -92.99 23.17 4.4 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 118.434 -2.666 . . . . 0.0 112.244 -173.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.99 119.62 54.89 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-O 114.458 -2.687 . . . . 0.0 106.045 152.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -65.52 19.63 0.08 OUTLIER 'Trans proline' 0 CA--C 1.543 0.926 1 C-N-CA 126.488 4.792 . . . . 0.0 115.497 -168.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -76.38 -21.08 56.51 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.567 1.147 . . . . 0.0 110.319 156.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.2 tt -108.11 -81.2 0.57 Allowed 'General case' 0 C--N 1.343 0.315 0 C-N-CA 125.179 1.392 . . . . 0.0 108.559 172.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 5.4 t -138.86 -59.03 0.61 Allowed 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 116.557 2.058 . . . . 0.0 116.557 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 21.9 t-80 56.21 93.47 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 125.62 1.568 . . . . 0.0 114.395 -170.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 56.69 90.26 0.04 OUTLIER 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.7 1.6 . . . . 0.0 114.547 171.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 33.0 t-80 . . . . . 0 N--CA 1.469 0.494 0 C-N-CA 125.896 1.679 . . . . 0.0 112.724 -171.414 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.101 0 CA-C-O 121.425 0.458 . . . . 0.0 112.269 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.4 m -163.77 156.84 15.84 Favored Pre-proline 0 N--CA 1.469 0.523 0 C-N-CA 125.133 1.373 . . . . 0.0 110.062 172.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -74.42 121.5 6.83 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 122.922 2.415 . . . . 0.0 111.049 -179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -71.73 -44.34 1.03 Allowed 'Trans proline' 0 C--N 1.35 0.653 0 C-N-CA 122.868 2.379 . . . . 0.0 112.207 178.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 87.0 -25.1 0.1 Allowed 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 129.972 3.309 . . . . 0.0 116.019 168.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.9 t -155.82 -50.53 0.08 Allowed 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 125.585 1.554 . . . . 0.0 110.524 171.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.1 mt-30 -135.01 178.6 1.69 Allowed Pre-proline 0 CA--C 1.551 0.995 0 C-N-CA 131.085 3.754 . . . . 0.0 104.951 171.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -74.76 71.39 4.84 Favored 'Trans proline' 0 CA--C 1.547 1.164 0 CA-C-N 123.331 2.225 . . . . 0.0 113.297 -173.737 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.81 50.4 0.06 OUTLIER Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.855 1.217 . . . . 0.0 114.871 177.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -129.37 -166.03 1.6 Allowed 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 118.885 1.342 . . . . 0.0 112.914 -165.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -117.09 123.54 47.04 Favored 'General case' 0 CA--C 1.561 1.367 1 CA-C-O 128.542 4.02 . . . . 0.0 117.166 -178.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.57 108.17 20.71 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 117.871 -3.018 . . . . 0.0 112.374 168.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 13.5 t -79.78 126.39 30.9 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 126.31 1.844 . . . . 0.0 110.471 176.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.17 -17.4 2.76 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 115.764 1.764 . . . . 0.0 115.764 173.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -69.07 -24.33 64.15 Favored 'General case' 0 CA--C 1.546 0.796 0 CA-C-N 120.459 1.481 . . . . 0.0 111.733 168.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.7 m 122.94 51.26 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.25 1 C-N-CA 131.897 4.079 . . . . 0.0 110.171 167.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 4.0 mmm180 -127.59 136.06 51.14 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 123.605 1.669 . . . . 0.0 115.445 -167.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.283 0.2 OUTLIER -99.17 115.87 30.06 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 119.455 -2.028 . . . . 0.0 111.068 165.004 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.67 163.31 37.8 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 115.096 -2.383 . . . . 0.0 105.81 173.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -85.48 142.06 29.48 Favored 'General case' 0 N--CA 1.442 -0.849 1 O-C-N 130.105 4.628 . . . . 0.0 111.799 -174.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -58.2 -16.86 15.25 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 127.295 2.872 . . . . 0.0 113.909 -169.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -52.87 -19.85 2.85 Favored 'General case' 0 CA--C 1.553 1.062 0 O-C-N 119.591 -1.943 . . . . 0.0 113.253 163.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 31.6 m0 -92.7 -10.29 37.69 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 126.077 2.846 . . . . 0.0 112.001 179.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.6 mttt -75.96 120.68 21.63 Favored 'General case' 0 C--N 1.353 0.731 1 O-C-N 116.009 -4.182 . . . . 0.0 108.343 171.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.257 1.6 p 42.83 57.76 3.47 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 114.016 1.117 . . . . 0.0 114.016 -164.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -87.83 -26.5 22.78 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.169 -0.923 . . . . 0.0 112.105 162.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.421 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 104.84 -3.17 41.62 Favored Glycine 0 CA--C 1.531 1.059 0 CA-C-O 116.966 -2.019 . . . . 0.0 114.712 -174.3 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -123.99 152.39 42.61 Favored 'General case' 0 CA--C 1.542 0.673 0 CA-C-O 127.862 3.696 . . . . 0.0 114.471 174.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.468 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -64.09 55.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 127.877 2.471 . . . . 0.0 110.472 168.557 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.49 -27.7 62.77 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.704 1.601 . . . . 0.0 110.139 176.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 40.5 t -80.52 -13.69 58.87 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 128.263 2.625 . . . . 0.0 115.897 173.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 63.0 -32.62 0.11 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.479 2.312 . . . . 0.0 115.06 -172.093 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -22.39 59.65 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 127.69 2.396 . . . . 0.0 110.903 169.106 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.0 t-20 58.6 87.06 0.08 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.352 2.261 . . . . 0.0 111.044 -168.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -106.44 -62.89 1.33 Allowed 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.162 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -28.86 -67.9 0.07 Allowed 'General case' 0 C--O 1.245 0.82 0 CA-C-O 127.369 3.462 . . . . 0.0 111.569 164.104 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.485 ' HA ' ' HA ' ' A' ' 43' ' ' HIS . 26.9 mm-40 -82.37 11.82 5.11 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 112.676 -2.056 . . . . 0.0 113.752 -170.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -107.46 131.67 21.54 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-O 115.183 -2.341 . . . . 0.0 107.074 163.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -68.51 22.1 0.14 Allowed 'Trans proline' 0 CA--C 1.543 0.961 1 C-N-CA 126.073 4.516 . . . . 0.0 114.498 -171.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.83 -20.6 59.69 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.141 0.976 . . . . 0.0 110.227 154.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.0 tt -119.83 -82.05 0.64 Allowed 'General case' 0 C--N 1.344 0.333 0 C-N-CA 125.614 1.566 . . . . 0.0 108.977 178.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 15.1 t -140.02 -50.61 0.48 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 116.791 2.145 . . . . 0.0 116.791 177.43 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.485 ' HA ' ' HA ' ' A' ' 37' ' ' GLU . 37.1 t-80 57.31 98.98 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.353 1.612 . . . . 0.0 115.353 -173.116 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -69.17 103.03 1.81 Allowed 'General case' 0 CA--C 1.541 0.629 0 O-C-N 121.419 -0.8 . . . . 0.0 111.078 170.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 23.9 p-80 . . . . . 0 CA--C 1.538 0.507 0 C-N-CA 126.211 1.804 . . . . 0.0 113.126 -179.993 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.204 0 CA-C-O 119.201 -0.777 . . . . 0.0 114.083 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 64.6 m 32.78 66.43 1.12 Allowed Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 128.427 2.691 . . . . 0.0 114.8 -178.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -59.63 163.58 12.92 Favored 'Trans proline' 0 CA--C 1.549 1.239 0 C-N-CA 122.958 2.438 . . . . 0.0 113.642 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -73.07 -23.49 18.23 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 123.79 2.993 . . . . 0.0 114.84 -178.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 49.1 mm-40 79.34 -105.54 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.323 2.249 . . . . 0.0 112.323 177.593 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -78.31 -45.2 23.3 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 119.773 1.17 . . . . 0.0 112.63 -174.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -152.1 174.29 3.76 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 130.989 3.716 . . . . 0.0 105.605 -177.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -68.08 84.41 0.44 Allowed 'Trans proline' 0 CA--C 1.545 1.069 0 CA-C-N 123.275 2.205 . . . . 0.0 113.981 -174.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.16 2.08 1.41 Allowed Glycine 0 CA--C 1.534 1.265 0 N-CA-C 117.168 1.627 . . . . 0.0 117.168 171.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -87.2 -162.12 0.76 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.597 1.199 . . . . 0.0 113.764 -153.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -113.71 124.11 51.5 Favored 'General case' 0 CA--C 1.559 1.299 1 CA-C-O 128.671 4.081 . . . . 0.0 117.157 175.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.77 110.85 23.39 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 117.958 -2.964 . . . . 0.0 113.071 166.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 43.6 t -79.14 122.8 26.7 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 125.515 1.526 . . . . 0.0 110.682 171.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.2 -13.57 5.28 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 173.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.99 -27.23 67.27 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 120.523 1.51 . . . . 0.0 111.996 166.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.7 m 128.31 52.12 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.389 1 C-N-CA 132.01 4.124 . . . . 0.0 111.319 166.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 -130.27 132.18 45.8 Favored 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 123.615 1.674 . . . . 0.0 115.497 -168.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.314 0.5 OUTLIER -100.42 117.67 35.07 Favored 'General case' 0 N--CA 1.47 0.529 0 O-C-N 118.911 -2.368 . . . . 0.0 111.015 165.428 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.83 165.48 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.191 0 CA-C-O 115.146 -2.359 . . . . 0.0 106.059 174.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -91.23 152.1 20.66 Favored 'General case' 0 N--CA 1.446 -0.633 1 O-C-N 129.16 4.037 . . . . 0.0 112.909 -170.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -60.63 -16.83 42.65 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 126.831 2.582 . . . . 0.0 114.123 -167.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 4.0 ttt180 -44.09 -27.06 0.35 Allowed 'General case' 0 CA--C 1.552 1.022 0 O-C-N 119.655 -1.903 . . . . 0.0 113.562 160.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 2.6 m0 -101.47 -6.67 23.66 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 126.354 2.978 . . . . 0.0 110.693 -172.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.8 mtpt -76.4 118.33 18.97 Favored 'General case' 0 C--N 1.356 0.855 1 O-C-N 116.189 -4.07 . . . . 0.0 108.045 172.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.251 2.0 p 46.98 46.42 15.8 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 -174.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.3 p30 -75.76 -23.58 55.98 Favored 'General case' 0 CA--C 1.537 0.467 0 O-C-N 121.145 -0.972 . . . . 0.0 111.693 151.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 92.56 5.0 65.36 Favored Glycine 0 CA--C 1.529 0.928 0 CA-C-O 117.262 -1.854 . . . . 0.0 114.101 -165.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -90.65 128.28 36.57 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 124.383 2.039 . . . . 0.0 110.094 175.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -44.26 -36.85 2.92 Favored 'General case' 0 C--N 1.342 0.25 0 CA-C-O 116.549 -1.691 . . . . 0.0 113.561 175.838 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 34.74 -50.1 0.0 OUTLIER 'General case' 0 C--N 1.35 0.624 1 C-N-CA 138.681 6.792 . . . . 0.0 114.72 173.479 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 39.5 t -69.92 -20.6 63.35 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 128.513 2.725 . . . . 0.0 115.601 166.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.63 -39.0 0.42 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 126.927 2.091 . . . . 0.0 112.419 -173.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.45 -14.38 61.24 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 126.946 2.098 . . . . 0.0 110.311 170.422 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 52.41 65.44 1.51 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 127.296 2.239 . . . . 0.0 110.086 -174.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.9 m -78.93 -60.7 2.27 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 106.123 -1.806 . . . . 0.0 106.123 -176.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.496 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 18.5 p-10 -57.82 -49.93 74.98 Favored 'General case' 0 C--O 1.246 0.869 0 CA-C-O 126.577 3.084 . . . . 0.0 111.478 -176.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.5 mm-40 -71.01 9.75 0.66 Allowed 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 112.631 -2.077 . . . . 0.0 114.144 176.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.58 137.69 22.28 Favored Pre-proline 0 CA--C 1.543 0.693 0 CA-C-O 116.411 -1.757 . . . . 0.0 108.659 157.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -69.76 21.04 0.17 Allowed 'Trans proline' 0 CA--C 1.541 0.863 1 C-N-CA 126.145 4.563 . . . . 0.0 114.308 -171.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.36 -22.14 64.68 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 123.097 0.559 . . . . 0.0 110.276 151.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.496 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 5.7 tt -121.28 -76.56 0.58 Allowed 'General case' 0 C--N 1.342 0.27 0 C-N-CA 126.015 1.726 . . . . 0.0 108.977 176.458 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 34.1 t -139.71 -68.5 0.42 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 178.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.2 t60 60.53 136.52 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 127.383 2.273 . . . . 0.0 114.768 -164.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -146.93 -63.33 0.29 Allowed 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.693 0.797 . . . . 0.0 111.744 172.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 13.6 t60 . . . . . 0 N--CA 1.471 0.609 0 C-N-CA 125.754 1.622 . . . . 0.0 113.058 -176.952 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.253 0 CA-C-O 119.663 -0.52 . . . . 0.0 114.023 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 80.7 p -64.4 113.65 11.31 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 125.873 1.669 . . . . 0.0 111.146 176.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.48 114.35 3.24 Favored 'Trans proline' 0 CA--C 1.547 1.125 0 C-N-CA 123.118 2.545 . . . . 0.0 111.239 -177.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -70.53 -41.55 3.22 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.789 2.993 . . . . 0.0 113.188 -171.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 39.3 mt-30 67.17 117.17 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 127.61 2.364 . . . . 0.0 111.819 173.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER 64.56 -58.94 0.23 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 127.739 2.416 . . . . 0.0 114.609 -179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -139.14 -172.83 0.33 Allowed Pre-proline 0 CA--C 1.555 1.16 0 C-N-CA 130.862 3.665 . . . . 0.0 106.187 -177.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.62 79.62 2.76 Favored 'Trans proline' 0 CA--C 1.544 1.021 0 CA-C-N 123.388 2.246 . . . . 0.0 110.761 171.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 119.47 57.16 0.25 Allowed Glycine 0 C--N 1.346 1.12 0 N-CA-C 117.285 1.674 . . . . 0.0 117.285 173.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -127.39 -160.62 1.02 Allowed 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 119.737 1.768 . . . . 0.0 111.504 178.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 7.3 t80 -108.89 122.95 48.28 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 127.915 3.721 . . . . 0.0 115.962 176.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.05 110.48 23.05 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 118.239 -2.788 . . . . 0.0 113.314 166.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 21.3 t -77.74 124.1 27.53 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.121 1.768 . . . . 0.0 110.68 171.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.04 -19.72 2.03 Favored 'General case' 0 CA--C 1.549 0.913 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 172.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -70.4 -24.25 62.9 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 120.279 1.399 . . . . 0.0 112.297 170.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m 125.59 52.17 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 131.666 3.987 . . . . 0.0 110.822 166.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 3.1 mmm180 -128.48 132.97 48.37 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 123.472 1.606 . . . . 0.0 115.141 -169.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.375 0.5 OUTLIER -105.09 117.05 33.03 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 119.022 -2.299 . . . . 0.0 112.45 167.206 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.68 166.14 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 114.203 -2.808 . . . . 0.0 106.318 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -88.81 144.41 26.24 Favored 'General case' 0 N--CA 1.449 -0.476 1 O-C-N 129.311 4.132 . . . . 0.0 113.103 -170.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -58.3 -15.22 9.45 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 127.12 2.763 . . . . 0.0 114.318 -167.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 33.7 ttp85 -50.64 -28.12 8.23 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 120.218 -1.551 . . . . 0.0 112.449 164.436 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.9 m0 -91.99 -4.3 54.74 Favored 'General case' 0 CA--C 1.561 1.385 0 CA-C-O 126.146 2.879 . . . . 0.0 110.132 -172.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.402 ' HB3' HD21 ' A' ' 41' ' ' LEU . 17.8 mttt -78.82 105.91 10.46 Favored 'General case' 0 C--N 1.351 0.672 0 O-C-N 116.425 -3.922 . . . . 0.0 108.265 170.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 12.8 p 48.08 57.16 6.38 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -168.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -81.06 -37.78 28.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.979 -1.009 . . . . 0.0 112.231 145.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.14 -19.96 8.12 Favored Glycine 0 CA--C 1.537 1.457 0 CA-C-O 117.09 -1.95 . . . . 0.0 116.036 -173.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -78.95 139.82 38.16 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 125.941 2.782 . . . . 0.0 111.864 173.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 20.8 m120 -54.79 8.45 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 118.536 -2.603 . . . . 0.0 117.572 -176.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -55.18 -24.18 25.58 Favored 'General case' 0 C--N 1.325 -0.487 1 C-N-CA 133.002 4.521 . . . . 0.0 112.728 -120.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 53.2 t -61.63 -20.68 63.65 Favored 'General case' 0 N--CA 1.435 -1.206 0 C-N-CA 130.192 3.397 . . . . 0.0 117.894 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 66.45 -32.28 0.17 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 128.106 2.563 . . . . 0.0 113.777 -171.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -15.98 62.07 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 126.395 1.878 . . . . 0.0 110.649 160.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.83 63.49 2.12 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.285 1.834 . . . . 0.0 110.336 -178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -79.33 -59.02 2.93 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.674 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -38.93 -66.0 0.32 Allowed 'General case' 0 C--O 1.249 1.039 1 CA-C-O 128.55 4.024 . . . . 0.0 110.974 177.216 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -82.08 19.66 1.12 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 110.473 -3.058 . . . . 0.0 112.909 -175.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -116.2 136.64 23.06 Favored Pre-proline 0 CA--C 1.543 0.702 0 CA-C-O 115.449 -2.215 . . . . 0.0 108.076 153.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 81.0 Cg_endo -67.61 19.69 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.987 1 C-N-CA 125.911 4.407 . . . . 0.0 114.688 -173.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.62 -21.86 62.6 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 123.863 0.865 . . . . 0.0 110.64 154.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.674 HD22 ' HA ' ' A' ' 36' ' ' ASP . 9.1 tt -119.19 -75.98 0.58 Allowed 'General case' 0 CA--C 1.515 -0.379 0 C-N-CA 126.02 1.728 . . . . 0.0 108.23 177.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 50.9 t -145.92 -59.83 0.32 Allowed 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.726 1.38 . . . . 0.0 114.726 170.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 2.8 t60 49.06 -64.22 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 -160.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -91.9 93.19 8.69 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 120.88 -1.137 . . . . 0.0 110.617 -174.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 2.8 t60 . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.191 1.396 . . . . 0.0 112.503 -175.021 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.225 0 CA-C-O 119.664 -0.52 . . . . 0.0 114.184 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 29.7 m -60.59 128.81 88.9 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 124.858 1.263 . . . . 0.0 111.415 177.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -71.0 121.47 7.89 Favored 'Trans proline' 0 CA--C 1.547 1.172 0 C-N-CA 122.931 2.42 . . . . 0.0 112.318 -172.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -77.9 48.33 2.61 Favored 'Trans proline' 0 CA--C 1.543 0.926 0 C-N-CA 125.119 3.879 . . . . 0.0 112.519 -179.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 -63.93 141.86 58.62 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.973 1.709 . . . . 0.0 110.959 174.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 61.62 -71.36 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.841 1.656 . . . . 0.0 110.789 -155.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 -150.35 167.03 13.81 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 126.787 2.035 . . . . 0.0 108.808 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -69.14 78.19 0.81 Allowed 'Trans proline' 0 CA--C 1.539 0.759 0 C-N-CA 123.154 2.569 . . . . 0.0 112.194 173.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.72 38.96 0.11 Allowed Glycine 0 N--CA 1.47 0.91 0 N-CA-C 115.738 1.055 . . . . 0.0 115.738 179.533 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -132.26 -170.46 2.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.657 1.183 . . . . 0.0 111.537 -171.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -111.93 121.64 45.57 Favored 'General case' 0 CA--C 1.56 1.359 1 CA-C-O 128.844 4.164 . . . . 0.0 116.675 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.23 107.48 19.96 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 118.216 -2.802 . . . . 0.0 112.824 170.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 37.6 t -83.55 123.56 29.88 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 125.752 1.621 . . . . 0.0 111.334 175.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.36 -12.76 4.1 Favored 'General case' 0 CA--C 1.55 0.953 0 N-CA-C 115.613 1.709 . . . . 0.0 115.613 173.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -66.74 -29.6 69.62 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 120.858 1.663 . . . . 0.0 111.775 165.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.4 m 127.95 55.92 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.283 1 C-N-CA 132.052 4.141 . . . . 0.0 110.732 168.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -132.51 132.46 42.67 Favored 'General case' 0 N--CA 1.481 1.086 0 CA-C-O 124.19 1.948 . . . . 0.0 115.344 -168.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.255 0.3 OUTLIER -98.66 119.38 37.3 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 118.863 -2.398 . . . . 0.0 110.493 161.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.24 168.47 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-O 115.028 -2.415 . . . . 0.0 105.993 171.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.8 pt20 -93.84 150.81 20.06 Favored 'General case' 0 N--CA 1.447 -0.581 0 O-C-N 128.366 3.541 . . . . 0.0 112.979 -169.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -60.2 -16.1 30.19 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 126.756 2.535 . . . . 0.0 114.305 -166.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 5.2 ttt180 -45.92 -26.82 0.76 Allowed 'General case' 0 CA--C 1.55 0.973 0 O-C-N 120.117 -1.614 . . . . 0.0 113.297 161.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 3.8 m0 -99.03 -5.44 30.37 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-O 126.844 3.211 . . . . 0.0 110.377 -172.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.52 ' HG2' HD21 ' A' ' 41' ' ' LEU . 15.7 mttt -76.99 109.94 11.21 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 115.683 -4.385 . . . . 0.0 109.255 171.327 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 25.3 p 42.47 53.88 4.53 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 115.983 1.845 . . . . 0.0 115.983 -169.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -68.05 -25.87 65.57 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.251 140.462 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 94.37 14.38 51.05 Favored Glycine 0 CA--C 1.53 0.976 0 CA-C-O 117.179 -1.901 . . . . 0.0 113.313 -167.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -110.35 139.32 45.66 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-O 126.555 3.074 . . . . 0.0 113.68 173.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -40.59 -40.3 1.23 Allowed 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 127.706 2.402 . . . . 0.0 114.363 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 30.42 -47.52 0.0 OUTLIER 'General case' 0 C--N 1.348 0.504 1 C-N-CA 139.146 6.978 . . . . 0.0 114.857 178.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 44.0 t -73.88 -24.81 59.78 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 129.982 3.313 . . . . 0.0 116.29 169.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 70.0 -27.52 0.16 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 126.994 2.118 . . . . 0.0 113.941 -178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.2 -13.96 59.64 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.87 2.068 . . . . 0.0 110.788 158.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 49.82 58.12 5.79 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.376 2.27 . . . . 0.0 110.793 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 m -69.78 -58.61 3.69 Favored 'General case' 0 C--O 1.22 -0.488 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 179.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.573 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -36.66 -65.11 0.3 Allowed 'General case' 0 C--O 1.248 0.987 1 C-N-CA 131.798 4.039 . . . . 0.0 110.669 173.069 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -82.27 16.58 1.96 Allowed 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 111.035 -2.802 . . . . 0.0 113.513 -173.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.68 136.53 22.02 Favored Pre-proline 0 CA--C 1.543 0.688 0 CA-C-O 115.689 -2.1 . . . . 0.0 108.174 155.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -68.89 20.9 0.15 Allowed 'Trans proline' 0 CA--C 1.543 0.959 1 C-N-CA 125.768 4.312 . . . . 0.0 114.552 -173.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.34 -21.35 62.91 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.629 0.772 . . . . 0.0 110.403 152.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 36' ' ' ASP . 6.3 tt -120.42 -76.86 0.58 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 125.78 1.632 . . . . 0.0 108.828 176.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 52.2 t -142.38 -61.5 0.44 Allowed 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.8 t60 60.95 120.52 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.726 2.01 . . . . 0.0 115.565 -166.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -129.87 166.14 20.59 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.336 0.654 . . . . 0.0 110.879 157.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 6.3 p-80 . . . . . 0 CA--C 1.533 0.315 0 C-N-CA 125.013 1.325 . . . . 0.0 110.888 -179.648 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.252 0 CA-C-O 119.098 -0.834 . . . . 0.0 114.156 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 55.5 m 34.73 59.18 2.31 Favored Pre-proline 0 CA--C 1.547 0.855 0 C-N-CA 128.173 2.589 . . . . 0.0 114.676 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.84 124.08 10.32 Favored 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.924 2.416 . . . . 0.0 112.481 -170.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -77.27 47.02 2.13 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 125.049 3.833 . . . . 0.0 112.758 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -63.98 146.54 53.91 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.801 1.64 . . . . 0.0 110.778 172.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 61.68 -72.54 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.668 1.587 . . . . 0.0 110.85 -157.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 24.4 mt-30 -150.48 166.11 15.88 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 126.986 2.114 . . . . 0.0 108.78 -179.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -70.22 78.95 1.13 Allowed 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.05 2.5 . . . . 0.0 112.547 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.26 37.55 0.09 OUTLIER Glycine 0 CA--C 1.53 0.996 0 C-N-CA 124.685 1.136 . . . . 0.0 115.209 178.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -131.03 -170.14 2.3 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.0 1.32 . . . . 0.0 111.598 -168.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -113.75 122.41 47.0 Favored 'General case' 0 CA--C 1.56 1.33 1 CA-C-O 128.987 4.232 . . . . 0.0 116.546 -178.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.88 109.6 22.28 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 118.233 -2.792 . . . . 0.0 112.394 170.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 36.5 t -83.48 124.24 30.52 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 126.352 1.861 . . . . 0.0 111.307 175.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.53 -12.91 4.5 Favored 'General case' 0 CA--C 1.55 0.979 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 174.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.5 -29.34 69.42 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.871 1.669 . . . . 0.0 111.84 165.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 21.2 m 128.02 52.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.354 1 C-N-CA 132.186 4.194 . . . . 0.0 110.901 169.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 1.7 mmm180 -130.08 134.83 47.63 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 124.419 2.057 . . . . 0.0 115.66 -167.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.73 121.39 39.58 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 118.77 -2.456 . . . . 0.0 110.428 162.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.22 164.15 30.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.333 0 CA-C-O 114.765 -2.541 . . . . 0.0 105.964 169.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -88.84 151.21 22.5 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 128.541 3.65 . . . . 0.0 112.721 -172.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -61.21 -16.0 40.4 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 126.39 2.306 . . . . 0.0 114.697 -166.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.39 -38.14 2.62 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-N 120.692 1.587 . . . . 0.0 110.792 161.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 5.7 m95 -88.87 -5.5 57.98 Favored 'General case' 0 CA--C 1.558 1.287 0 CA-C-O 124.788 2.232 . . . . 0.0 108.982 -164.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.426 ' HA ' ' HB2' ' A' ' 36' ' ' ASP . 18.3 mttt -77.97 134.91 37.76 Favored 'General case' 0 C--N 1.358 0.945 0 O-C-N 117.983 -2.948 . . . . 0.0 109.443 165.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.8 m 60.33 15.29 5.29 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -175.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.54 -11.15 58.65 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 126.263 1.825 . . . . 0.0 112.104 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 72.96 -3.51 28.24 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-O 116.997 -2.001 . . . . 0.0 114.481 -179.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -91.16 133.97 34.93 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 126.479 3.037 . . . . 0.0 111.18 165.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -35.3 -44.92 0.29 Allowed 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 128.368 2.667 . . . . 0.0 112.872 169.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 35.64 -49.87 0.0 OUTLIER 'General case' 0 C--N 1.349 0.546 1 C-N-CA 138.746 6.818 . . . . 0.0 114.288 175.498 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 25.5 t -65.09 -23.87 67.28 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 129.469 3.108 . . . . 0.0 115.518 163.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.62 -25.34 0.15 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.997 2.119 . . . . 0.0 113.881 -178.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.7 -11.89 56.59 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.223 2.209 . . . . 0.0 110.762 163.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.0 m120 51.1 64.06 1.99 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 127.191 2.196 . . . . 0.0 109.891 -174.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 2.3 m -77.13 -60.86 2.19 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 105.614 -1.995 . . . . 0.0 105.614 -176.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.49 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 17.4 p-10 -57.03 -52.0 67.0 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-O 126.111 2.863 . . . . 0.0 111.234 -175.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -75.09 15.58 0.4 Allowed 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 113.091 -1.868 . . . . 0.0 113.31 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -118.09 143.44 32.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-O 117.06 -1.448 . . . . 0.0 109.634 155.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -71.05 21.66 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.847 1 C-N-CA 125.823 4.349 . . . . 0.0 114.25 -171.379 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.65 -21.42 64.46 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 110.235 151.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.49 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 8.5 tt -128.72 -75.97 0.56 Allowed 'General case' 0 C--N 1.343 0.295 0 C-N-CA 125.743 1.617 . . . . 0.0 108.792 179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 35.5 t -132.41 -76.42 0.5 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 114.295 1.221 . . . . 0.0 114.295 177.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.6 t60 58.32 -48.73 0.05 Allowed 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.118 2.167 . . . . 0.0 115.0 -160.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -146.69 159.43 43.48 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.459 1.503 . . . . 0.0 111.094 178.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 3.5 t-80 . . . . . 0 CA--C 1.539 0.524 0 C-N-CA 123.78 0.832 . . . . 0.0 110.322 179.502 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 1.132 0 CA-C-O 119.767 -0.463 . . . . 0.0 114.039 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 72.3 m -71.93 145.48 89.16 Favored Pre-proline 0 CA--C 1.539 0.551 0 CA-C-N 117.969 0.885 . . . . 0.0 111.253 172.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -70.54 148.75 60.7 Favored 'Trans proline' 0 CA--C 1.547 1.143 0 C-N-CA 122.434 2.089 . . . . 0.0 112.839 -178.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -75.79 77.75 3.3 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 124.294 3.329 . . . . 0.0 110.561 174.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 62.5 mt-30 -69.02 63.01 0.12 Allowed 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.626 1.97 . . . . 0.0 114.275 -174.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 5' ' ' GLN . 0.1 OUTLIER 121.84 -52.81 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.197 1 C-N-CA 134.884 5.274 . . . . 0.0 108.232 -177.493 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.5 mt-30 -143.43 168.02 14.06 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 127.694 2.398 . . . . 0.0 107.276 175.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -72.91 72.14 3.29 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.99 2.46 . . . . 0.0 112.187 178.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 147.53 41.7 0.04 OUTLIER Glycine 0 CA--C 1.531 1.035 0 C-N-CA 124.8 1.19 . . . . 0.0 114.652 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -136.2 -172.1 3.05 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.158 1.383 . . . . 0.0 111.578 -168.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -127.13 141.95 51.63 Favored 'General case' 0 N--CA 1.484 1.258 0 CA-C-O 111.819 -3.943 . . . . 0.0 112.715 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.404 ' HA ' ' O ' ' A' ' 17' ' ' ARG . . . -121.8 140.36 52.46 Favored 'General case' 0 CA--C 1.542 0.656 0 O-C-N 128.301 3.501 . . . . 0.0 114.861 166.749 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . 0.416 ' SG ' ' HB3' ' A' ' 15' ' ' ASN . 27.6 t -86.16 126.9 34.57 Favored 'General case' 0 N--CA 1.444 -0.751 0 C-N-CA 130.266 3.426 . . . . 0.0 110.674 -175.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.91 -15.69 5.36 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 115.374 1.62 . . . . 0.0 115.374 173.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.416 ' HB3' ' SG ' ' A' ' 13' ' ' CYS . 28.4 t-20 -67.88 -26.22 65.9 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 120.392 1.451 . . . . 0.0 112.069 167.359 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m 127.72 52.39 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.475 1 C-N-CA 131.938 4.095 . . . . 0.0 111.317 164.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.404 ' O ' ' HA ' ' A' ' 12' ' ' ALA . 1.4 mmm180 -132.38 133.21 43.67 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -166.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 1.5 p -99.37 123.74 43.9 Favored 'General case' 0 N--CA 1.475 0.797 0 O-C-N 117.623 -3.173 . . . . 0.0 111.043 169.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -138.66 169.37 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 CA-C-O 115.286 -2.292 . . . . 0.0 111.183 175.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.566 ' H ' ' NE2' ' A' ' 20' ' ' GLN . 1.8 pm0 -88.23 147.39 24.86 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 127.195 2.809 . . . . 0.0 114.279 -173.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -53.25 -18.33 2.31 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 129.045 2.938 . . . . 0.0 115.224 -169.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.75 -33.8 3.25 Favored 'General case' 0 N--CA 1.48 1.035 0 CA-C-N 121.215 1.825 . . . . 0.0 110.963 163.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 8.0 m0 -85.87 -8.56 57.98 Favored 'General case' 0 CA--C 1.558 1.26 0 CA-C-O 124.761 2.219 . . . . 0.0 109.825 -167.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.4 mtpt -76.23 108.02 8.88 Favored 'General case' 0 C--N 1.351 0.67 0 O-C-N 117.543 -3.223 . . . . 0.0 110.525 169.55 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 15.0 p 41.19 58.78 2.5 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.063 1.505 . . . . 0.0 115.063 -169.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.7 p30 -80.17 -27.0 39.03 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.891 143.322 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 91.6 4.37 67.9 Favored Glycine 0 CA--C 1.532 1.122 0 CA-C-O 118.103 -1.387 . . . . 0.0 113.555 -165.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -79.11 123.52 27.43 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-O 124.017 1.865 . . . . 0.0 108.139 168.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -52.71 -24.66 9.09 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 118.894 -2.379 . . . . 0.0 114.154 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 28.54 -48.41 0.0 OUTLIER 'General case' 0 C--N 1.347 0.467 1 C-N-CA 139.61 7.164 . . . . 0.0 114.65 175.149 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 52.5 t -70.47 -20.92 62.84 Favored 'General case' 0 N--CA 1.427 -1.595 0 C-N-CA 127.444 2.297 . . . . 0.0 115.915 168.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 70.36 -30.03 0.19 Allowed 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.939 2.096 . . . . 0.0 113.236 -176.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.27 -13.83 59.41 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 128.083 2.553 . . . . 0.0 111.415 170.69 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.9 m120 48.62 88.83 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.702 2.001 . . . . 0.0 110.814 -159.419 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.6 m -98.34 -68.24 0.81 Allowed 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 174.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -26.65 -66.6 0.06 Allowed 'General case' 0 C--O 1.248 1.009 0 CA-C-O 127.734 3.635 . . . . 0.0 111.952 153.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 17.3 mm-40 -91.46 25.81 2.49 Favored 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 112.327 -2.215 . . . . 0.0 112.634 -172.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -112.93 139.94 23.51 Favored Pre-proline 0 CA--C 1.543 0.694 0 CA-C-O 115.268 -2.301 . . . . 0.0 108.799 148.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.75 21.76 0.14 Allowed 'Trans proline' 0 CA--C 1.545 1.026 1 C-N-CA 125.789 4.326 . . . . 0.0 114.356 -175.173 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.32 -20.59 60.76 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.107 0.963 . . . . 0.0 110.27 154.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 6.9 tt -121.58 -81.11 0.63 Allowed 'General case' 0 C--N 1.344 0.361 0 C-N-CA 125.268 1.427 . . . . 0.0 108.782 178.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 46.2 t -146.37 -43.0 0.2 Allowed 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 117.224 2.305 . . . . 0.0 117.224 176.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 4.2 t-80 54.67 89.69 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 CA-C-N 121.167 1.803 . . . . 0.0 114.626 177.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -63.71 -44.94 92.13 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 113.081 0.771 . . . . 0.0 113.081 -178.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 3.5 t60 . . . . . 0 N--CA 1.468 0.44 0 C-N-CA 125.858 1.663 . . . . 0.0 112.672 176.885 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.264 0 CA-C-O 119.863 -0.409 . . . . 0.0 114.073 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 83.0 p -62.27 121.45 66.56 Favored Pre-proline 0 CA--C 1.542 0.643 0 C-N-CA 125.148 1.379 . . . . 0.0 110.861 174.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -63.71 115.95 3.37 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 C-N-CA 122.952 2.435 . . . . 0.0 110.419 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -68.85 -54.23 0.28 Allowed 'Trans proline' 0 C--N 1.351 0.66 0 C-N-CA 123.056 2.504 . . . . 0.0 112.432 -168.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 61.84 -43.51 0.15 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.384 2.674 . . . . 0.0 115.497 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -103.1 -68.17 0.85 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.982 1.713 . . . . 0.0 108.151 160.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -145.25 162.01 39.23 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 126.73 2.012 . . . . 0.0 108.759 177.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -70.93 75.18 1.73 Allowed 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.349 2.699 . . . . 0.0 112.25 -179.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.6 21.64 0.03 OUTLIER Glycine 0 CA--C 1.531 1.087 0 C-N-CA 125.006 1.289 . . . . 0.0 115.632 -176.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -125.53 -171.45 2.38 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 118.658 1.229 . . . . 0.0 112.318 -165.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.7 t80 -106.6 122.34 46.14 Favored 'General case' 0 CA--C 1.557 1.223 1 CA-C-O 128.768 4.127 . . . . 0.0 116.109 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -99.15 106.18 18.34 Favored 'General case' 0 CA--C 1.547 0.841 0 O-C-N 118.385 -2.697 . . . . 0.0 112.891 170.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 t -82.59 124.71 30.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 125.716 1.606 . . . . 0.0 111.173 178.363 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.08 -14.75 1.7 Allowed 'General case' 0 CA--C 1.547 0.86 0 N-CA-C 115.774 1.768 . . . . 0.0 115.774 176.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -63.89 -35.81 81.88 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 120.186 1.357 . . . . 0.0 111.079 166.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.9 m 132.45 49.11 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.282 1 C-N-CA 132.284 4.233 . . . . 0.0 111.488 170.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.1 mtt-85 -125.11 135.8 53.02 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 116.037 1.866 . . . . 0.0 116.037 -167.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.96 120.12 37.8 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 119.688 -1.883 . . . . 0.0 110.944 163.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -141.09 171.8 11.89 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 CA-C-O 114.532 -2.651 . . . . 0.0 106.37 171.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -94.7 147.04 23.72 Favored 'General case' 0 N--CA 1.449 -0.499 0 O-C-N 128.502 3.626 . . . . 0.0 113.287 -168.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -59.38 -15.92 19.65 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 126.759 2.537 . . . . 0.0 114.333 -168.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 -48.57 -25.89 1.95 Allowed 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.336 -1.477 . . . . 0.0 112.84 163.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.2 m0 -98.97 -2.84 36.42 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-O 126.227 2.917 . . . . 0.0 109.876 -171.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -79.38 121.92 25.75 Favored 'General case' 0 C--N 1.353 0.737 1 O-C-N 116.209 -4.057 . . . . 0.0 109.45 168.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . 0.271 1.9 p 45.07 51.56 8.84 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 115.573 1.694 . . . . 0.0 115.573 -172.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -90.8 -16.16 28.82 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 164.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.403 ' H ' ' CD ' ' A' ' 37' ' ' GLU . . . 107.54 -11.54 39.14 Favored Glycine 0 CA--C 1.538 1.525 0 CA-C-O 115.721 -2.71 . . . . 0.0 116.484 -172.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -117.35 145.12 44.26 Favored 'General case' 0 N--CA 1.477 0.911 1 CA-C-O 129.27 4.367 . . . . 0.0 117.342 -178.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.507 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -65.78 55.59 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 O-C-N 118.044 -2.91 . . . . 0.0 111.145 170.104 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.72 -31.48 62.53 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 126.532 1.933 . . . . 0.0 109.857 173.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 42.5 t -76.12 -15.05 60.16 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 127.928 2.491 . . . . 0.0 115.662 174.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.2 -39.2 0.14 Allowed 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 127.653 2.381 . . . . 0.0 113.732 -167.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -70.67 -16.64 62.82 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.26 2.224 . . . . 0.0 111.256 175.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 49.7 78.76 0.09 Allowed 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.359 2.264 . . . . 0.0 110.297 -166.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.6 m -84.75 -76.49 0.31 Allowed 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 115.386 -2.245 . . . . 0.0 105.421 167.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.412 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -22.55 -71.02 0.02 OUTLIER 'General case' 0 C--O 1.247 0.956 2 C-N-CA 134.936 5.294 . . . . 0.0 112.698 179.963 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.403 ' CD ' ' H ' ' A' ' 27' ' ' GLY . 41.4 mm-40 -73.44 7.01 2.55 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 110.761 -2.927 . . . . 0.0 114.248 -171.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -119.68 143.18 34.34 Favored Pre-proline 0 CA--C 1.542 0.66 0 CA-C-O 116.483 -1.722 . . . . 0.0 108.419 167.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -70.73 20.72 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.907 1 C-N-CA 125.904 4.403 . . . . 0.0 114.149 -170.767 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.25 -21.14 63.01 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.104 0.562 . . . . 0.0 110.132 152.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.412 HD22 ' HA ' ' A' ' 36' ' ' ASP . 6.2 tt -126.64 -77.79 0.58 Allowed 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 125.61 1.564 . . . . 0.0 109.414 176.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 49.0 t -136.25 -62.94 0.65 Allowed 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 57.86 -55.83 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 126.621 1.968 . . . . 0.0 115.584 -166.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 58.15 -23.79 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 129.935 3.294 . . . . 0.0 116.543 -175.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 24.6 t60 . . . . . 0 CA--C 1.532 0.282 0 C-N-CA 127.109 2.164 . . . . 0.0 112.939 175.686 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.077 0 N-CA-C 112.214 -0.354 . . . . 0.0 112.214 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.0 t -150.32 143.13 16.22 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.16 1.384 . . . . 0.0 109.484 177.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.17 115.21 4.18 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.122 2.548 . . . . 0.0 110.763 177.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -68.83 -49.6 0.71 Allowed 'Trans proline' 0 C--N 1.351 0.688 0 C-N-CA 122.807 2.338 . . . . 0.0 112.207 -176.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.473 ' NE2' ' H ' ' A' ' 12' ' ' ALA . 61.4 mt-30 63.93 110.89 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 127.042 2.137 . . . . 0.0 112.255 177.545 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER 66.94 -59.49 0.38 Allowed 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 128.134 2.574 . . . . 0.0 113.831 -176.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -141.74 -166.2 0.12 Allowed Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.07 3.348 . . . . 0.0 105.889 -177.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.4 Cg_endo -77.94 79.99 3.09 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 CA-C-N 123.99 2.461 . . . . 0.0 110.404 170.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 126.64 45.95 0.22 Allowed Glycine 0 C--N 1.348 1.206 0 N-CA-C 119.224 2.45 . . . . 0.0 119.224 169.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -125.83 -156.96 0.76 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 120.194 1.997 . . . . 0.0 111.228 178.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.3 t80 -114.93 126.84 55.25 Favored 'General case' 0 CA--C 1.558 1.288 1 CA-C-O 128.975 4.226 . . . . 0.0 116.785 174.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.473 ' H ' ' NE2' ' A' ' 5' ' ' GLN . . . -103.93 111.68 24.33 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 117.995 -2.941 . . . . 0.0 111.92 173.369 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.2 t -84.39 125.56 32.43 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 128.626 2.77 . . . . 0.0 111.075 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.02 -13.47 2.79 Favored 'General case' 0 CA--C 1.55 0.971 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 174.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -66.4 -30.51 70.9 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 120.764 1.62 . . . . 0.0 111.768 165.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.2 m 127.56 51.13 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.322 1 C-N-CA 132.258 4.223 . . . . 0.0 110.558 169.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.4 mmm180 -130.12 138.03 50.47 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 123.71 1.719 . . . . 0.0 115.389 -165.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . 0.444 0.5 OUTLIER -111.3 119.83 40.2 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 118.577 -2.577 . . . . 0.0 114.12 168.439 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -137.75 162.36 32.08 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 C-N-CA 128.527 2.731 . . . . 0.0 105.418 -178.212 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -86.35 147.13 26.18 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 128.579 3.674 . . . . 0.0 112.906 -172.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -60.41 -13.81 15.49 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 128.102 2.561 . . . . 0.0 113.987 -169.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.88 -35.83 3.01 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 119.75 -1.844 . . . . 0.0 111.336 160.223 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 4.4 m0 -90.26 -3.72 57.62 Favored 'General case' 0 CA--C 1.552 1.04 0 CA-C-O 124.864 2.269 . . . . 0.0 108.883 -166.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 mttt -79.49 124.47 28.51 Favored 'General case' 0 C--N 1.358 0.948 0 O-C-N 117.765 -3.084 . . . . 0.0 109.509 165.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.5 p 37.88 65.62 0.55 Allowed 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.942 2.097 . . . . 0.0 116.234 -163.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 19.5 p30 -99.2 -4.21 32.59 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 160.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 75.84 12.71 83.71 Favored Glycine 0 CA--C 1.538 1.531 0 CA-C-O 116.55 -2.25 . . . . 0.0 115.089 -162.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -105.76 122.79 46.81 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 121.769 2.785 . . . . 0.0 112.908 177.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -24.59 -50.02 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 127.52 2.328 . . . . 0.0 113.633 162.46 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 30.75 -49.55 0.0 OUTLIER 'General case' 0 C--N 1.352 0.682 1 C-N-CA 139.109 6.964 . . . . 0.0 114.621 -179.56 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 35.0 t -66.21 -23.19 66.39 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 129.42 3.088 . . . . 0.0 115.384 167.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 69.46 -29.55 0.18 Allowed 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 126.638 1.975 . . . . 0.0 113.563 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.74 -19.4 61.39 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 126.177 1.791 . . . . 0.0 110.494 164.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.7 t30 45.61 87.55 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.808 1.643 . . . . 0.0 110.812 -155.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 37.6 m -86.26 -73.86 0.44 Allowed 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 114.44 -2.695 . . . . 0.0 104.157 163.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.449 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -59.83 -44.51 94.01 Favored 'General case' 0 CA--C 1.534 0.331 0 O-C-N 128.029 3.33 . . . . 0.0 111.137 -154.559 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 34.1 mm-40 -74.94 6.15 4.39 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 119.27 -2.143 . . . . 0.0 111.907 -173.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -104.12 135.62 19.31 Favored Pre-proline 0 CA--C 1.542 0.639 0 CA-C-O 116.656 -1.64 . . . . 0.0 108.044 161.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -68.79 20.28 0.15 Allowed 'Trans proline' 0 C--N 1.356 0.957 1 C-N-CA 126.459 4.772 . . . . 0.0 114.303 -171.932 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.86 -23.16 65.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.298 0.639 . . . . 0.0 110.308 152.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.449 ' HB3' ' HA ' ' A' ' 36' ' ' ASP . 8.5 tt -125.89 -79.98 0.61 Allowed 'General case' 0 C--N 1.342 0.249 0 C-N-CA 125.99 1.716 . . . . 0.0 108.936 177.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 21.3 t -157.26 118.3 3.62 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 178.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -128.64 108.03 10.17 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 120.539 -1.351 . . . . 0.0 109.039 172.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -142.28 114.55 8.31 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.679 0.792 . . . . 0.0 110.218 -174.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 23.9 m80 . . . . . 0 CA--C 1.534 0.346 0 C-N-CA 124.956 1.303 . . . . 0.0 111.519 175.922 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.171 0 N-CA-C 112.368 -0.293 . . . . 0.0 112.368 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.1 t 75.11 126.25 0.03 OUTLIER Pre-proline 0 N--CA 1.473 0.718 0 C-N-CA 127.781 2.433 . . . . 0.0 111.609 -170.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -68.49 111.74 2.63 Favored 'Trans proline' 0 CA--C 1.546 1.1 0 C-N-CA 122.151 1.901 . . . . 0.0 108.45 173.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -79.77 -63.34 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.676 0 C-N-CA 122.594 2.196 . . . . 0.0 114.437 -155.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 67.8 mm-40 57.62 -52.67 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.119 2.568 . . . . 0.0 115.623 -171.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -77.26 -64.64 1.09 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.345 1.458 . . . . 0.0 109.973 178.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.1 mt-30 -149.76 158.74 37.09 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 126.931 2.092 . . . . 0.0 108.0 -177.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -64.14 92.8 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.773 0 C-N-CA 123.443 2.762 . . . . 0.0 112.225 -179.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 141.61 -17.97 2.62 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 126.033 1.778 . . . . 0.0 114.482 -179.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -78.68 -167.94 1.25 Allowed 'General case' 0 C--O 1.239 0.525 0 C-N-CA 125.435 1.494 . . . . 0.0 111.753 -171.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 6.6 t80 -113.43 120.94 42.78 Favored 'General case' 0 CA--C 1.561 1.368 1 CA-C-O 129.143 4.306 . . . . 0.0 116.323 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.93 109.18 20.62 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 117.955 -2.965 . . . . 0.0 112.642 167.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 39.3 t -82.48 124.01 29.69 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 125.898 1.679 . . . . 0.0 110.888 174.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.49 -12.05 3.55 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.695 1.739 . . . . 0.0 115.695 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -65.29 -31.56 72.76 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 120.739 1.609 . . . . 0.0 111.845 164.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.5 m 128.55 52.9 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.323 1 C-N-CA 132.131 4.172 . . . . 0.0 110.61 170.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 2.0 mmm180 -129.19 134.8 48.17 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-O 124.079 1.895 . . . . 0.0 115.311 -168.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -97.37 119.8 36.57 Favored 'General case' 0 N--CA 1.465 0.282 0 O-C-N 119.044 -2.285 . . . . 0.0 110.731 161.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.71 160.82 39.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 115.019 -2.42 . . . . 0.0 105.979 170.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -83.1 150.47 26.27 Favored 'General case' 0 N--CA 1.448 -0.532 1 O-C-N 129.379 4.174 . . . . 0.0 112.515 -173.605 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.404 ' HG3' ' HE2' ' A' ' 24' ' ' LYS . 6.8 tt0 -49.73 -24.56 2.38 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 127.42 2.95 . . . . 0.0 115.119 -171.438 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.78 -38.55 7.23 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 121.441 1.928 . . . . 0.0 110.183 169.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 6.0 m0 -83.6 -7.99 59.4 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-O 124.781 2.229 . . . . 0.0 108.089 -163.306 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.404 ' HE2' ' HG3' ' A' ' 21' ' ' GLU . 43.0 mtmt -77.02 131.44 38.43 Favored 'General case' 0 C--N 1.357 0.901 0 O-C-N 118.006 -2.934 . . . . 0.0 110.381 166.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 m 63.4 17.59 10.41 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 127.031 2.132 . . . . 0.0 114.457 -179.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.43 -11.19 59.92 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 128.193 2.597 . . . . 0.0 113.382 -165.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 84.37 6.59 85.88 Favored Glycine 0 CA--C 1.532 1.094 0 CA-C-O 116.45 -2.306 . . . . 0.0 114.908 -173.261 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -137.88 146.6 43.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 128.438 3.97 . . . . 0.0 117.061 175.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.506 ' ND2' ' H ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -64.65 48.42 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 128.43 2.692 . . . . 0.0 111.363 165.262 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -45.31 -34.71 3.08 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 127.958 2.503 . . . . 0.0 110.247 164.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 29.2 t -78.99 -14.89 58.93 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 128.4 2.68 . . . . 0.0 115.097 179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 62.19 -30.16 0.08 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 127.386 2.275 . . . . 0.0 114.945 -172.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -79.53 -20.87 46.1 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 127.542 2.337 . . . . 0.0 110.601 171.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 30.5 t-20 52.83 82.31 0.07 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.123 1.769 . . . . 0.0 109.909 -163.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.7 m -88.56 -72.49 0.54 Allowed 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 113.814 -2.994 . . . . 0.0 103.885 168.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.493 ' HA ' ' HB3' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -59.57 -45.04 93.01 Favored 'General case' 0 C--O 1.241 0.618 0 O-C-N 127.921 3.263 . . . . 0.0 111.654 -156.927 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -70.97 5.41 2.03 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 112.998 -1.91 . . . . 0.0 113.29 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -113.78 140.72 25.05 Favored Pre-proline 0 CA--C 1.544 0.722 0 CA-C-O 117.016 -1.469 . . . . 0.0 108.941 165.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -71.13 21.45 0.22 Allowed 'Trans proline' 0 CA--C 1.541 0.859 1 C-N-CA 126.034 4.489 . . . . 0.0 114.162 -170.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.51 -22.25 65.45 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.956 -0.465 . . . . 0.0 110.231 151.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.518 HD23 ' HB2' ' A' ' 42' ' ' CYS . 8.9 tt -129.15 -76.19 0.55 Allowed 'General case' 0 C--N 1.343 0.301 0 C-N-CA 125.983 1.713 . . . . 0.0 109.201 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.518 ' HB2' HD23 ' A' ' 41' ' ' LEU . 7.3 t -134.57 -65.76 0.63 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 116.056 1.872 . . . . 0.0 116.056 -179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.568 ' CG ' ' H ' ' A' ' 44' ' ' GLN . 12.8 t-80 56.78 -170.07 0.09 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.606 1.162 . . . . 0.0 113.121 -160.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.568 ' H ' ' CG ' ' A' ' 43' ' ' HIS . 3.9 mm-40 22.87 87.49 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 130.877 3.671 . . . . 0.0 116.634 175.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . . . . . . . . . 6.7 m170 . . . . . 0 CA--C 1.535 0.374 0 C-N-CA 126.067 1.747 . . . . 0.0 111.939 172.572 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_