data_6r0j_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6r0j _Structure_validation_residue.Date_analyzed 2020-01-03 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 ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 121.312 0.577 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.68 -34.63 78.3 Favored 'General case' 0 C--O 1.215 -0.763 0 O-C-N 122.017 -0.427 . . . . 0.0 110.976 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -61.62 -32.95 73.12 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.602 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -63.15 -52.44 62.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.2 m -59.38 -40.82 87.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.371 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -55.26 -48.35 74.12 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.425 0.69 . . . . 0.0 110.983 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -70.49 -34.08 71.96 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.718 -0.614 . . . . 0.0 111.749 178.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -67.97 -34.88 77.4 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.095 -0.378 . . . . 0.0 111.397 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.512 ' HA ' ' HD1' ' A' ' 14' ' ' HIS . 24.2 mm -71.85 -41.1 69.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 177.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.86 78.04 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.51 -49.8 73.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.519 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.512 ' HD1' ' HA ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -64.99 -37.92 89.26 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.28 -176.503 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.47 -48.79 63.56 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.2 p -65.22 -30.61 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.202 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -78.17 -8.56 58.45 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.971 -0.455 . . . . 0.0 111.312 178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 55.4 m -101.25 9.94 41.27 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.95 0.83 61.76 Favored Glycine 0 N--CA 1.452 -0.282 0 N-CA-C 116.836 1.494 . . . . 0.0 116.836 176.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.42 132.08 46.41 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.13 131.29 10.28 Favored Glycine 0 C--O 1.22 -0.753 0 N-CA-C 110.271 -1.132 . . . . 0.0 110.271 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.44 106.23 7.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 118.332 1.066 . . . . 0.0 109.329 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 74.3 mt -72.78 -42.46 61.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -148.7 116.34 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.5 0 O-C-N 123.189 0.306 . . . . 0.0 111.035 179.022 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 . . . . . 0 C--O 1.222 -0.352 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -131.6 131.68 43.45 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.8 mt -136.6 132.79 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 175.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -108.17 129.2 55.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.88 126.26 48.28 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 123.434 0.694 . . . . 0.0 109.565 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -76.32 132.26 39.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.29 116.62 50.93 Favored Pre-proline 0 CA--C 1.546 0.809 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.28 -23.58 20.7 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 117.592 -1.139 . . . . 0.0 113.812 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.9 -27.49 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.654 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.7 mttt 54.83 39.54 31.5 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.952 1.834 . . . . 0.0 108.353 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 t -73.95 -176.26 2.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 110.816 -2.902 . . . . 0.0 107.927 176.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.2 m -47.22 -30.62 3.1 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -90.03 129.9 36.28 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 172.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -89.15 -37.36 15.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.956 0.408 . . . . 0.0 111.891 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.49 166.42 30.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.257 0.551 . . . . 0.0 111.534 -175.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 49.1 t -127.16 136.39 60.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -114.98 126.35 54.66 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mp -95.87 129.46 43.11 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 102.98 -2.97 . . . . 0.0 102.98 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -136.45 113.43 10.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.644 0.735 . . . . 0.0 112.478 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -87.67 96.88 10.59 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.82 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -151.62 139.19 19.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -93.68 137.82 32.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -121.81 120.1 33.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.353 0.121 . . . . 0.0 111.115 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -80.09 -48.63 12.94 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.559 0.695 . . . . 0.0 111.297 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -120.2 156.33 31.36 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.256 0.551 . . . . 0.0 112.4 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HE ' ' CB ' ' A' ' 95' ' ' ASP . 8.4 ptt85 -64.33 -15.52 60.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.249 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -65.11 -45.66 84.2 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -72.52 -36.29 68.29 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -178.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 20.5 ttt -57.46 -48.08 80.12 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -72.29 -31.81 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.744 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.48 -36.43 84.16 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -60.81 -41.23 95.28 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -66.34 -30.93 51.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 O-C-N 122.12 -0.363 . . . . 0.0 111.527 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -61.04 -39.44 89.81 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -76.55 -41.83 45.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.019 0.437 . . . . 0.0 110.168 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -55.99 -43.23 77.45 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.79 88.68 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -71.78 -34.18 69.2 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 121.72 -0.613 . . . . 0.0 109.989 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -63.28 -42.16 99.07 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.5 t -67.17 -32.24 56.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.782 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.9 -33.56 68.87 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.239 -0.913 . . . . 0.0 110.447 177.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.87 -40.45 79.26 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.99 0.424 . . . . 0.0 109.97 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.73 -36.75 75.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.082 0.468 . . . . 0.0 109.746 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -55.79 -39.44 71.28 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.113 -0.367 . . . . 0.0 110.668 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -59.28 -50.86 72.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.048 -178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -73.37 -22.45 60.27 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -82.59 -18.06 42.61 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 122.015 -0.428 . . . . 0.0 112.032 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.09 2.06 12.05 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -75.58 152.71 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 118.108 0.954 . . . . 0.0 112.976 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.5 ttt85 -69.11 -22.84 63.95 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.903 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 -147.35 151.85 37.23 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 104.16 -2.533 . . . . 0.0 104.16 177.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -119.99 135.79 54.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.882 -1.895 . . . . 0.0 105.882 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -126.13 126.13 43.65 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 53.8 tp -114.13 134.47 54.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.817 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.6 tp -95.08 120.43 35.28 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 169.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -114.24 114.79 26.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.312 0.505 . . . . 0.0 110.362 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.5 t -109.08 111.01 34.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.004 0.431 . . . . 0.0 112.048 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -77.21 141.69 39.94 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -116.11 103.68 10.8 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.7 m -128.36 150.62 50.02 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.546 0.529 . . . . 0.0 111.141 -174.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.3 t -70.61 -29.0 65.27 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.511 -0.743 . . . . 0.0 110.458 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -148.54 164.06 35.35 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.64 157.51 49.37 Favored Pre-proline 0 C--N 1.319 -0.718 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.87 147.33 62.8 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.44 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 19.8 m -65.84 -14.16 16.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -152.0 146.64 25.73 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -177.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.48 ' CB ' ' HE ' ' A' ' 54' ' ' ARG . 60.1 m-20 47.22 6.28 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 120.243 3.423 . . . . 0.0 120.243 176.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -58.95 -25.89 63.93 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.86 -1.15 . . . . 0.0 112.61 -175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.67 -32.24 73.27 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.996 -0.44 . . . . 0.0 112.18 -177.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.07 -33.49 75.54 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.853 0.835 . . . . 0.0 109.187 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.3 mm -69.21 -41.14 81.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.483 -173.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.87 -12.55 61.02 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.082 0.468 . . . . 0.0 111.469 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -98.56 0.24 44.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.416 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -121.88 135.75 54.9 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.479 0.656 . . . . 0.0 112.346 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.8 m -82.59 126.95 32.88 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -85.42 119.0 25.29 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 176.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -123.45 131.79 53.75 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -139.31 103.6 4.78 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.738 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.96 -112.7 4.35 Favored Glycine 0 C--O 1.224 -0.497 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.0 p -108.59 8.31 27.06 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.171 0.51 . . . . 0.0 110.578 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 86.1 t -95.38 141.49 15.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.6 t -127.35 135.67 50.84 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 175.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.4 t -134.25 134.94 54.88 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.603 0 CA-C-O 122.107 0.956 . . . . 0.0 109.284 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -103.18 101.88 24.94 Favored Pre-proline 0 N--CA 1.427 -1.582 0 CA-C-N 113.26 -1.791 . . . . 0.0 108.207 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.31 145.43 24.02 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 116.941 -1.573 . . . . 0.0 112.451 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.36 154.57 40.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 tt -147.33 128.78 6.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.36 121.53 60.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.45 140.03 42.34 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -175.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.56 -32.54 53.42 Favored Glycine 0 C--O 1.229 -0.176 0 CA-C-N 115.568 -0.742 . . . . 0.0 114.188 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 32.9 p -53.35 -30.19 38.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 115.718 1.747 . . . . 0.0 115.718 -178.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.5 ptm -140.94 26.92 2.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.86 0.838 . . . . 0.0 109.44 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.7 tp -47.86 -40.88 22.69 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 118.263 2.69 . . . . 0.0 118.263 -168.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -41.75 94.93 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.675 1.125 . . . . 0.0 112.028 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.55 -40.25 35.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.981 0.896 . . . . 0.0 110.878 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -61.69 -41.86 98.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.589 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.96 -42.48 89.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.44 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -76.64 -15.09 59.91 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.626 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.35 -34.63 63.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.4 t -90.18 -43.17 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 109.903 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -120.49 78.89 28.78 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.773 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -69.68 -9.12 25.36 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 117.669 -1.087 . . . . 0.0 112.515 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 p -74.28 -14.92 60.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.396 176.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -96.72 134.17 40.34 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 . . . . . 0 C--N 1.323 -0.573 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -177.866 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 . . . . . 0 C--O 1.214 -0.797 0 CA-C-O 120.554 0.216 . . . . 0.0 111.506 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -31.72 55.91 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.112 -0.368 . . . . 0.0 111.662 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -64.58 -48.31 75.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.0 mmt -66.4 -35.64 80.83 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.913 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.55 -38.33 77.57 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.33 -0.231 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -65.34 -45.9 82.41 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.29 -43.43 98.88 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.148 0.499 . . . . 0.0 111.029 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.9 mmt-85 -63.17 -44.01 96.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.14 -41.56 88.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 177.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 80.2 mt -65.48 -35.8 81.96 Favored 'General case' 0 C--N 1.321 -0.657 0 O-C-N 121.646 -0.658 . . . . 0.0 111.2 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 87.6 p -75.81 -27.81 58.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.487 -0.758 . . . . 0.0 110.53 175.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.69 -43.68 65.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.474 -177.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.3 -33.07 57.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--N 1.327 -0.387 0 O-C-N 121.719 -0.613 . . . . 0.0 109.584 176.124 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 23.8 tp -63.08 -42.19 99.59 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.448 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -64.63 -41.05 96.43 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -58.59 -48.14 81.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.9 m -66.12 -43.46 87.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.352 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -55.09 -51.63 65.78 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.622 0.369 . . . . 0.0 110.984 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -72.3 -29.95 64.34 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.728 -0.607 . . . . 0.0 112.143 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -71.1 -35.54 71.84 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.557 -0.715 . . . . 0.0 111.166 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.1 mm -71.29 -37.83 67.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.14 -45.15 87.87 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 176.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.66 -40.8 96.07 Favored 'General case' 0 C--O 1.208 -1.123 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -58.94 -49.81 76.44 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.2 mp -68.35 -45.42 72.9 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.089 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.76 -42.77 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.937 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -61.97 -26.53 68.26 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 121.915 -0.491 . . . . 0.0 111.72 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -82.53 5.24 21.44 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 122.575 0.35 . . . . 0.0 111.763 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.12 -1.51 44.06 Favored Glycine 0 CA--C 1.517 0.164 0 N-CA-C 115.483 0.953 . . . . 0.0 115.483 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.01 123.05 19.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.817 0.808 . . . . 0.0 109.393 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.01 129.39 9.66 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.31 133.99 29.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.07 -41.94 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -149.2 142.24 24.87 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 104.804 -2.295 . . . . 0.0 104.804 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.432 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -179.403 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 . . . . . 0 N--CA 1.466 0.332 0 CA-C-O 121.183 0.516 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -133.18 152.28 51.95 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 93.2 mt -135.21 133.48 52.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -114.44 136.11 53.37 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.14 0.576 . . . . 0.0 109.654 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mp -132.91 137.97 46.8 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.349 0.66 . . . . 0.0 109.923 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -93.86 135.82 34.78 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.77 111.93 15.38 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -73.59 -24.96 15.48 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.523 -1.184 . . . . 0.0 114.173 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.19 -8.3 55.72 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt 58.15 43.95 19.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -68.19 -177.66 0.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 113.273 -1.785 . . . . 0.0 110.915 -177.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 p -56.27 -27.64 55.97 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.484 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -105.76 133.4 50.55 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -80.11 -39.81 28.77 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 120.96 0.409 . . . . 0.0 109.933 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.4 mt -137.38 160.35 39.32 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.716 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 58.5 t -131.51 137.43 55.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -123.35 132.27 53.93 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.2 124.08 47.92 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 174.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -136.54 150.0 48.4 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -125.81 119.91 29.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 118.181 0.446 . . . . 0.0 112.019 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.71 140.43 20.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -92.61 111.98 23.76 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.7 mt -104.09 125.19 50.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -87.22 -34.7 18.89 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.18 0.514 . . . . 0.0 110.708 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -130.29 148.01 52.07 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -177.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -67.38 -21.05 65.63 Favored 'General case' 0 CA--C 1.505 -0.768 0 O-C-N 121.088 -1.008 . . . . 0.0 111.803 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -62.11 -28.52 69.69 Favored 'General case' 0 C--O 1.213 -0.865 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.69 -45.07 25.95 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 175.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.4 ttm -54.56 -49.97 69.07 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.484 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.17 -31.87 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.25 -34.57 76.45 Favored 'General case' 0 CA--C 1.506 -0.745 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.238 -176.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -42.24 89.71 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -74.18 -34.43 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 122.019 -0.426 . . . . 0.0 111.355 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -41.54 92.05 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -76.3 -33.73 59.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.948 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -58.2 -46.62 85.51 Favored 'General case' 0 C--O 1.219 -0.52 0 O-C-N 121.966 -0.459 . . . . 0.0 109.798 176.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.05 -32.68 74.11 Favored 'General case' 0 N--CA 1.444 -0.755 0 O-C-N 122.403 -0.185 . . . . 0.0 110.623 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -46.54 85.35 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -61.67 -41.31 97.38 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.7 t -61.31 -35.34 65.56 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.74 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.986 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -55.48 -38.99 69.85 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.493 1.042 . . . . 0.0 110.597 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -73.93 -45.79 48.3 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.705 0.288 . . . . 0.0 111.118 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.06 -44.33 95.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.652 0.263 . . . . 0.0 111.698 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -30.1 70.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.151 -0.968 . . . . 0.0 110.167 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -68.89 -43.15 75.86 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.12 -30.99 70.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.879 0.371 . . . . 0.0 111.246 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -83.33 -14.0 53.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.489 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.98 -3.09 30.63 Favored Glycine 0 CA--C 1.522 0.469 0 N-CA-C 114.191 0.437 . . . . 0.0 114.191 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -71.0 136.02 48.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -64.24 -45.79 86.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 122.124 -0.36 . . . . 0.0 111.785 -176.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -119.98 162.26 19.52 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 178.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.4 ttp -145.31 138.84 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.363 174.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -113.63 143.46 44.53 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 123.647 0.592 . . . . 0.0 109.863 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.1 tt -139.47 136.85 35.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.0 tp -99.22 106.35 18.49 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -97.31 108.52 21.26 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.41 116.31 46.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -175.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -85.98 151.37 23.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -126.3 129.43 48.85 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 172.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.5 p -147.62 163.02 37.94 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.017 0.198 . . . . 0.0 110.784 -174.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.0 m -67.09 -48.96 66.59 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 173.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -151.41 165.99 32.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 105.188 -2.153 . . . . 0.0 105.188 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.16 158.14 36.5 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.14 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -54.48 146.01 54.7 Favored 'Trans proline' 0 C--N 1.349 0.571 0 N-CA-C 116.902 1.847 . . . . 0.0 116.902 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.6 m -77.18 -19.51 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.01 177.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -87.71 87.22 7.31 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.755 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 19.84 51.25 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 119.054 2.983 . . . . 0.0 119.054 176.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -63.05 -20.59 65.48 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.519 -0.738 . . . . 0.0 112.875 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.35 -31.29 69.06 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 122.246 -0.284 . . . . 0.0 111.451 -177.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.73 -30.35 71.46 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.685 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.4 mm -73.46 -38.51 53.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.86 0.362 . . . . 0.0 110.3 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.07 -25.3 67.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.101 0.953 . . . . 0.0 110.441 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -97.69 21.71 10.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.215 -177.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.3 ttmm -139.36 98.02 3.41 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 65.1 m -68.24 127.07 31.58 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -86.39 112.12 21.16 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -108.4 131.98 54.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.809 0.814 . . . . 0.0 110.103 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -128.86 84.51 2.24 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.94 -110.44 3.15 Favored Glycine 0 C--O 1.22 -0.78 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 71.7 p -98.09 -1.32 42.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 95.9 t -89.52 138.55 19.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.0 m -133.98 112.72 11.46 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 173.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.9 t -121.53 130.58 74.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -113.58 133.0 22.28 Favored Pre-proline 0 C--O 1.244 0.808 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -81.58 160.88 19.4 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 O-C-N 122.253 0.607 . . . . 0.0 112.446 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.86 152.59 36.72 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 102.444 -3.169 . . . . 0.0 102.444 174.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 tt -147.76 135.46 14.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 51.7 t -108.98 117.32 54.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.41 146.91 42.54 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.295 177.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.49 -41.5 8.35 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 172.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.3 t -65.51 -19.75 66.06 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -177.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 24.4 ptm -136.63 32.0 2.78 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 122.095 0.95 . . . . 0.0 109.355 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -49.19 -43.83 42.58 Favored 'General case' 0 C--O 1.213 -0.821 0 N-CA-C 116.545 2.054 . . . . 0.0 116.545 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.4 ptt-85 -54.69 -51.35 65.82 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.309 0.504 . . . . 0.0 112.052 -177.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -75.05 -39.66 60.81 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.951 -177.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -70.37 -32.12 69.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -175.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.45 -41.22 93.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.721 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.11 -21.23 66.77 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.7 -22.69 60.86 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.648 0.261 . . . . 0.0 110.91 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.0 t -109.06 -42.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.167 0.508 . . . . 0.0 111.554 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -125.54 73.88 68.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.366 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.83 -12.38 32.65 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 117.991 -0.873 . . . . 0.0 113.362 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.0 m -80.39 -5.08 55.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -103.6 132.95 49.41 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 39.5 mtp85 . . . . . 0 C--N 1.325 -0.473 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.74 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 C--O 1.215 -0.732 0 N-CA-C 110.688 -0.115 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -39.85 72.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.731 0.3 . . . . 0.0 111.524 177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -68.67 -41.94 78.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.531 0.681 . . . . 0.0 109.266 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 46.3 mtt -64.41 -37.0 86.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.84 -37.55 87.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.447 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -64.61 -52.6 56.64 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -63.85 -36.02 82.55 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.373 0.606 . . . . 0.0 111.148 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -63.86 -39.67 94.75 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -66.95 -42.14 85.74 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.129 0.171 . . . . 0.0 111.289 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.37 -34.84 75.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.177 0.513 . . . . 0.0 109.822 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 24.0 m -75.97 -35.69 59.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.392 0.615 . . . . 0.0 111.477 176.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 5.7 tt -65.56 -43.16 90.74 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.5 p -57.72 -40.76 77.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.739 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.6 tm? . . . . . 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.539 . . . . 0.0 110.265 179.525 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 C--O 1.214 -0.766 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -60.99 -32.41 71.98 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.649 0.737 . . . . 0.0 112.052 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -56.98 -27.15 61.13 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -61.29 -52.3 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 178.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 m -69.45 -40.22 77.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.141 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -52.82 -58.03 8.24 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -68.01 -28.07 67.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.476 -0.765 . . . . 0.0 111.905 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -73.18 -29.87 63.14 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 122.09 -0.381 . . . . 0.0 111.455 178.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mm -69.87 -41.88 79.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.56 80.28 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.42 98.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.094 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -39.32 86.33 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.644 -0.423 . . . . 0.0 111.27 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.45 -44.23 83.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.84 -42.58 89.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.027 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -77.96 -2.41 36.79 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.358 -0.839 . . . . 0.0 112.692 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -98.37 7.96 45.5 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 173.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.54 -1.32 57.02 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 116.694 1.437 . . . . 0.0 116.694 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.409 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 12.8 m-85 -69.69 125.32 26.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 118.336 1.068 . . . . 0.0 110.442 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.46 133.67 13.1 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.6 t -78.25 117.09 22.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 75.3 mt -87.24 -44.74 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -149.56 123.26 9.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.827 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.628 0 N-CA-C 104.115 -2.55 . . . . 0.0 104.115 172.389 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.462 0.162 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -135.53 141.02 45.17 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 42.3 mt -136.1 131.69 49.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -106.83 128.74 54.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.09 133.45 53.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.564 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -87.52 137.03 32.69 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.03 107.25 11.03 Favored Pre-proline 0 CA--C 1.549 0.921 0 O-C-N 123.034 0.209 . . . . 0.0 111.554 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 90.2 Cg_endo -73.49 -20.23 20.92 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 118.009 -0.861 . . . . 0.0 112.418 -178.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.88 -25.45 66.4 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.708 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mttt 59.59 40.75 19.86 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 -173.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.0 p -75.79 -177.52 3.82 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 112.498 -2.137 . . . . 0.0 108.728 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.2 -1.56 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -136.08 133.57 37.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -76.91 -35.75 57.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.449 0.643 . . . . 0.0 109.898 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 54.8 mt -136.24 162.62 32.47 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.0 t -126.4 133.7 68.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -118.47 115.67 25.1 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 tp -90.24 123.31 33.93 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -136.35 141.9 43.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 117.902 0.319 . . . . 0.0 111.548 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -111.39 119.73 39.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 t-160 -151.71 123.62 8.06 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.21 121.0 26.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.42 108.3 18.28 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -176.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -70.29 -46.84 63.49 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 122.458 1.123 . . . . 0.0 109.856 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -119.78 155.46 32.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.051 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -62.56 -22.29 66.23 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -65.58 -32.26 73.75 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -69.96 -49.12 54.94 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.534 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -66.48 -32.07 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -71.24 -27.65 63.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.303 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -68.5 -37.52 80.14 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.84 -30.64 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.334 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.88 -42.13 98.69 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -70.05 -41.8 73.71 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.029 0.919 . . . . 0.0 109.187 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.59 -37.11 77.67 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.005 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.34 -41.92 96.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.853 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -64.26 -39.95 94.99 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.95 -44.52 97.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.3 t -67.08 -40.86 86.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.666 0 CA-C-O 119.737 -0.173 . . . . 0.0 110.57 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -35.01 72.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.262 0.553 . . . . 0.0 109.932 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -73.6 -45.73 51.29 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.803 -0.561 . . . . 0.0 110.786 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.68 -42.69 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -59.36 -30.23 68.26 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.341 -0.849 . . . . 0.0 110.729 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -66.16 -36.73 83.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -70.27 -39.66 74.82 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 121.315 0.579 . . . . 0.0 109.689 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.6 mt -75.38 -7.79 54.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.264 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.53 10.53 63.64 Favored Glycine 0 CA--C 1.522 0.485 0 CA-C-O 121.316 0.398 . . . . 0.0 113.368 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -76.23 137.67 40.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.366 0.603 . . . . 0.0 110.333 -176.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -72.0 -30.53 65.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.994 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -151.46 149.34 29.14 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 103.791 -2.67 . . . . 0.0 103.791 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.7 ttp -131.42 143.15 50.24 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 118.913 0.779 . . . . 0.0 109.901 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.1 mtpt -107.57 136.94 46.49 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.0 tp -125.75 137.31 53.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.3 tp -94.81 121.27 36.23 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.36 135.53 42.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.0 t -132.79 111.62 17.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -82.75 150.58 26.59 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.584 0.553 . . . . 0.0 110.541 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -128.94 115.87 18.5 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 173.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 96.2 p -137.06 160.8 37.88 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 123.478 0.486 . . . . 0.0 110.6 -177.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.7 t -70.55 -30.89 67.74 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.909 -0.495 . . . . 0.0 110.992 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -152.93 170.82 19.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.85 154.8 61.45 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -58.73 148.41 83.06 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 117.469 -1.221 . . . . 0.0 111.902 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 25.6 m -61.41 -22.22 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -155.49 147.2 23.14 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 48.4 9.24 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 120.027 3.343 . . . . 0.0 120.027 172.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.2 p-90 -63.46 -23.11 67.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 114.252 1.205 . . . . 0.0 114.252 -176.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -60.58 -31.35 70.49 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.927 -0.483 . . . . 0.0 112.006 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -58.47 -32.93 69.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.622 0.725 . . . . 0.0 109.873 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.6 mm -69.85 -39.37 77.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -175.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.91 -8.02 53.7 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -112.0 2.82 17.06 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.439 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -112.73 133.68 54.63 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.405 0.621 . . . . 0.0 111.426 -178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 54.2 m -79.39 125.0 28.96 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -86.34 121.05 28.37 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -128.07 139.89 52.27 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 122.024 0.916 . . . . 0.0 113.448 -177.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -140.34 75.27 1.5 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.056 -1.429 . . . . 0.0 108.831 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.13 -110.8 3.6 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 119.575 -1.298 . . . . 0.0 112.331 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.3 p -73.82 10.53 1.11 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.164 0.985 . . . . 0.0 112.941 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.8 t -130.46 142.94 42.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 121.869 -0.52 . . . . 0.0 111.079 -177.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.0 t -142.22 131.52 23.54 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 173.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.8 t -134.02 138.83 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.111 0 CA-C-O 121.942 0.877 . . . . 0.0 110.27 -177.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -111.89 110.07 54.67 Favored Pre-proline 0 N--CA 1.435 -1.178 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.485 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.19 157.68 20.08 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 115.878 -2.281 . . . . 0.0 113.345 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.1 156.76 37.85 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.2 tt -146.88 132.88 12.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.47 0.653 . . . . 0.0 111.517 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.1 119.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.6 136.36 53.12 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.09 -35.95 42.62 Favored Glycine 0 C--O 1.221 -0.669 0 N-CA-C 117.182 1.633 . . . . 0.0 117.182 -174.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -22.54 57.18 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -147.58 40.66 1.01 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.735 1.255 . . . . 0.0 108.631 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.2 tt -48.48 -54.17 15.24 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.0 ttt180 -57.32 -36.19 70.82 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.785 1.175 . . . . 0.0 113.931 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.06 -41.23 64.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.069 0.462 . . . . 0.0 110.425 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -66.04 -39.09 89.89 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.396 1.093 . . . . 0.0 109.362 178.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.77 -48.66 78.19 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.316 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -72.33 -16.07 61.88 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.432 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.1 -36.2 55.85 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.407 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.05 -44.08 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.435 0.635 . . . . 0.0 110.443 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -128.5 77.16 77.67 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.931 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -66.69 -16.04 49.25 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 118.195 -0.736 . . . . 0.0 112.896 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.5 m -74.8 -10.52 59.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 178.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -71.35 129.31 38.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.892 0.853 . . . . 0.0 110.868 -178.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 . . . . . 0 C--N 1.322 -0.606 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.704 -177.363 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 . . . . . 0 N--CA 1.467 0.393 0 CA-C-O 121.122 0.487 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.36 -30.86 69.82 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -68.28 -39.54 82.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.4 mtt -68.16 -28.92 67.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.71 -35.21 79.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.342 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -65.27 -49.54 69.19 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 178.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -60.38 -42.15 95.24 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.492 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -61.46 -40.72 95.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.66 -43.46 93.55 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 70.4 mt -65.02 -37.94 89.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.164 0.507 . . . . 0.0 110.148 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 35.4 m -69.25 -34.67 75.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.409 0.623 . . . . 0.0 110.382 177.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.28 -45.88 78.93 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.353 -178.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.7 p -63.78 -34.04 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.068 0.849 . . . . 0.0 110.959 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.4 tm? . . . . . 0 C--O 1.218 -0.586 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.591 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.1 tp . . . . . 0 N--CA 1.472 0.634 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.62 -37.96 80.04 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.905 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -62.52 -35.9 80.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.545 -175.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -62.52 -48.28 80.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 21.0 m -69.35 -37.33 77.6 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.412 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -57.17 -51.3 69.86 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.518 0.727 . . . . 0.0 110.296 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -69.29 -29.75 67.69 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.625 -0.672 . . . . 0.0 111.098 178.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -68.48 -36.06 78.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.814 -0.554 . . . . 0.0 111.044 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.9 mm -72.34 -38.88 62.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 176.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.86 84.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.0 95.41 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.612 178.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -60.67 -45.6 93.52 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 122.708 0.403 . . . . 0.0 110.619 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.11 -46.32 78.03 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.711 0.291 . . . . 0.0 110.562 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.57 -37.91 80.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.951 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -63.98 -31.87 73.21 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.997 -0.439 . . . . 0.0 110.479 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.2 t -79.17 9.42 4.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 122.883 0.473 . . . . 0.0 111.52 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 92.17 1.05 70.07 Favored Glycine 0 N--CA 1.453 -0.189 0 N-CA-C 116.295 1.278 . . . . 0.0 116.295 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -64.74 126.08 26.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.278 1.039 . . . . 0.0 109.454 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.93 132.11 11.58 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.8 t -77.34 117.51 22.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 63.4 mt -87.02 -47.01 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -149.78 123.15 9.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.297 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.532 0 N-CA-C 104.137 -2.542 . . . . 0.0 104.137 173.488 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t0 . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -141.92 150.36 41.38 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -178.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.3 mt -138.19 127.65 33.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -103.6 130.0 50.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.51 138.13 54.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 123.626 0.77 . . . . 0.0 110.239 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -92.37 134.72 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 112.12 15.42 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 122.133 0.173 . . . . 0.0 110.74 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.81 -26.98 9.14 Favored 'Trans proline' 0 C--N 1.352 0.759 0 N-CA-C 114.932 1.089 . . . . 0.0 114.932 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -73.77 -5.02 38.22 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 57.62 42.19 24.38 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -176.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 p -70.0 -177.68 1.4 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 113.338 -1.755 . . . . 0.0 112.367 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.1 m -56.18 -30.36 62.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.091 176.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -92.78 134.54 34.95 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -78.53 -45.45 21.88 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.6 mt -141.84 164.74 29.37 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.548 -174.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 85.6 t -133.59 138.88 50.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -121.91 128.15 51.23 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -98.17 131.97 44.09 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -136.19 141.31 44.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 118.134 0.425 . . . . 0.0 110.204 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.8 95.59 4.48 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -176.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -151.67 146.26 25.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 178.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -86.7 151.57 23.29 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.3 mt -138.73 129.12 25.86 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 122.251 0.22 . . . . 0.0 110.645 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -91.51 -37.3 13.22 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.974 0.416 . . . . 0.0 110.302 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -129.56 147.79 51.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.2 ptt-85 -65.38 -22.16 66.76 Favored 'General case' 0 CA--C 1.507 -0.708 0 O-C-N 121.645 -0.659 . . . . 0.0 111.945 -177.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -62.09 -31.04 71.43 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.01 -39.35 63.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.7 ttm -62.51 -50.48 71.24 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.489 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.9 m -60.36 -31.97 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.39 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -69.16 -34.0 74.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.664 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -63.99 -40.7 96.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.403 0.62 . . . . 0.0 109.669 177.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.1 mt -70.88 -33.3 51.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.777 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -62.61 -32.75 73.82 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 176.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -67.91 -49.88 59.35 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.42 -39.25 70.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.231 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.97 -37.28 81.88 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.06 -42.22 80.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.602 0.715 . . . . 0.0 109.186 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -62.43 -42.49 99.49 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.407 0.622 . . . . 0.0 109.738 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.73 -42.96 83.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.953 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -66.99 -33.47 75.64 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.101 -179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -41.78 86.81 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 176.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 95.3 t -73.02 -38.76 56.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.49 -35.33 77.37 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.288 -0.882 . . . . 0.0 111.595 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 -58.33 -39.94 80.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 109.87 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -73.41 -20.67 60.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.0 mp -106.01 -15.73 14.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.09 4.43 42.46 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.778 1.071 . . . . 0.0 115.778 178.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -76.89 135.63 38.83 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.632 -0.922 . . . . 0.0 109.338 -178.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -66.84 -20.66 65.97 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 -175.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.427 HH21 ' CD ' ' A' ' 105' ' ' GLU . 40.6 ttt180 -152.06 154.08 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.6 151.39 50.25 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 177.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -126.11 117.46 23.21 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 170.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -116.81 126.75 53.53 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.69 123.92 34.68 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 176.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -119.26 109.64 16.07 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.83 112.84 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -176.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.16 133.03 35.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 122.87 0.468 . . . . 0.0 110.066 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -108.38 110.12 21.6 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 95.0 p -130.89 152.75 49.88 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 24.1 m -67.22 -46.51 73.6 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.864 0.84 . . . . 0.0 109.226 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -147.24 161.11 41.6 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.96 158.65 34.63 Favored Pre-proline 0 C--N 1.312 -1.058 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.797 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -54.02 150.84 29.54 Favored 'Trans proline' 0 C--N 1.349 0.563 0 N-CA-C 116.254 1.598 . . . . 0.0 116.254 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.5 m -76.5 -11.96 14.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.88 101.66 8.03 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 40.14 27.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 119.442 3.127 . . . . 0.0 119.442 172.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.4 p-90 -59.72 -20.97 59.86 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.47 -0.769 . . . . 0.0 112.88 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -60.08 -31.29 69.88 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -175.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -66.15 -34.63 78.48 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 11.7 mm -65.37 -43.89 94.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.502 -174.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.33 -1.27 20.08 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -111.98 -2.82 14.99 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -103.31 115.23 30.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.91 -175.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.1 m -68.24 126.59 30.03 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 172.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -88.32 128.05 35.49 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.427 ' CD ' HH21 ' A' ' 79' ' ' ARG . 8.0 mt-10 -126.91 140.65 52.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.453 0.644 . . . . 0.0 111.433 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -140.87 75.49 1.51 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.179 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.89 -111.97 4.14 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 119.897 -1.144 . . . . 0.0 111.609 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 41.1 p -80.23 13.21 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.83 137.97 55.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.0 m -133.58 133.6 42.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 84.2 t -123.59 138.58 52.93 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.875 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -102.46 99.64 13.62 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.84 120.01 2.99 Favored 'Trans proline' 0 C--N 1.349 0.597 0 CA-C-O 121.395 0.498 . . . . 0.0 113.035 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -127.22 145.4 50.78 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.5 tt -138.72 139.16 41.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.3 m -116.83 133.71 62.68 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-O 122.109 0.957 . . . . 0.0 108.484 174.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.46 152.64 27.27 Favored 'General case' 0 C--O 1.207 -1.152 0 CA-C-N 114.363 -1.289 . . . . 0.0 108.456 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.4 -41.21 8.55 Favored Glycine 0 C--N 1.317 -0.509 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.8 t -61.74 -26.19 67.91 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 27.0 ptm -131.41 32.87 4.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.201 1.001 . . . . 0.0 110.573 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 28.1 tp -51.3 -41.49 60.53 Favored 'General case' 0 C--O 1.211 -0.959 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -174.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.744 -176.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -78.37 -40.14 37.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.618 0.723 . . . . 0.0 111.936 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.49 -39.06 85.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.5 0.667 . . . . 0.0 112.508 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -63.47 -43.32 97.66 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.061 -0.399 . . . . 0.0 111.268 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -72.58 -14.7 61.68 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.678 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.2 -32.09 62.91 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.3 t -92.08 -43.65 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-O 121.245 0.545 . . . . 0.0 110.264 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -124.66 78.05 63.73 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.187 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.11 -11.17 31.03 Favored 'Trans proline' 0 C--N 1.346 0.446 0 N-CA-C 114.197 0.807 . . . . 0.0 114.197 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 19.3 t -78.0 -14.85 59.37 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.278 0.561 . . . . 0.0 110.426 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -80.88 124.93 29.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.314 0.578 . . . . 0.0 110.254 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 38.3 mtp-105 . . . . . 0 C--O 1.218 -0.599 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.197 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 52.7 m-20 . . . . . 0 N--CA 1.467 0.413 0 CA-C-O 120.791 0.329 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.19 90.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.81 0.338 . . . . 0.0 110.608 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.37 -43.46 70.08 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 74.4 mtp -61.35 -27.61 68.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.265 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.859 -0.526 . . . . 0.0 110.683 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -64.41 -45.95 85.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.08 -42.54 94.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.42 0.628 . . . . 0.0 110.184 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 70.5 mmt-85 -66.5 -40.16 89.1 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.814 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -62.68 -42.52 99.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.229 0.468 . . . . 0.0 111.262 176.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.34 -39.42 94.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 84.8 p -71.58 -27.84 63.42 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.744 -0.598 . . . . 0.0 110.804 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.1 tt -72.33 -43.29 64.33 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.838 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 8.8 p -63.62 -36.19 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 118.935 0.789 . . . . 0.0 108.883 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.222 -0.356 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.657 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 121.129 0.49 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.62 -46.94 80.47 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.55 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 8.2 pt-20 -73.81 -29.14 61.99 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.698 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -56.93 -45.46 82.72 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.211 -1.404 . . . . 0.0 107.211 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.9 m -71.66 -44.52 64.15 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.292 0.568 . . . . 0.0 111.519 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.431 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 73.0 t80 -55.51 -51.25 67.65 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 123.873 0.869 . . . . 0.0 113.15 -178.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -68.64 -31.28 70.31 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.98 -0.45 . . . . 0.0 110.341 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -70.84 -35.14 72.32 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.902 -0.499 . . . . 0.0 111.259 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 mm -69.06 -40.75 81.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 176.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.7 90.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.17 84.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.002 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -57.06 -47.28 81.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -68.69 -46.18 69.72 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.544 0.202 . . . . 0.0 111.544 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.11 -44.49 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-O 121.319 0.58 . . . . 0.0 110.153 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -72.44 -7.62 50.78 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -97.97 9.05 43.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.49 -6.17 45.16 Favored Glycine 0 CA--C 1.517 0.202 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 175.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -66.6 133.74 50.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 118.091 0.945 . . . . 0.0 109.598 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.5 115.65 4.36 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 107.47 -2.252 . . . . 0.0 107.47 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.5 p -71.08 130.13 34.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.9 mt -94.34 -42.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 -178.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -147.57 138.48 23.47 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.441 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.597 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 N--CA 1.461 0.122 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -125.64 139.31 53.67 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.857 -1.065 . . . . 0.0 112.919 -172.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 80.8 mt -135.03 133.81 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -112.14 135.61 52.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -131.14 129.95 42.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -83.92 132.73 34.75 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.26 118.85 71.02 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -76.81 -23.99 10.44 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 117.408 -1.261 . . . . 0.0 115.089 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -75.49 -17.95 59.97 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -177.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt 61.03 37.77 17.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.484 1.135 . . . . 0.0 110.266 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -173.34 0.07 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 112.754 -2.021 . . . . 0.0 110.653 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.8 p -49.88 -42.61 48.21 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -78.8 138.25 38.11 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.068 0.461 . . . . 0.0 111.168 174.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -101.71 -37.2 8.43 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.058 176.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.4 mt -139.78 163.79 31.67 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -172.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -131.52 134.95 60.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 174.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -119.57 113.72 21.15 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 84.9 mt -95.61 125.0 39.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -136.35 130.47 32.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.624 0.193 . . . . 0.0 110.598 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -107.95 114.18 27.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.072 0.463 . . . . 0.0 109.959 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -151.64 142.71 23.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.105 -176.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -93.05 98.72 11.51 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -87.06 103.31 15.25 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.946 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -68.49 -42.6 78.42 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.784 0.802 . . . . 0.0 111.958 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -121.71 156.4 33.17 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.859 -0.525 . . . . 0.0 111.478 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -66.73 -16.06 63.98 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.147 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -63.74 -40.16 96.06 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -69.96 -36.73 75.48 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 55.7 ttm -61.33 -50.24 73.74 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.86 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.7 m -70.09 -31.95 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.243 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 -66.9 -34.65 78.25 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.206 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -64.56 -33.97 77.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mm -71.84 -30.89 39.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 O-C-N 121.634 -0.666 . . . . 0.0 110.956 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -64.23 -40.34 95.85 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.38 -44.25 91.95 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 121.935 0.874 . . . . 0.0 109.21 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -62.68 -39.67 94.69 Favored 'General case' 0 C--O 1.206 -1.222 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.233 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.49 -40.44 82.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 118.998 0.817 . . . . 0.0 111.518 -177.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -66.8 -41.47 87.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.565 0.697 . . . . 0.0 109.832 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.78 -47.29 84.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.522 0.677 . . . . 0.0 110.141 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.86 -42.64 97.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.258 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.42 -31.7 72.07 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 119.97 1.259 . . . . 0.0 111.401 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -64.72 -44.1 91.31 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.2 t -68.99 -36.03 71.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.185 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ttp-105 -59.24 -35.2 73.24 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.801 -0.562 . . . . 0.0 110.687 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -62.11 -39.04 91.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -73.4 -39.86 64.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.378 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.28 -17.96 61.26 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.17 -2.98 32.82 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 116.163 1.225 . . . . 0.0 116.163 177.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -71.39 152.6 43.0 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.384 1.092 . . . . 0.0 108.681 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.62 -27.19 61.99 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.795 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -142.03 159.43 42.24 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -122.19 141.78 51.11 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -123.35 127.95 49.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.4 tp -129.3 123.71 32.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -86.46 109.43 19.06 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -98.84 127.54 44.79 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 22.7 t -124.21 113.5 36.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-O 121.169 0.509 . . . . 0.0 111.469 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -84.18 142.81 30.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.78 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.55 109.82 16.16 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 173.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.0 p -125.59 161.09 27.99 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -173.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.3 m -67.17 -49.28 65.29 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -148.72 156.88 42.97 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 101.798 -3.408 . . . . 0.0 101.798 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.29 159.19 86.05 Favored Pre-proline 0 C--N 1.313 -0.989 0 O-C-N 124.268 0.98 . . . . 0.0 109.294 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.16 154.12 29.82 Favored 'Trans proline' 0 C--N 1.353 0.765 0 N-CA-C 115.081 1.147 . . . . 0.0 115.081 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.1 m -63.26 -24.48 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 118.089 2.626 . . . . 0.0 118.089 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -155.44 145.03 21.2 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 t0 45.88 19.48 0.06 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 117.896 2.554 . . . . 0.0 117.896 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 29.9 p-90 -76.08 -23.54 55.01 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 120.864 -1.147 . . . . 0.0 111.967 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.65 -37.7 76.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -18.4 64.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 111.832 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.7 mm -72.93 -40.17 59.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.88 0.61 17.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.153 0.501 . . . . 0.0 111.566 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -111.85 3.13 17.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.426 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -122.17 155.87 34.89 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.293 0.568 . . . . 0.0 111.396 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -102.0 126.04 48.82 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -83.46 112.56 20.07 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -118.29 123.14 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.518 0.675 . . . . 0.0 112.337 -176.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -124.24 75.49 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.57 -112.32 4.89 Favored Glycine 0 C--O 1.226 -0.401 0 C-N-CA 119.912 -1.137 . . . . 0.0 111.504 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 50.9 p -72.85 11.92 0.6 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 87.5 t -127.83 140.51 48.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 -178.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.2 p -138.05 125.39 21.8 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 105.77 -1.937 . . . . 0.0 105.77 169.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -128.85 133.4 66.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -113.45 116.74 45.94 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.74 156.13 27.47 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 118.109 -0.794 . . . . 0.0 112.892 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -147.54 155.05 41.48 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 102.889 -3.004 . . . . 0.0 102.889 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 16.3 tt -145.98 138.58 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.262 0.553 . . . . 0.0 109.733 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 8.2 m -115.9 142.06 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.868 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 172.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.95 150.72 40.05 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.593 -2.373 . . . . 0.0 104.593 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.98 -22.68 64.99 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.339 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.0 p -72.83 -30.05 63.72 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -176.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 mtm -129.25 20.84 5.75 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.378 0.609 . . . . 0.0 110.593 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.4 tt -42.18 -42.49 3.02 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 116.817 2.154 . . . . 0.0 116.817 -173.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 52.4 ptt85 -62.82 -40.53 97.68 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.632 -0.667 . . . . 0.0 111.934 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -78.66 -40.11 35.0 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.705 0.764 . . . . 0.0 109.867 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -59.22 -42.72 91.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.484 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.3 mt -62.22 -43.5 98.68 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -75.35 -14.14 60.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.965 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.59 -39.74 62.03 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.7 p -95.8 -38.54 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -125.21 77.32 67.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 123.14 0.576 . . . . 0.0 110.393 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.49 -7.45 20.31 Favored 'Trans proline' 0 C--N 1.345 0.393 0 N-CA-C 114.211 0.812 . . . . 0.0 114.211 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.4 m -92.67 1.68 57.13 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -81.45 140.37 34.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.061 0.458 . . . . 0.0 110.237 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 . . . . . 0 C--N 1.327 -0.37 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.446 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 . . . . . 0 C--O 1.216 -0.672 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.19 81.4 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 122.057 -0.402 . . . . 0.0 110.188 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.43 -43.99 84.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 38.0 mmt -62.63 -36.7 83.64 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.412 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.25 -41.98 85.42 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.101 -0.374 . . . . 0.0 110.288 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -65.2 -50.41 66.0 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.791 0.329 . . . . 0.0 110.311 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -61.18 -41.86 97.54 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.378 0.608 . . . . 0.0 111.669 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -67.49 -36.49 81.2 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.84 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -62.33 -44.67 95.96 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.253 0.933 . . . . 0.0 111.365 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.61 -38.51 87.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 19.5 m -69.98 -35.2 74.25 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.448 0.642 . . . . 0.0 111.428 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.92 -37.7 86.76 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 123.794 0.838 . . . . 0.0 110.514 -178.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.2 t -57.45 -47.29 85.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.321 -0.634 0 CA-C-O 121.487 0.66 . . . . 0.0 109.914 179.87 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.215 -0.731 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.57 -33.22 75.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.359 0.599 . . . . 0.0 111.82 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.28 -30.07 71.28 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -62.06 -41.07 97.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.448 ' HA ' ' HE3' ' A' ' 10' ' ' LYS . 44.6 m -69.41 -44.11 72.06 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.461 -0.149 . . . . 0.0 110.973 176.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -52.35 -47.4 66.11 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.588 0.355 . . . . 0.0 110.557 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -67.8 -43.47 79.58 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.448 ' HE3' ' HA ' ' A' ' 7' ' ' THR . 19.9 pttp -73.51 -25.31 60.37 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.029 -1.044 . . . . 0.0 112.243 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.0 mm -72.31 -38.6 61.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 174.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.23 -40.91 78.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.5 -42.67 99.14 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.504 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -34.18 75.92 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.745 -0.597 . . . . 0.0 112.45 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.8 -44.46 63.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.9 t -53.64 -42.73 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.149 171.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.51 -31.07 70.14 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.72 -0.613 . . . . 0.0 110.66 178.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.3 m -82.56 9.31 9.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.17 1.26 62.9 Favored Glycine 0 CA--C 1.517 0.173 0 N-CA-C 115.827 1.091 . . . . 0.0 115.827 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -71.04 126.6 30.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.773 0.787 . . . . 0.0 109.662 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.23 113.72 3.78 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 107.338 -2.305 . . . . 0.0 107.338 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.9 p -70.31 128.67 33.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 75.8 mt -86.78 -38.84 12.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -144.16 134.64 24.68 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.594 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.977 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 . . . . . 0 C--O 1.232 0.174 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -135.11 137.18 42.56 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.4 mt -125.3 131.5 72.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -111.38 139.57 46.68 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.01 129.73 42.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.997 0.919 . . . . 0.0 108.742 -177.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -82.05 130.61 35.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.72 113.03 22.91 Favored Pre-proline 0 CA--C 1.549 0.904 0 CA-C-N 117.715 0.234 . . . . 0.0 110.486 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -74.7 -18.71 19.32 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 117.825 -0.983 . . . . 0.0 113.36 -176.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.84 -23.34 60.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.851 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.0 mttt 60.42 38.84 19.11 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.2 p -71.7 -177.63 1.98 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 112.963 -1.926 . . . . 0.0 112.103 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.9 m -61.26 -10.01 6.09 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.345 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.68 132.32 54.29 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.33 -40.56 10.85 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -174.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -139.16 162.12 35.73 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.59 135.47 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 35.0 ttt-85 -124.66 116.31 22.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.519 0.728 . . . . 0.0 109.828 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.31 132.15 36.35 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 103.39 -2.818 . . . . 0.0 103.39 175.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -136.53 136.03 39.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.826 0.285 . . . . 0.0 110.901 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.53 113.55 27.19 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.787 -0.571 . . . . 0.0 110.543 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -151.62 149.88 29.65 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -108.34 131.42 54.75 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.5 mt -124.1 120.62 32.9 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -171.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -88.49 -37.81 15.48 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.887 0.851 . . . . 0.0 111.585 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -129.67 144.71 51.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.727 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -64.33 -17.54 63.78 Favored 'General case' 0 C--O 1.215 -0.736 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -60.75 -33.33 72.77 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.518 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -77.65 -34.91 52.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.065 0.459 . . . . 0.0 110.209 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.0 ttt -60.81 -48.83 80.0 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.559 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.2 m -66.31 -31.84 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.433 0.635 . . . . 0.0 110.086 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -38.21 87.15 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.198 -177.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -62.36 -38.99 91.68 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.3 mm -68.66 -31.81 52.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.949 -0.47 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -61.66 -39.48 91.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -44.32 58.17 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.689 0.757 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -59.53 -39.74 84.92 Favored 'General case' 0 C--O 1.21 -0.989 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.097 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.86 90.65 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.576 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -70.92 -35.95 72.46 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 119.887 -0.725 . . . . 0.0 109.759 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.83 -44.77 96.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.2 t -66.9 -39.76 84.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -62.21 -33.53 74.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 119.654 1.116 . . . . 0.0 111.187 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.8 ttt-85 -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -69.03 -37.41 77.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.935 0.398 . . . . 0.0 110.014 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -41.35 88.13 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.855 -0.528 . . . . 0.0 111.052 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -66.79 -40.11 88.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -63.48 -40.19 96.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.022 0.439 . . . . 0.0 110.861 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -78.02 -13.96 59.68 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.65 1.47 38.06 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -68.36 156.28 38.1 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.008 -0.701 . . . . 0.0 110.082 -177.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -39.35 93.85 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -149.41 167.99 24.65 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 103.453 -2.795 . . . . 0.0 103.453 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 ttp -129.18 147.97 51.08 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 118.746 0.703 . . . . 0.0 109.979 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -116.33 123.7 48.27 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 123.521 0.513 . . . . 0.0 110.559 177.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.4 tp -116.87 128.12 54.94 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.253 0.346 . . . . 0.0 111.405 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -91.32 110.83 22.13 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -102.54 129.12 48.99 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 32.6 t -121.05 109.38 25.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -76.84 142.95 40.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -119.35 107.62 13.59 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 172.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 97.7 p -126.74 155.65 42.41 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.33 -171.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 18.2 m -67.09 -47.91 69.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -147.0 158.19 43.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.813 -2.662 . . . . 0.0 103.813 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.92 157.14 39.83 Favored Pre-proline 0 C--N 1.312 -1.025 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.087 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -55.08 143.73 72.53 Favored 'Trans proline' 0 C--N 1.347 0.46 0 N-CA-C 116.374 1.644 . . . . 0.0 116.374 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.47 -21.72 15.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.638 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -90.81 91.98 8.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.872 178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.9 t0 14.88 70.98 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 117.773 2.509 . . . . 0.0 117.773 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -74.01 -16.85 61.04 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.608 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.75 -35.22 79.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.224 -0.298 . . . . 0.0 110.553 -175.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -60.81 -23.54 65.14 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.825 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.1 mm -79.04 -44.46 24.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 -176.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.04 -1.58 23.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.256 0.55 . . . . 0.0 111.917 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -108.59 5.35 24.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.503 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -124.72 132.27 53.39 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.153 0.502 . . . . 0.0 110.872 178.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -77.68 125.2 28.98 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 173.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -82.71 120.6 25.79 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -126.23 127.64 45.97 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.793 0.806 . . . . 0.0 110.008 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -139.3 114.71 9.79 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 60.21 -126.45 41.49 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 119.968 -1.11 . . . . 0.0 111.439 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.0 p -96.3 29.05 2.98 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.11 -0.641 . . . . 0.0 111.065 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 48.5 t -124.61 145.52 31.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.852 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.9 m -132.6 134.95 45.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.66 138.95 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.786 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 109.06 60.48 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -87.94 63.95 3.55 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.151 2.567 . . . . 0.0 117.171 -175.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 156.68 38.98 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.819 -0.551 . . . . 0.0 110.589 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -147.91 142.36 19.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 O-C-N 121.887 -0.508 . . . . 0.0 110.116 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.4 t -117.69 120.84 65.93 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.29 136.22 40.52 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.303 0.573 . . . . 0.0 109.857 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.45 -34.93 91.23 Favored Glycine 0 CA--C 1.51 -0.232 0 N-CA-C 114.868 0.707 . . . . 0.0 114.868 -176.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.2 t -53.16 -26.8 18.31 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.9 ptm -140.56 32.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.634 0.73 . . . . 0.0 109.808 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -46.64 -36.55 7.13 Favored 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 mtm180 -58.36 -46.99 85.23 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 121.496 -0.752 . . . . 0.0 111.175 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -78.65 -38.66 38.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.103 0.954 . . . . 0.0 111.922 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.63 -35.43 72.93 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.37 -41.05 73.61 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.887 -0.508 . . . . 0.0 110.684 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -69.3 -16.14 63.5 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.629 -177.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.82 65.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.067 0.461 . . . . 0.0 109.836 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.8 t -97.57 -43.84 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.457 0.646 . . . . 0.0 110.643 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -129.47 78.14 76.15 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.113 -178.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.05 -12.67 34.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 CA-C-O 121.381 0.492 . . . . 0.0 112.998 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -11.59 59.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -94.92 124.93 39.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.215 0.531 . . . . 0.0 111.164 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 . . . . . 0 C--N 1.324 -0.532 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.687 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 m120 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 120.044 -0.027 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.21 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.625 0.25 . . . . 0.0 110.567 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -66.38 -35.53 80.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.499 0.666 . . . . 0.0 109.348 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 77.0 mtp -71.04 -30.8 67.08 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.787 -0.571 . . . . 0.0 109.998 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -70.95 -30.41 66.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -61.19 -52.22 65.73 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.4 -37.2 86.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.536 0.684 . . . . 0.0 110.449 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -60.01 -46.87 88.06 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.036 176.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -65.88 -41.86 91.07 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.97 -36.88 82.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 29.3 m -76.12 -32.94 59.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.56 0.695 . . . . 0.0 112.21 176.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -62.31 -42.78 99.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -176.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.5 p -57.73 -39.18 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.829 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 110.027 176.837 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp . . . . . 0 C--O 1.222 -0.384 0 CA-C-O 121.1 0.476 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.29 -35.35 78.75 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.81 -27.44 68.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.073 0.464 . . . . 0.0 110.222 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -65.13 -50.67 65.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -64.47 -39.79 94.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.256 0.551 . . . . 0.0 110.309 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -55.42 -52.44 63.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.318 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -71.54 -27.1 62.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.346 -0.846 . . . . 0.0 111.964 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -64.97 -39.52 93.6 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 22.2 mm -71.85 -38.2 64.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 178.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.49 -44.89 81.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 176.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.73 93.23 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.674 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -59.32 -47.03 86.94 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 122.747 0.419 . . . . 0.0 111.585 -179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.7 mt -68.39 -47.31 67.66 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.698 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -57.84 -39.77 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.886 -0.509 . . . . 0.0 110.519 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.32 -25.56 67.95 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 121.871 -0.518 . . . . 0.0 111.276 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -84.77 4.89 30.75 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.796 0.438 . . . . 0.0 111.366 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.14 -1.68 47.38 Favored Glycine 0 CA--C 1.518 0.249 0 N-CA-C 115.939 1.135 . . . . 0.0 115.939 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.3 m-85 -65.78 129.17 38.84 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 117.736 0.768 . . . . 0.0 110.864 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.3 134.88 13.69 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.6 t -79.38 122.4 34.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 76.7 mt -90.73 -44.96 14.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 176.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -155.0 146.24 22.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 177.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 178.739 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 . . . . . 0 N--CA 1.465 0.311 0 CA-C-O 120.838 0.351 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -129.09 151.75 49.43 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.2 mt -134.54 134.78 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -115.1 131.58 56.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -127.62 132.93 49.7 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.655 0.782 . . . . 0.0 109.908 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -86.22 134.84 33.75 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.13 109.75 13.67 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.5 Cg_endo -74.38 -24.41 14.25 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 117.889 -0.941 . . . . 0.0 114.054 -174.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -74.88 -4.45 37.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.859 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt 44.02 40.4 3.35 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 122.948 1.356 . . . . 0.0 111.875 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.3 m -67.21 -172.96 0.24 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 112.621 -2.081 . . . . 0.0 110.613 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.9 t -50.35 -35.72 29.12 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -83.3 138.95 33.34 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 173.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -98.04 -37.84 9.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -142.39 161.59 37.65 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.853 -175.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.5 t -132.55 136.25 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -122.11 130.18 53.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 176.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.06 128.72 54.62 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -136.43 143.56 43.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.87 99.81 6.32 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -151.69 149.47 29.13 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.49 151.56 20.72 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -133.18 124.54 27.63 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.275 0.23 . . . . 0.0 111.468 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -75.96 -42.7 47.7 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -136.04 151.03 49.43 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.203 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -63.98 -18.72 64.57 Favored 'General case' 0 C--O 1.212 -0.881 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -60.61 -33.17 72.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -77.22 -40.92 43.26 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.65 -40.88 89.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.0 -31.85 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 O-C-N 121.79 -0.569 . . . . 0.0 111.256 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -70.65 -34.62 72.24 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.628 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -59.32 -38.66 80.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mm -71.63 -31.31 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 121.99 -0.444 . . . . 0.0 111.457 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -63.07 -39.61 95.22 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -68.19 -45.41 73.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.705 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -58.05 -45.11 87.55 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.189 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.79 -31.18 69.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.56 -45.43 68.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.339 0.59 . . . . 0.0 109.454 177.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -61.51 -44.06 97.74 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.83 0.824 . . . . 0.0 109.299 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 73.6 t -65.73 -32.81 59.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.427 -178.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 121.764 -0.585 . . . . 0.0 109.434 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -62.16 -46.03 90.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.96 0.41 . . . . 0.0 110.273 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 79.7 t -61.74 -40.43 86.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.888 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -66.48 -40.26 89.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.16 -0.963 . . . . 0.0 111.877 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -55.47 -46.07 76.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -73.41 -18.79 61.11 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.3 mt -99.27 -10.04 22.88 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.81 -1.53 5.71 Favored Glycine 0 CA--C 1.531 1.052 0 N-CA-C 120.935 3.134 . . . . 0.0 120.935 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -67.9 154.19 42.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.161 1.481 . . . . 0.0 108.107 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -65.44 -29.51 70.2 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 ttt85 -151.41 147.92 27.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.48 150.32 23.5 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -134.43 122.22 22.21 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 168.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -124.0 129.74 51.42 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.8 tp -92.29 121.84 34.19 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -115.81 108.57 16.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 5.4 t -108.45 117.34 53.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -84.68 150.58 25.03 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -129.05 116.77 19.81 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -139.59 158.24 44.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.97 0.414 . . . . 0.0 111.887 -174.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 55.0 m -69.23 -49.23 58.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -128.28 170.43 13.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.67 154.17 43.3 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.75 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.15 146.17 89.43 Favored 'Trans proline' 0 C--N 1.348 0.551 0 N-CA-C 114.579 0.953 . . . . 0.0 114.579 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.9 m -82.17 -6.01 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -113.14 100.43 8.59 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.438 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.4 t0 14.43 60.41 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 117.981 2.585 . . . . 0.0 117.981 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 p-90 -73.1 -17.45 61.4 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.99 -32.45 73.99 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.03 -28.38 67.7 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.178 0.514 . . . . 0.0 110.137 175.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.1 mm -75.37 -40.66 42.7 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 O-C-N 122.013 -0.429 . . . . 0.0 110.588 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.11 62.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 122.138 0.97 . . . . 0.0 109.306 177.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -88.6 -3.02 58.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.849 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -126.38 130.39 50.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.754 0.788 . . . . 0.0 112.296 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.3 m -76.41 125.62 29.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -83.3 123.08 29.27 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 176.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -127.65 139.19 52.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.774 0.797 . . . . 0.0 111.649 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -139.97 82.06 1.85 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.627 -1.17 . . . . 0.0 108.928 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.06 -112.66 5.02 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 119.698 -1.239 . . . . 0.0 111.726 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 p -86.2 8.69 20.13 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.76 0.424 . . . . 0.0 111.281 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -110.0 141.37 25.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 122.574 0.35 . . . . 0.0 110.637 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.0 t -135.46 137.4 42.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.104 -2.924 . . . . 0.0 103.104 171.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 99.8 t -133.77 136.5 53.99 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -105.03 104.18 45.51 Favored Pre-proline 0 N--CA 1.433 -1.321 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.467 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.99 147.71 24.2 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 117.387 -1.275 . . . . 0.0 112.191 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 155.91 39.9 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.9 tt -149.81 142.16 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.093 -1.817 . . . . 0.0 106.093 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.35 103.84 15.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.64 138.47 31.44 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.43 -22.92 66.14 Favored Glycine 0 C--N 1.321 -0.29 0 CA-C-N 116.072 -0.513 . . . . 0.0 113.977 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 22.0 p -59.21 -29.27 67.37 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.4 ptm -144.65 36.52 1.18 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 109.261 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -44.61 -40.35 5.72 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -173.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -58.24 -51.45 69.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 118.387 0.54 . . . . 0.0 111.411 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -76.99 -34.88 57.49 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.327 0.584 . . . . 0.0 112.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -67.43 -36.27 80.91 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.596 0.712 . . . . 0.0 111.707 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.85 -44.1 77.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.169 -179.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -71.88 -14.29 61.9 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.321 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.23 -26.42 62.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.442 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.1 p -108.73 -37.83 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 120.635 0.255 . . . . 0.0 111.465 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -125.19 75.29 67.92 Favored Pre-proline 0 CA--C 1.536 0.421 0 O-C-N 121.863 -0.523 . . . . 0.0 111.289 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.22 -7.42 21.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 N-CA-C 114.724 1.009 . . . . 0.0 114.724 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 20.3 t -85.85 -5.82 59.18 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.971 -0.456 . . . . 0.0 111.039 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -89.37 130.86 35.67 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 71.8 mtm-85 . . . . . 0 C--N 1.325 -0.487 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 -178.662 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 . . . . . 0 C--O 1.214 -0.768 0 CA-C-O 121.048 0.451 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.78 -35.86 64.28 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 111.905 176.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.61 -43.09 73.45 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 121.954 -0.466 . . . . 0.0 109.816 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 33.3 mmt -64.56 -33.24 75.44 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.87 79.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.222 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -68.06 -43.83 77.75 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -65.89 -39.43 90.63 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.5 0.667 . . . . 0.0 110.372 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -62.92 -38.8 92.43 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -64.71 -40.33 95.17 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 0.0 111.86 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 30.3 mt -64.54 -36.58 84.68 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 122.12 -0.363 . . . . 0.0 111.059 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 7.6 p -76.06 -32.17 59.17 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.585 -0.697 . . . . 0.0 111.281 174.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -42.62 98.09 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 p -58.99 -39.2 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.413 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.329 -0.314 0 O-C-N 121.473 -0.767 . . . . 0.0 110.192 177.851 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.5 tp . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 121.677 0.751 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.9 mt -73.67 -37.06 65.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.39 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.69 -34.03 77.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.631 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -59.33 -50.58 73.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.404 ' HG1' HD11 ' A' ' 121' ' ' LEU . 11.6 m -66.0 -41.9 90.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.89 0.376 . . . . 0.0 111.283 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -57.21 -52.13 66.57 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.113 0.565 . . . . 0.0 111.95 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 92.6 m95 -70.8 -30.98 67.58 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.807 -0.558 . . . . 0.0 110.656 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -69.59 -38.15 77.21 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.874 -0.516 . . . . 0.0 111.693 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.0 mm -70.39 -36.51 67.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.33 -43.03 83.02 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.83 -44.82 84.4 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -59.08 -45.05 91.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.228 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.6 mt -69.23 -47.61 64.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.0 p -62.4 -29.03 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.362 177.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.4 -24.94 61.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 177.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 t -87.84 8.83 24.15 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.501 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.74 2.41 61.37 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 116.79 1.476 . . . . 0.0 116.79 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -72.48 113.05 9.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 118.182 0.991 . . . . 0.0 109.458 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.54 126.0 24.15 Favored Glycine 0 C--O 1.226 -0.39 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.538 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 70.9 t -76.42 121.95 29.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.6 mt -91.39 -42.09 13.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -153.11 145.0 23.61 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 118.273 0.488 . . . . 0.0 112.31 -179.51 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -113.43 147.07 38.5 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 96.6 mt -132.76 129.57 58.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 103.069 -2.938 . . . . 0.0 103.069 169.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -108.16 129.3 55.18 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.1 134.72 47.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -179.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -84.23 136.87 33.77 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -90.97 105.76 13.41 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 118.005 0.366 . . . . 0.0 111.194 -178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -72.06 -17.31 28.4 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 118.402 -0.599 . . . . 0.0 112.892 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.33 -15.85 62.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.0 mtmt 58.12 38.95 26.51 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -175.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -62.57 -177.43 0.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 112.945 -1.934 . . . . 0.0 112.377 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.9 m -57.21 -10.66 1.33 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.034 0.534 . . . . 0.0 111.828 175.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -127.93 151.26 49.32 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -96.9 -31.2 12.69 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.083 0.468 . . . . 0.0 109.952 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -135.33 161.91 34.07 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.5 t -123.17 133.58 68.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 ttt-85 -117.31 108.78 16.02 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 174.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.7 mt -85.89 130.53 34.52 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 103.777 -2.675 . . . . 0.0 103.777 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -134.65 123.09 23.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 117.993 0.361 . . . . 0.0 111.267 -176.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -102.69 94.55 5.68 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.04 0.447 . . . . 0.0 111.582 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -151.24 139.73 20.53 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -92.65 151.6 20.01 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -134.64 119.85 18.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.68 -173.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -86.48 -37.58 18.13 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.71 0.767 . . . . 0.0 110.52 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.5 145.79 51.41 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.135 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.0 ptt180 -66.1 -20.74 66.26 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.097 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -64.09 -33.24 75.32 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.141 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -77.64 -35.25 52.73 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.475 -0.766 . . . . 0.0 109.21 175.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 18.5 ttt -58.26 -50.41 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.954 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 29.8 m -60.61 -31.87 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -69.11 -37.94 78.65 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -59.87 -41.71 92.11 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -71.78 -36.39 58.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 121.447 -0.783 . . . . 0.0 111.72 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -65.11 -30.72 71.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -76.53 -41.72 45.73 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.618 0.723 . . . . 0.0 109.564 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -58.06 -35.0 70.72 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.272 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.44 78.57 Favored 'General case' 0 C--N 1.319 -0.759 0 O-C-N 122.056 -0.403 . . . . 0.0 111.41 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -72.89 -36.02 67.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.609 0.719 . . . . 0.0 109.168 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -43.18 99.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.92 -38.42 81.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.49 -41.15 80.16 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.419 1.009 . . . . 0.0 110.243 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.55 -41.66 99.03 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.165 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 87.5 t -69.99 -46.43 73.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.454 0.645 . . . . 0.0 109.704 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.54 -40.1 78.1 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 111.131 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -63.33 -51.72 64.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.403 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -71.12 -22.26 62.1 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.08 -4.96 57.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.886 0.374 . . . . 0.0 110.51 175.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.82 13.71 64.24 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 114.289 0.475 . . . . 0.0 114.289 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -79.64 145.4 33.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.776 -0.838 . . . . 0.0 112.605 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.1 mtp85 -72.41 -32.89 66.74 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.882 177.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -153.13 150.8 29.45 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 177.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.3 ttp -131.59 150.58 52.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -117.74 139.25 51.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -135.16 131.62 37.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.378 0.535 . . . . 0.0 110.287 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.7 tp -93.55 122.28 35.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -110.57 108.45 18.41 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.6 t -105.23 105.6 18.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 120.897 0.38 . . . . 0.0 110.801 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -75.73 144.59 41.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 174.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -121.74 104.14 9.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 103.125 -2.916 . . . . 0.0 103.125 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -123.1 156.56 34.7 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.543 0.527 . . . . 0.0 110.149 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -67.06 -52.69 39.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 110.583 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.29 -179.41 4.73 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.99 141.8 23.23 Favored Pre-proline 0 C--N 1.317 -0.832 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -57.12 142.92 94.35 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 117.696 -1.069 . . . . 0.0 113.851 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.1 m -77.65 -10.25 12.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -173.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -110.04 56.21 0.63 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.3 t0 61.76 52.53 3.48 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 123.238 1.494 . . . . 0.0 114.882 174.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -65.45 -17.88 64.89 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.349 -0.844 . . . . 0.0 112.69 175.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -58.81 -37.4 76.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -173.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.9 -18.61 65.46 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.3 mm -73.02 -37.87 54.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.11 -25.08 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.427 0.632 . . . . 0.0 110.438 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -89.15 3.14 52.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.184 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -116.95 98.49 6.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.31 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 47.1 m -68.53 126.11 28.61 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 172.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -86.25 108.44 18.38 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -110.31 101.39 10.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.76 0.79 . . . . 0.0 113.013 -176.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.2 tttm -99.48 75.58 1.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.76 -108.35 2.08 Favored Glycine 0 C--O 1.228 -0.238 0 C-N-CA 119.529 -1.319 . . . . 0.0 112.568 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 52.0 p -72.4 9.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.535 1.134 . . . . 0.0 112.965 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 99.3 t -129.49 144.82 36.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 C-N-CA 122.796 0.438 . . . . 0.0 110.471 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.0 t -136.34 118.32 15.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -118.79 126.39 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.471 -2.075 0 CA-C-O 122.74 1.257 . . . . 0.0 110.379 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -99.42 104.53 27.63 Favored Pre-proline 0 N--CA 1.419 -2.001 0 CA-C-N 111.4 -2.636 . . . . 0.0 109.474 -176.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -80.27 149.47 19.45 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 117.843 -0.971 . . . . 0.0 113.973 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.32 149.84 31.55 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.0 tt -142.72 123.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.1 t -102.57 107.84 22.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 136.16 33.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -60.7 -33.58 83.08 Favored Glycine 0 CA--C 1.511 -0.182 0 N-CA-C 114.908 0.723 . . . . 0.0 114.908 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.5 t -56.05 -23.88 36.19 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.5 ptm -140.97 35.83 1.75 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.586 1.184 . . . . 0.0 109.44 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.404 HD11 ' HG1' ' A' ' 7' ' ' THR . 0.9 OUTLIER -48.81 -41.94 34.39 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 -171.554 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -61.52 -51.36 68.93 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.16 1.8 . . . . 0.0 111.387 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -73.69 -32.94 64.2 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.828 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -72.73 -39.92 66.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.889 0.852 . . . . 0.0 111.309 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -68.22 -43.47 77.93 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.751 -0.593 . . . . 0.0 110.491 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.424 -177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.41 -32.03 62.54 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.4 t -91.21 -43.64 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.367 0.603 . . . . 0.0 110.157 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -127.39 79.61 73.0 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.036 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.6 -13.85 38.19 Favored 'Trans proline' 0 C--N 1.347 0.456 0 N-CA-C 114.535 0.937 . . . . 0.0 114.535 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.6 m -84.47 -2.46 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -76.83 137.29 39.11 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.447 0.641 . . . . 0.0 111.183 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 . . . . . 0 C--N 1.325 -0.465 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.76 178.616 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 57.8 t30 . . . . . 0 CA--C 1.533 0.311 0 CA-C-O 120.988 0.423 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.92 -38.06 72.93 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.286 -0.259 . . . . 0.0 110.705 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -64.03 -45.73 87.6 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtt -62.69 -28.95 70.3 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.675 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.08 -34.49 73.53 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 121.63 -0.669 . . . . 0.0 111.115 -178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -66.37 -45.64 79.42 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -67.1 -38.03 84.96 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.259 0.552 . . . . 0.0 110.375 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 60.3 mtt85 -61.86 -43.49 98.73 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -63.88 -42.17 97.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 118.515 0.598 . . . . 0.0 111.887 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.5 -36.36 83.95 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 122.092 -0.38 . . . . 0.0 111.648 -178.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 10.6 p -76.14 -35.66 59.14 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.321 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -41.24 95.38 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.69 0.796 . . . . 0.0 112.837 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -63.13 -38.25 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 118.753 0.706 . . . . 0.0 111.349 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 N--CA 1.467 0.402 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.406 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 C--O 1.224 -0.28 0 CA-C-O 120.914 0.387 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 22.4 tp -60.65 -48.11 83.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.821 0.343 . . . . 0.0 110.491 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -73.75 -30.63 62.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.443 0.64 . . . . 0.0 110.804 -178.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -61.62 -43.0 99.67 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.9 m -66.34 -44.31 83.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.778 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -53.05 -55.43 23.82 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -68.59 -35.66 77.66 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.527 -0.733 . . . . 0.0 112.858 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -74.88 -25.24 58.81 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.113 -0.992 . . . . 0.0 112.515 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.4 mm -67.76 -40.78 84.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 175.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.96 -40.29 80.21 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -41.95 96.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.392 177.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -63.54 -42.33 98.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.585 0.231 . . . . 0.0 110.539 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -65.2 -45.74 83.56 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.4 t -60.48 -40.11 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.101 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -62.16 -30.63 71.19 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.664 -0.647 . . . . 0.0 110.623 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.8 m -80.39 11.41 3.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.926 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.14 3.19 63.71 Favored Glycine 0 C--O 1.229 -0.194 0 N-CA-C 115.296 0.879 . . . . 0.0 115.296 175.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.405 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 16.5 m-85 -68.8 126.4 29.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.024 0.912 . . . . 0.0 110.361 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 134.89 13.75 Favored Glycine 0 C--O 1.225 -0.445 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.57 119.18 24.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 O-C-N 122.013 -0.698 . . . . 0.0 110.142 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 77.2 mt -89.41 -46.03 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -149.76 120.37 7.49 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.285 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.599 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 173.665 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 . . . . . 0 C--O 1.22 -0.473 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -144.73 142.97 30.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.36 0.982 . . . . 0.0 113.445 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.8 mt -136.5 125.98 38.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -107.77 123.87 49.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.405 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.3 mm? -124.15 128.58 49.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -83.0 132.22 35.15 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.56 123.52 89.64 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.67 -19.51 24.21 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 116.955 -1.563 . . . . 0.0 112.943 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -66.07 -33.87 76.78 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 56.75 27.38 12.66 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.65 1.214 . . . . 0.0 110.638 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 t -79.46 -172.85 3.43 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 112.217 -2.265 . . . . 0.0 106.347 176.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.7 m -41.75 -25.45 0.06 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -110.38 127.27 55.0 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 169.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.423 ' HB2' ' HE3' ' A' ' 80' ' ' MET . 39.5 m-20 -91.01 -32.42 15.93 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.62 166.42 32.15 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.36 136.67 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.2 ttt180 -112.64 111.28 21.98 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -81.47 128.53 33.98 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 101.917 -3.364 . . . . 0.0 101.917 173.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -136.13 114.89 12.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.732 -176.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tttm -87.38 94.66 9.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -151.7 136.41 17.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.264 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -97.26 147.24 24.33 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 175.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.97 134.61 47.56 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -92.25 -39.93 11.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -120.39 147.84 44.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.634 0.73 . . . . 0.0 112.418 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -61.3 -21.26 63.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.48 -33.25 74.73 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.961 -0.462 . . . . 0.0 109.8 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -68.24 -37.59 80.95 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 54.1 ttm -61.94 -46.5 89.03 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.67 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.1 m -68.02 -36.62 76.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.745 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -26.43 62.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.862 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -65.15 -34.5 78.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -72.08 -30.87 37.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.495 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.63 -40.17 93.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -67.91 -44.85 75.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.864 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -61.02 -38.76 87.21 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.465 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.71 76.03 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -68.87 -37.04 78.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.244 0.545 . . . . 0.0 109.917 177.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -64.21 -42.3 96.67 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.29 -40.41 87.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.066 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.521 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -57.53 -36.1 71.15 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 119.108 0.867 . . . . 0.0 111.333 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -64.33 -45.95 85.59 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.531 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.72 -40.8 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.663 0.744 . . . . 0.0 110.248 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -39.83 78.56 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.348 0.659 . . . . 0.0 110.201 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -63.35 -47.57 81.59 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.487 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -73.36 -23.01 60.15 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.989 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.3 -11.88 57.25 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.668 0.271 . . . . 0.0 111.353 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.21 17.6 68.32 Favored Glycine 0 CA--C 1.52 0.401 0 CA-C-O 121.55 0.528 . . . . 0.0 112.482 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 mmt-85 -69.62 136.95 51.85 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.113 -0.64 . . . . 0.0 111.503 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -72.09 -32.04 66.63 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -152.32 145.34 24.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 N-CA-C 102.536 -3.135 . . . . 0.0 102.536 173.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.423 ' HE3' ' HB2' ' A' ' 42' ' ' ASP . 1.1 ttp -125.36 143.04 51.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -178.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -120.58 129.79 53.92 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -117.64 134.06 55.29 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.021 -176.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.87 124.9 38.18 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -112.06 128.27 56.14 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 121.905 -0.497 . . . . 0.0 109.793 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.65 105.85 17.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -75.14 136.58 41.07 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -111.99 108.36 17.66 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 173.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -126.39 158.52 35.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.71 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.9 t -80.01 -28.9 39.36 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.632 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -155.41 167.11 31.44 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.85 158.83 41.54 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 122.669 0.388 . . . . 0.0 111.174 -175.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.41 153.17 42.47 Favored 'Trans proline' 0 C--N 1.355 0.898 0 O-C-N 122.178 0.567 . . . . 0.0 112.871 175.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -62.72 -29.69 47.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -157.41 151.61 24.76 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.8 t0 49.8 15.89 0.18 Allowed 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 27.7 p-90 -76.81 -25.21 53.01 Favored 'General case' 0 C--O 1.216 -0.669 0 O-C-N 121.118 -0.989 . . . . 0.0 110.741 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.05 -31.93 72.39 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 121.989 -0.444 . . . . 0.0 111.783 -175.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.59 -17.71 62.9 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.128 0.49 . . . . 0.0 110.823 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.8 mm -75.87 -36.12 31.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.22 -17.51 63.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.074 0.464 . . . . 0.0 111.341 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -96.34 2.71 52.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -121.48 138.42 54.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.434 0.635 . . . . 0.0 111.013 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 62.4 m -80.59 125.88 30.55 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -82.66 130.49 35.13 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 105.084 -2.191 . . . . 0.0 105.084 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -129.6 137.11 50.52 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.557 0.694 . . . . 0.0 112.448 -178.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -132.6 75.59 1.64 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.15 -112.66 5.18 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.989 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.8 t -77.5 16.49 0.63 Allowed 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.68 0.752 . . . . 0.0 111.935 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 76.6 t -130.07 141.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 121.47 -0.769 . . . . 0.0 111.677 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 70.9 m -132.49 140.21 48.27 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -138.24 138.17 43.45 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.291 0 CA-C-O 121.566 0.698 . . . . 0.0 110.564 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.98 108.77 62.52 Favored Pre-proline 0 N--CA 1.435 -1.2 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.101 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -78.83 155.33 26.83 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 115.363 -2.625 . . . . 0.0 112.132 176.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -153.13 153.42 32.75 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 102.269 -3.234 . . . . 0.0 102.269 175.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.4 tt -146.88 130.08 8.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.0 m -105.92 133.53 50.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 N-CA-C 104.473 -2.417 . . . . 0.0 104.473 172.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.82 136.18 53.14 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -55.21 -34.13 58.57 Favored Glycine 0 C--O 1.227 -0.332 0 N-CA-C 115.65 1.02 . . . . 0.0 115.65 -174.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.4 t -61.7 -17.08 54.2 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -141.49 25.44 2.02 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.665 0.745 . . . . 0.0 109.815 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -48.0 -39.78 20.61 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -170.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -58.72 -51.33 70.41 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.456 1.026 . . . . 0.0 111.729 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -73.76 -34.71 64.82 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.333 0.587 . . . . 0.0 111.585 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.91 -40.59 91.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.065 0.936 . . . . 0.0 111.789 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.54 -44.76 77.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.433 -176.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -70.97 -13.75 62.12 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.164 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.82 -35.5 62.44 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 176.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.62 -36.8 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 120.632 0.253 . . . . 0.0 111.327 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -126.39 75.85 73.46 Favored Pre-proline 0 C--N 1.326 -0.422 0 O-C-N 122.079 -0.388 . . . . 0.0 110.755 177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.95 -14.99 39.69 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 118.53 -0.513 . . . . 0.0 112.766 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 m -76.03 0.78 17.42 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.821 0.449 . . . . 0.0 112.008 178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -117.27 139.07 51.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 -179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 . . . . . 0 CA--C 1.514 -0.441 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.699 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.223 -0.314 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.03 -45.48 92.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.96 0.409 . . . . 0.0 110.727 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -63.7 -46.08 87.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.218 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 84.1 mtp -64.33 -29.46 70.54 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.089 -0.382 . . . . 0.0 110.947 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -34.9 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.716 -0.615 . . . . 0.0 110.672 178.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -66.45 -47.18 73.96 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -67.09 -38.88 86.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.541 0.686 . . . . 0.0 110.401 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.4 ttt-85 -60.64 -44.19 96.69 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.35 99.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 111.995 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -33.77 76.55 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.856 0.36 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -75.97 -35.26 59.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.751 0.786 . . . . 0.0 111.523 175.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -62.13 -43.57 98.55 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 124.041 0.936 . . . . 0.0 113.341 -176.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 4.3 p -57.4 -43.43 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.86 -176.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.326 -0.421 0 O-C-N 121.657 -0.652 . . . . 0.0 110.117 178.603 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.1 tt . . . . . 0 N--CA 1.471 0.599 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 53.6 tp -54.32 -35.25 62.47 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.609 0.718 . . . . 0.0 112.299 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 61.9 mt-10 -57.12 -25.03 58.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -178.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -51.81 -50.46 60.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.602 0.637 . . . . 0.0 110.714 177.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.0 m -68.56 -39.61 80.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.2 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -58.76 -57.29 13.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.113 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -70.34 -31.55 68.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -70.09 -35.12 73.94 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.644 -1.222 . . . . 0.0 109.183 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.2 mm -65.0 -44.78 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.16 -42.04 80.31 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.33 -41.28 98.89 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -62.73 -45.75 91.29 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -66.84 -51.89 50.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.194 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.7 t -56.28 -43.09 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.927 0.394 . . . . 0.0 110.306 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -71.28 -18.24 62.43 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.109 -0.994 . . . . 0.0 112.362 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.9 t -88.08 9.51 22.32 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.967 0.507 . . . . 0.0 110.734 177.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.28 0.24 57.03 Favored Glycine 0 CA--C 1.517 0.205 0 N-CA-C 116.135 1.214 . . . . 0.0 116.135 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -69.93 107.43 3.57 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.73 133.26 34.88 Favored Glycine 0 CA--C 1.511 -0.211 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.212 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.5 t -75.95 125.02 35.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 52.4 mt -93.91 -46.05 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -147.79 133.37 18.78 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.409 -178.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.805 0 N-CA-C 101.203 -3.629 . . . . 0.0 101.203 173.876 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 C--O 1.235 0.322 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.19 164.71 14.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.1 mt -135.58 126.29 43.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 175.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 76.8 m95 -105.9 132.87 51.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 mp -133.72 145.16 49.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 -177.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -98.66 150.14 22.08 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 125.64 88.02 Favored Pre-proline 0 CA--C 1.544 0.75 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.63 -29.06 13.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 116.939 -1.574 . . . . 0.0 113.242 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -73.52 -19.42 60.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.847 0.356 . . . . 0.0 110.744 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.1 mttm 53.89 43.34 31.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.103 1.43 . . . . 0.0 110.045 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.2 p -69.73 -177.71 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 112.237 -2.256 . . . . 0.0 108.737 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -46.82 -33.07 4.14 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.09 113.47 21.06 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 172.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -78.48 -44.86 23.48 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.359 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -137.35 166.17 24.46 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -173.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.2 t -134.55 139.74 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.791 0.837 . . . . 0.0 109.497 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 -120.34 124.27 45.14 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -91.77 130.17 37.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 104.264 -2.495 . . . . 0.0 104.264 174.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -136.49 139.79 42.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -125.72 103.12 7.65 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.775 0.716 . . . . 0.0 111.906 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -149.05 138.81 21.91 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.31 145.78 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.2 mt -129.02 126.24 39.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.46 0.171 . . . . 0.0 111.085 -173.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -90.17 -38.15 13.69 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.674 0.749 . . . . 0.0 110.637 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -133.42 151.27 51.79 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.787 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ptt-85 -65.34 -18.14 65.08 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -64.53 -33.33 75.65 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.787 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -69.29 -40.37 77.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 91.8 mtp -55.92 -47.95 76.57 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.149 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -64.15 -31.21 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.682 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -71.13 -41.37 70.6 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -57.46 -43.65 84.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.164 0.507 . . . . 0.0 110.629 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -68.03 -30.65 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.423 -176.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.94 73.82 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.92 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -73.71 -43.75 58.36 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -54.38 -39.1 66.89 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 175.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.29 93.79 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.042 0.837 . . . . 0.0 110.791 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -67.97 -42.39 80.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.516 0.674 . . . . 0.0 109.379 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -59.18 -42.38 90.68 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.6 -36.9 77.65 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.975 0 CA-C-O 118.833 -0.603 . . . . 0.0 110.558 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.0 -42.59 85.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.951 1.25 . . . . 0.0 109.391 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -65.91 -48.41 71.51 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.328 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.0 t -66.17 -35.8 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.264 0.554 . . . . 0.0 110.346 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -43.91 96.9 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 121.558 -0.714 . . . . 0.0 110.037 178.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -67.61 -39.3 84.75 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.396 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.91 -40.36 88.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.825 0.345 . . . . 0.0 111.477 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -91.83 0.54 57.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.85 19.71 65.72 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 115.746 1.058 . . . . 0.0 115.746 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -77.93 142.58 38.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.684 -0.892 . . . . 0.0 110.698 -176.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -63.65 -40.48 96.96 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.13 -0.356 . . . . 0.0 111.182 -178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.3 ptt-85 -144.91 160.37 41.41 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 102.09 -3.3 . . . . 0.0 102.09 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -135.09 145.9 48.37 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 119.568 1.076 . . . . 0.0 110.895 175.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 110' ' ' SER . 40.2 tttp -123.62 127.82 48.8 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.666 0.604 . . . . 0.0 109.671 174.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -122.5 132.64 54.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.814 -175.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.9 tp -92.79 123.66 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 174.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -115.6 108.5 16.49 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.3 t -105.08 112.92 40.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.107 0.254 . . . . 0.0 111.46 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.41 135.16 35.64 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 175.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -110.92 117.84 34.47 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.9 p -132.87 168.39 18.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -176.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.4 t -92.55 -28.95 16.44 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.64 161.73 39.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.36 149.88 39.13 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -177.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -64.35 151.14 86.67 Favored 'Trans proline' 0 C--N 1.346 0.418 0 O-C-N 122.34 0.652 . . . . 0.0 112.562 177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.0 m -77.76 -12.7 13.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 119.096 2.998 . . . . 0.0 119.096 -169.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.82 101.66 8.04 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 117.404 2.372 . . . . 0.0 117.404 -173.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 44.52 28.66 0.33 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 117.703 2.483 . . . . 0.0 117.703 172.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -63.11 -21.75 66.39 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -176.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -61.72 -31.27 71.42 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.746 -0.596 . . . . 0.0 110.774 -177.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.5 -28.09 69.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.082 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.4 mm -73.59 -35.81 45.7 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.75 71.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.444 0.64 . . . . 0.0 111.114 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.65 -24.42 59.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.293 0.568 . . . . 0.0 111.358 178.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -85.16 99.36 11.02 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -171.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 59.6 m -68.26 122.58 18.64 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 171.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.88 120.66 25.96 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -118.76 128.18 54.24 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.079 0.943 . . . . 0.0 110.474 -179.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -130.75 75.57 1.67 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.246 -1.343 . . . . 0.0 107.773 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.02 -112.63 5.0 Favored Glycine 0 C--O 1.219 -0.831 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.703 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.1 p -84.49 16.99 2.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -121.64 140.73 44.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.423 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 7.9 p -134.88 137.71 43.47 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -134.01 130.05 54.82 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.724 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -99.09 110.76 59.05 Favored Pre-proline 0 N--CA 1.432 -1.361 0 CA-C-N 114.424 -1.262 . . . . 0.0 107.979 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -79.64 149.95 21.32 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 117.417 -1.255 . . . . 0.0 111.597 179.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.84 150.69 29.59 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.9 tt -145.89 137.36 19.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 -178.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.0 m -119.83 133.79 65.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 103.559 -2.756 . . . . 0.0 103.559 175.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.38 136.21 53.9 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 -176.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -45.58 -43.35 10.95 Favored Glycine 0 N--CA 1.461 0.318 0 N-CA-C 116.915 1.526 . . . . 0.0 116.915 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.25 -29.93 35.48 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.9 ptm -140.6 30.84 1.88 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 122.664 1.221 . . . . 0.0 109.624 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.06 -37.81 47.81 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -58.39 -40.83 83.43 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.621 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -78.44 -43.37 27.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.808 0.813 . . . . 0.0 111.105 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.66 -43.37 93.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.991 0.901 . . . . 0.0 112.196 -177.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -65.01 -42.06 94.79 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.27 -175.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -74.78 -18.39 60.48 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.72 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.72 -36.26 65.18 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 59.5 t -85.59 -40.19 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.427 0.632 . . . . 0.0 110.117 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -124.91 82.26 61.17 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.122 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -68.92 -4.54 13.65 Favored 'Trans proline' 0 C--N 1.347 0.462 0 N-CA-C 114.919 1.084 . . . . 0.0 114.919 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 35.4 p -80.53 -8.18 59.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.367 0.603 . . . . 0.0 109.628 175.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -86.15 124.93 33.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.697 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 . . . . . 0 C--N 1.324 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.546 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 32.0 m120 . . . . . 0 C--O 1.219 -0.55 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.68 95.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.19 0.519 . . . . 0.0 111.117 177.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -44.23 92.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 48.7 mtp -69.03 -28.89 66.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.02 92.49 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.901 -0.499 . . . . 0.0 110.222 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.99 -46.73 80.21 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -60.33 -45.6 92.86 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.241 1.019 . . . . 0.0 110.373 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 22.2 ttm180 -65.48 -33.86 76.92 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.3 -42.75 92.74 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 121.224 -0.19 . . . . 0.0 110.905 177.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.18 -41.0 91.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 28.0 m -67.09 -35.36 79.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.562 0.696 . . . . 0.0 111.019 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tt -70.18 -33.76 72.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 39.9 t -58.36 -44.44 88.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--N 1.324 -0.519 0 C-N-CA 120.475 -0.49 . . . . 0.0 109.928 178.804 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.5 tt . . . . . 0 N--CA 1.471 0.62 0 CA-C-O 121.63 0.729 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.35 -39.74 89.38 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.24 -38.15 90.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.712 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -62.24 -46.18 90.01 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 23.5 m -65.16 -43.23 92.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.047 0.451 . . . . 0.0 110.519 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.63 -53.94 51.76 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.384 0.673 . . . . 0.0 111.156 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -69.8 -27.41 64.87 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.956 -0.465 . . . . 0.0 111.679 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -71.13 -36.85 72.26 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.745 -0.597 . . . . 0.0 111.881 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.4 mm -67.84 -45.9 83.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.86 -45.86 74.61 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.9 91.96 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -34.74 76.58 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.684 -176.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -71.07 -52.18 20.92 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.531 178.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.0 m -60.1 -32.84 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.828 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -67.99 -23.96 65.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.417 . . . . 0.0 110.723 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 t -89.17 9.82 24.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.809 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.73 2.68 59.73 Favored Glycine 0 C--O 1.227 -0.293 0 N-CA-C 115.612 1.005 . . . . 0.0 115.612 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 15.5 m-85 -72.31 99.76 2.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.064 0.932 . . . . 0.0 109.402 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.76 134.36 40.99 Favored Glycine 0 CA--C 1.512 -0.125 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.819 -177.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.2 t -77.23 124.26 35.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 79.3 mt -90.09 -43.58 14.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -150.13 127.33 11.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.402 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.674 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 170.551 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -140.45 144.51 36.13 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -176.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 87.7 mt -139.31 132.24 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -105.22 134.33 48.51 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -129.72 139.75 51.26 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.927 0.491 . . . . 0.0 110.294 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -86.93 140.47 29.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -92.44 105.61 14.96 Favored Pre-proline 0 CA--C 1.553 1.068 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 91.9 Cg_endo -72.76 -17.29 25.99 Favored 'Trans proline' 0 C--N 1.352 0.729 0 CA-C-N 118.431 0.475 . . . . 0.0 112.991 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -67.47 -16.41 64.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.751 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.9 mttt 54.49 42.37 31.38 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 122.67 1.224 . . . . 0.0 108.823 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.4 p -72.78 -175.04 1.59 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 112.884 -1.962 . . . . 0.0 109.637 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.5 m -52.35 -31.71 34.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.769 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -98.66 136.25 38.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.043 0.537 . . . . 0.0 109.62 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -83.34 -33.75 25.8 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.9 mt -135.01 158.03 45.39 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.619 -176.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.21 141.7 43.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -138.5 150.71 46.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.247 0.546 . . . . 0.0 111.079 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.1 mt -113.98 135.96 53.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -136.47 129.92 31.81 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.261 0.35 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -106.11 114.84 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -151.76 150.4 30.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -118.85 139.56 51.41 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 103.601 -2.74 . . . . 0.0 103.601 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -152.22 144.45 23.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -82.03 -35.15 29.1 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -133.3 154.52 50.63 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.5 ptt-85 -62.9 -17.87 62.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -177.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -61.77 -33.34 73.92 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.622 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.53 -39.1 67.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 ttp -61.84 -45.81 92.17 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.586 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.41 -33.35 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.22 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -65.05 -39.87 93.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.758 -178.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -57.87 -43.49 86.01 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.172 0.295 . . . . 0.0 110.421 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mt -74.07 -35.59 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.761 -0.587 . . . . 0.0 111.341 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.3 -39.0 78.19 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -76.61 -40.76 48.44 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.571 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.56 93.34 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.21 -33.93 76.56 Favored 'General case' 0 C--O 1.209 -1.036 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.66 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.19 -41.73 96.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.584 0.707 . . . . 0.0 109.75 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -63.61 -46.21 86.78 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.304 0.574 . . . . 0.0 109.697 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.4 t -65.24 -38.23 82.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.908 -177.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -58.6 -43.03 89.41 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -64.47 -42.05 96.15 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.177 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.9 t -65.7 -39.47 84.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.602 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.3 OUTLIER -61.93 -44.95 95.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.561 -0.712 . . . . 0.0 111.95 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.3 m80 -64.44 -31.54 72.79 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.484 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -66.73 -24.21 66.2 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.914 0.387 . . . . 0.0 111.325 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.7 mp -100.68 -17.64 16.9 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.52 6.94 59.89 Favored Glycine 0 CA--C 1.523 0.594 0 CA-C-O 121.574 0.541 . . . . 0.0 113.93 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 -71.37 140.8 50.31 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -59.14 -47.01 86.84 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -170.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -153.97 153.72 32.49 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.675 0.671 . . . . 0.0 110.609 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.451 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -102.19 164.13 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.654 0.782 . . . . 0.0 112.716 -178.349 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.6 mptt -148.2 129.01 14.28 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 101.389 -3.56 . . . . 0.0 101.389 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -139.57 128.11 22.99 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -174.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.6 tp -91.43 121.16 32.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -115.16 108.62 16.86 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 12.4 t -101.69 113.06 36.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -82.14 143.51 31.4 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 175.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -123.25 117.35 25.09 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 173.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.1 m -135.59 158.31 44.7 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 123.447 0.467 . . . . 0.0 111.522 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 52.3 m -68.16 -49.16 62.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-O 121.885 0.85 . . . . 0.0 108.844 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -144.31 158.77 43.56 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 103.142 -2.91 . . . . 0.0 103.142 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.76 155.94 53.0 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.959 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -63.61 154.11 70.96 Favored 'Trans proline' 0 C--N 1.346 0.404 0 O-C-N 122.208 0.583 . . . . 0.0 112.789 177.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.6 m -88.26 10.52 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -121.83 83.49 2.1 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 114.449 1.278 . . . . 0.0 114.449 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 31.09 45.0 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 118.005 2.594 . . . . 0.0 118.005 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -70.01 -15.37 63.01 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.43 -0.794 . . . . 0.0 111.48 179.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -64.38 -29.67 70.74 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.664 -0.648 . . . . 0.0 109.687 -178.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.456 ' HA ' ' HE2' ' A' ' 101' ' ' LYS . 78.0 mm-40 -67.29 -18.32 65.14 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.635 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.1 mm -87.16 -38.4 12.11 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.667 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.04 -39.57 82.39 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.419 0.628 . . . . 0.0 112.477 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 98' ' ' GLU . 48.0 pttt -89.63 3.79 51.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.763 -178.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -102.22 107.19 18.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.805 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.5 m -68.31 123.19 20.07 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 175.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -85.65 125.35 33.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 178.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -125.89 127.32 45.82 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 121.688 0.756 . . . . 0.0 109.496 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -143.72 113.12 6.92 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.249 -178.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 55.39 -126.28 38.8 Favored Glycine 0 C--O 1.24 0.502 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.294 178.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.2 p -84.55 15.2 3.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.527 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.4 t -119.29 148.77 22.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.309 0.576 . . . . 0.0 112.216 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 t -139.31 140.07 37.48 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 100.598 -3.853 . . . . 0.0 100.598 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.8 t -136.29 133.94 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -101.07 111.68 63.82 Favored Pre-proline 0 C--O 1.244 0.781 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 174.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -78.2 153.37 28.09 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 117.058 -1.495 . . . . 0.0 111.376 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.61 151.63 34.1 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.61 137.56 16.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.1 t -116.87 107.9 23.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 177.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.21 141.17 28.86 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.65 -19.9 61.04 Favored Glycine 0 C--O 1.228 -0.28 0 N-CA-C 114.435 0.534 . . . . 0.0 114.435 -177.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 38.8 p -62.69 -29.47 70.67 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.631 0.975 . . . . 0.0 113.631 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.8 ptm -144.42 40.55 1.33 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.05 -43.63 30.57 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -173.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -43.8 97.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 119.069 0.849 . . . . 0.0 111.844 -176.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -73.68 -39.13 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.911 0.386 . . . . 0.0 111.232 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.47 -39.76 92.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.492 0.663 . . . . 0.0 110.445 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -63.71 -49.41 73.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.019 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -70.49 -15.45 62.8 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.881 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.61 64.61 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 31.7 t -91.86 -44.64 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 121.458 0.647 . . . . 0.0 110.689 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -124.97 77.98 66.21 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.123 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.2 -6.64 19.3 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 118.611 -0.459 . . . . 0.0 112.476 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 49.2 p -88.11 -5.72 58.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.677 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -79.2 124.15 28.08 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.649 -179.455 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 . . . . . 0 C--O 1.22 -0.5 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.84 95.29 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.731 0.241 . . . . 0.0 110.629 178.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -64.25 -44.82 90.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.7 mtm -62.76 -29.97 71.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.862 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.3 83.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 177.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -64.8 -45.72 85.08 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.623 0.249 . . . . 0.0 110.426 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -60.03 -44.32 94.7 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.317 0.579 . . . . 0.0 110.556 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -69.78 -28.53 65.82 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.083 -0.385 . . . . 0.0 111.071 178.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -66.45 -37.48 85.24 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.13 -34.68 78.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.83 0.347 . . . . 0.0 110.127 178.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 m -74.23 -38.02 63.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.678 0.751 . . . . 0.0 110.551 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.65 -39.92 88.46 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.6 p -60.61 -34.84 60.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 CA-C-N 118.934 0.788 . . . . 0.0 110.278 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? . . . . . 0 C--N 1.328 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 108.914 176.329 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.859 0.361 . . . . 50.0 110.979 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.4 mt -61.38 -35.91 78.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 50.0 110.884 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -51.96 -39.9 60.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 50.0 110.799 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -52.08 -39.54 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.137 -0.483 . . . . 50.0 110.87 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.44 -54.31 12.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.092 -0.503 . . . . 25.0 111.118 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -51.9 -43.98 63.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 50.0 110.914 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -71.98 -34.65 69.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.111 -0.495 . . . . 50.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -55.34 28.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.908 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.1 mm -59.72 -37.4 70.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.251 -0.431 . . . . 50.0 111.093 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.26 -53.74 32.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 25.0 111.107 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.01 -35.63 75.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 25.0 111.089 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -61.27 -54.97 37.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.865 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.07 -55.31 34.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.232 -0.44 . . . . 50.0 110.932 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.1 t -53.27 -51.88 36.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 50.0 111.117 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -58.47 -33.72 70.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 50.0 110.923 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.69 -16.57 64.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.821 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 117.95 -24.91 8.65 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 25.0 112.445 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -51.2 103.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 25.0 110.833 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.34 149.79 34.94 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.705 -0.76 . . . . 25.0 112.516 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.29 106.71 17.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.814 0.34 . . . . 50.0 111.099 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.9 mt -69.53 -35.69 67.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 25.0 111.137 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -161.03 118.98 2.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 25.0 111.086 179.983 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.718 0.294 . . . . 50.0 110.801 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.13 128.83 18.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 50.0 110.871 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 78.1 mt -141.49 131.93 26.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.101 -0.5 . . . . 25.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.7 m95 -101.33 149.66 23.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 50.0 110.864 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 mt -140.74 116.74 10.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 50.0 110.913 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 146.35 42.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 50.0 110.894 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.401 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . . . -103.42 104.11 39.49 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.677 0.751 . . . . 25.0 111.085 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 35' ' ' ALA . 54.0 Cg_endo -69.84 -32.22 18.65 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.636 2.224 . . . . 50.0 112.279 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -57.57 -27.02 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.306 -0.407 . . . . 50.0 110.858 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.9 mttt 66.07 44.65 2.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.907 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 p -83.91 -176.71 6.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.43 . . . . 25.0 110.806 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.42 -35.0 17.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 50.0 110.851 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.55 132.13 35.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 50.0 110.934 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.36 -65.26 0.95 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 50.0 110.937 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.8 mt -138.37 166.66 23.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 50.0 110.949 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.37 129.23 73.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 50.0 111.093 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -115.95 146.67 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 25.0 110.859 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.3 tp -123.83 110.33 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 50.0 110.974 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -116.72 140.61 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.287 -0.415 . . . . 25.0 110.966 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -125.65 101.52 6.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.52 . . . . 50.0 110.889 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -144.08 148.76 35.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 50.0 110.898 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -78.82 146.05 33.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 25.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.0 129.62 36.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.194 -0.457 . . . . 50.0 110.927 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.63 -52.2 2.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.108 -0.496 . . . . 50.0 110.804 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -99.83 168.41 9.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 25.0 110.956 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -34.48 36.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 50.0 110.828 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -54.68 -34.92 62.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 50.0 110.957 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -65.78 -33.38 75.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 50.0 110.84 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.5 tpp -58.15 -52.91 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 50.0 110.839 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 24.8 m -68.86 -33.04 57.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.234 -0.439 . . . . 50.0 111.12 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -26.22 68.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 50.0 110.805 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -77.26 -29.98 54.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 50.0 110.884 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 8.1 mm -73.62 -43.26 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 50.0 111.142 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -29.12 16.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.271 -0.422 . . . . 50.0 110.887 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.76 -35.95 57.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 50.0 110.895 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -58.4 -51.43 69.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.468 . . . . 50.0 110.916 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.06 -35.9 48.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.154 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -61.74 -43.43 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.446 . . . . 50.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -35.52 58.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.277 -0.42 . . . . 25.0 110.866 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 81.1 t -52.79 -36.6 23.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 50.0 111.189 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -61.19 -36.1 78.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 50.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -48.41 81.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 50.0 110.898 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.82 -41.49 46.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 25.0 111.188 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.83 -36.31 47.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 50.0 110.846 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -72.32 -35.94 68.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.825 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -47.28 53.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.43 . . . . 50.0 110.887 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mp -70.88 -19.61 62.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 50.0 110.956 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.74 33.37 87.07 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.845 -0.693 . . . . 25.0 112.497 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -103.63 176.17 5.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 50.0 110.847 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.29 -52.96 5.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.935 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -127.03 144.77 50.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.116 -0.493 . . . . 50.0 110.805 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.83 111.57 19.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 50.0 110.854 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -82.08 119.18 23.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 50.0 110.914 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.7 tt -130.7 135.18 47.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.45 . . . . 50.0 110.904 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.4 tp -99.43 107.44 19.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 50.0 110.896 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -105.36 108.89 20.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 25.0 110.87 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.8 t -106.41 146.43 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 50.0 111.174 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -108.16 137.59 45.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 50.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -114.12 103.66 11.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 50.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 p -131.06 169.25 16.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 50.0 110.862 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.8 t -67.09 -35.29 79.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 25.0 111.126 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -162.78 176.03 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.434 . . . . 50.0 110.853 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.68 161.34 79.24 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.533 0.683 . . . . 25.0 111.099 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.92 176.86 6.32 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.651 2.234 . . . . 50.0 112.324 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 10.6 m -51.46 -47.36 35.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 50.0 111.109 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 171.92 -172.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 50.0 110.868 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 57.48 38.79 28.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.2 p-90 -120.57 -32.2 4.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 50.0 110.907 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -51.83 -35.28 43.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.254 -0.43 . . . . 50.0 110.861 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.87 -40.24 96.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 50.0 110.858 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 2.4 mp -65.02 -47.77 86.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 50.0 111.181 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -50.9 -30.35 14.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 25.0 111.087 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.55 -38.19 12.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 50.0 110.944 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.28 139.88 58.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 50.0 110.921 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.9 m -101.89 143.66 31.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.44 . . . . 25.0 111.183 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -97.14 104.28 16.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.242 -0.436 . . . . 50.0 110.858 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -112.92 100.97 9.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 50.0 110.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -101.74 86.81 3.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 50.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.43 -112.43 4.97 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.726 -0.749 . . . . 25.0 112.458 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.0 30.01 2.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.355 . . . . 25.0 111.252 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 18.3 t -119.39 151.82 21.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 50.0 111.043 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 36.2 p -137.05 112.55 9.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.044 -0.526 . . . . 50.0 110.794 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -142.81 139.1 28.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.041 -0.527 . . . . 50.0 111.101 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -116.32 136.0 22.97 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.691 0.758 . . . . 50.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 149.16 66.24 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.669 2.246 . . . . 50.0 112.317 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.72 136.56 16.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.279 -0.418 . . . . 25.0 111.119 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.1 tt -138.83 144.21 30.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.159 -0.473 . . . . 50.0 111.093 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.8 t -124.57 124.91 69.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 50.0 111.196 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.65 140.06 51.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 50.0 110.834 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -75.04 -33.12 55.52 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.706 -0.759 . . . . 25.0 112.489 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.1 t -84.63 -34.05 23.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 25.0 111.149 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.08 33.04 4.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 50.0 110.835 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.68 -36.2 56.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.416 . . . . 50.0 110.94 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -58.55 -37.46 75.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.855 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.03 -35.82 64.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 50.0 110.927 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -72.61 -38.13 67.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 50.0 110.857 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.22 -42.79 63.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 50.0 110.925 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -79.83 -34.97 38.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 50.0 110.886 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.12 -33.81 76.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 25.0 111.112 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.55 -60.13 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 50.0 111.108 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -113.09 76.18 2.3 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.762 0.792 . . . . 50.0 110.944 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -30.71 22.04 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.727 2.285 . . . . 50.0 112.311 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 t -69.6 -16.32 63.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.265 -0.425 . . . . 25.0 110.863 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -70.45 139.69 51.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.067 -0.515 . . . . 50.0 110.828 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 50.0 110.934 -179.954 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.786 0.327 . . . . 50.0 110.861 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.57 -49.72 75.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 25.0 111.064 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -36.63 66.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 50.0 110.878 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.0 mtt -68.93 -41.44 78.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 50.0 110.932 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.64 -38.62 72.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 25.0 111.088 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -63.72 -53.68 47.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 50.0 110.871 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.08 -43.74 64.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.275 -0.42 . . . . 25.0 110.839 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -66.54 -38.96 88.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 50.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.32 -46.47 88.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.51 -36.32 55.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 50.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.93 -36.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 50.0 110.878 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.73 -54.6 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 50.0 110.925 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.0 -35.95 23.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 50.0 111.13 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 50.0 110.999 179.961 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.9 tt . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.12 -35.06 79.03 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.335 0.588 . . . . 0.0 110.887 177.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -59.62 -27.17 66.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.107 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.49 -48.98 78.63 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.6 m -67.44 -38.76 85.02 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.968 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -55.17 -53.43 56.01 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -65.95 -30.87 71.51 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.953 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.68 -33.38 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.088 -0.382 . . . . 0.0 111.85 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.4 mm -68.04 -43.66 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.36 -43.61 88.48 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.32 96.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.36 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -59.03 -46.02 89.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.143 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.28 -53.2 39.59 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.29 -0.164 . . . . 0.0 111.025 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 73.1 t -53.99 -44.47 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.944 -0.473 . . . . 0.0 111.883 178.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.83 -16.28 64.02 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.462 -0.774 . . . . 0.0 112.722 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.2 m -89.79 1.24 56.38 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.423 0.289 . . . . 0.0 110.924 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.06 -1.0 28.45 Favored Glycine 0 C--O 1.228 -0.278 0 N-CA-C 115.887 1.115 . . . . 0.0 115.887 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.431 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 37.7 m-85 -68.63 118.51 11.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 117.974 0.887 . . . . 0.0 109.39 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.86 130.82 11.93 Favored Glycine 0 CA--C 1.508 -0.386 0 N-CA-C 111.051 -0.819 . . . . 0.0 111.051 -177.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.6 t -75.47 130.31 36.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.14 0.495 . . . . 0.0 110.164 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.9 mt -102.46 -44.54 10.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 175.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -150.62 138.63 20.08 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.371 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 -177.278 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 . . . . . 0 C--O 1.225 -0.219 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -131.48 138.61 49.06 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -171.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.9 mt -138.96 137.26 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -120.79 133.55 55.32 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.151 0.58 . . . . 0.0 109.967 177.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mp -131.07 137.28 49.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.908 0.883 . . . . 0.0 110.272 -178.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -86.17 137.04 32.95 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.78 118.25 70.9 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 84.8 Cg_endo -76.26 -25.45 9.95 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 117.192 -1.405 . . . . 0.0 112.035 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -72.94 -30.52 63.93 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.393 1.077 . . . . 0.0 112.012 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.2 mttp 55.99 39.24 30.54 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.722 1.249 . . . . 0.0 111.554 177.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.2 t -77.66 -172.99 2.81 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 104.48 -2.415 . . . . 0.0 104.48 170.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -41.4 -1.78 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.071 1 N-CA-C 121.945 4.054 . . . . 0.0 121.945 -178.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -132.95 125.37 29.66 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -74.58 -33.63 62.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.589 0.709 . . . . 0.0 109.54 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.06 161.03 37.81 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.711 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.7 t -130.79 139.06 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -123.87 136.38 54.32 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tp -113.21 124.97 53.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -136.45 135.56 38.76 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -118.5 100.09 7.23 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.063 0.459 . . . . 0.0 112.177 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.41 150.23 30.21 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -87.82 151.41 22.88 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.6 mt -138.22 120.28 15.59 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -88.14 -33.41 18.22 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.098 0.475 . . . . 0.0 110.755 -178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -129.87 149.9 51.4 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.0 ptt180 -66.93 -22.42 65.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.673 -0.642 . . . . 0.0 111.147 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -32.69 73.77 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -74.37 -39.5 62.7 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 46.3 ttm -58.54 -48.59 80.38 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.279 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 20.8 m -63.2 -31.9 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 122.037 -0.414 . . . . 0.0 111.59 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -70.07 -34.13 72.8 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.834 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.22 -42.56 91.3 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 175.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -66.17 -31.28 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -63.82 -39.54 94.47 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -76.64 -41.98 43.85 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -57.48 -36.58 71.67 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 113.034 0.754 . . . . 0.0 113.034 178.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.89 -37.28 84.0 Favored 'General case' 0 C--O 1.208 -1.124 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -37.28 77.39 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.815 0.341 . . . . 0.0 110.471 177.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -61.16 -47.69 85.04 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 75.4 t -65.12 -40.72 89.78 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.408 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.31 -40.83 83.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -65.23 -44.74 87.25 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.733 -0.605 . . . . 0.0 110.884 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.7 t -67.01 -36.97 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-O 121.231 0.538 . . . . 0.0 110.176 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.07 -44.52 94.68 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.812 -0.555 . . . . 0.0 110.749 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -65.59 -41.08 93.22 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.2 -40.0 92.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.2 mp -94.57 -0.07 54.83 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.07 15.38 65.07 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 116.241 1.256 . . . . 0.0 116.241 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.8 mtt-85 -72.47 142.86 48.59 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.25 -32.99 67.17 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.35 -0.843 . . . . 0.0 112.979 -177.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.45 160.82 43.12 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 102.31 -3.218 . . . . 0.0 102.31 178.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.6 mtp -141.86 148.23 38.44 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.858 1.208 . . . . 0.0 113.004 178.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -117.6 141.27 48.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 174.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.2 tp -128.26 135.44 49.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 68.0 tp -94.14 119.5 33.06 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 170.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -115.04 108.73 17.06 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -177.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.4 t -107.68 118.44 55.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -176.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -88.01 146.21 25.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.226 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -121.47 116.86 25.5 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 172.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 78.2 p -136.45 160.32 39.11 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.226 0.329 . . . . 0.0 110.722 -174.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.2 t -76.87 -29.24 55.73 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.583 -0.698 . . . . 0.0 111.381 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -150.7 164.08 37.01 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 106.26 -1.755 . . . . 0.0 106.26 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.88 152.78 41.87 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -177.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -59.4 149.21 82.83 Favored 'Trans proline' 0 C--N 1.349 0.579 0 O-C-N 122.367 0.667 . . . . 0.0 113.42 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.8 m -77.79 -16.14 14.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 117.317 2.34 . . . . 0.0 117.317 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -120.73 100.26 7.01 Favored 'General case' 0 C--O 1.21 -0.991 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -175.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 44.6 31.46 0.63 Allowed 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 117.29 2.33 . . . . 0.0 117.29 172.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.7 p-90 -61.94 -22.23 65.44 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.461 -0.775 . . . . 0.0 112.642 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.88 -31.28 69.65 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.04 -0.413 . . . . 0.0 111.664 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -58.75 -39.85 82.14 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.768 -0.826 . . . . 0.0 108.768 177.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.8 mm -63.89 -39.35 85.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.04 -177.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.28 -10.33 57.33 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -112.0 3.81 17.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -109.88 105.85 15.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.852 -175.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.0 m -68.36 122.42 18.35 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 174.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -84.05 122.55 28.94 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -123.01 132.87 54.32 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.783 0.802 . . . . 0.0 109.643 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -147.61 125.48 11.97 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.23 -119.42 13.0 Favored Glycine 0 C--O 1.227 -0.343 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -176.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -119.23 19.34 12.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.167 0.984 . . . . 0.0 108.576 175.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 84.6 t -97.14 138.45 22.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.618 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -126.12 139.98 52.94 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 172.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.2 t -132.72 136.76 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.262 0 CA-C-O 121.813 0.816 . . . . 0.0 110.347 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.2 103.37 47.9 Favored Pre-proline 0 N--CA 1.433 -1.279 0 CA-C-N 113.422 -1.717 . . . . 0.0 109.347 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.18 152.61 27.62 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 115.636 -2.443 . . . . 0.0 112.483 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.69 154.69 38.96 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.63 -2.73 . . . . 0.0 103.63 175.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -150.76 135.89 10.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.5 m -111.99 138.03 42.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 172.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.44 142.57 47.43 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.76 -27.68 59.36 Favored Glycine 0 C--O 1.227 -0.283 0 CA-C-N 115.956 -0.565 . . . . 0.0 114.169 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.8 p -55.45 -30.03 59.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.84 26.27 2.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.352 0.596 . . . . 0.0 110.527 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 27.6 tp -43.51 -44.04 5.79 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -170.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -60.91 -43.27 98.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 119.118 0.872 . . . . 0.0 112.068 -177.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -74.95 -38.7 61.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 122.282 1.039 . . . . 0.0 110.564 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.82 -38.97 92.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.035 0.921 . . . . 0.0 111.686 -177.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.78 -50.04 73.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.102 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -72.06 -15.7 62.02 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.404 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.21 -34.67 63.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 56.2 t -91.18 -41.51 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.113 0.482 . . . . 0.0 109.979 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -124.24 76.33 60.65 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 122.882 0.473 . . . . 0.0 111.532 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.13 -11.64 32.15 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 117.726 -1.049 . . . . 0.0 112.181 177.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 24.7 p -76.27 -8.74 57.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.556 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -93.21 131.41 38.33 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.195 0.521 . . . . 0.0 109.598 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 . . . . . 0 C--N 1.323 -0.557 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.673 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 . . . . . 0 C--O 1.217 -0.625 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.89 -36.79 70.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 177.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.83 -41.27 95.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.467 0.651 . . . . 0.0 109.382 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 45.9 mtt -68.36 -35.44 77.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.517 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.2 -30.73 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.315 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.97 -48.27 74.62 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.01 -40.58 91.23 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.568 0.699 . . . . 0.0 110.007 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -60.26 -38.92 84.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.394 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -68.18 -45.42 73.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.706 -0.224 . . . . 0.0 110.905 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.19 -39.02 91.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.307 0.575 . . . . 0.0 110.028 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 42.0 m -66.32 -34.59 78.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.04 0.448 . . . . 0.0 110.577 177.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.3 tt -67.33 -39.9 85.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.762 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 66.9 t -58.49 -50.02 80.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.0 tm? . . . . . 0 C--N 1.325 -0.469 0 C-N-CA 120.142 -0.623 . . . . 0.0 110.968 -178.708 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.3 tt . . . . . 0 N--CA 1.467 0.385 0 CA-C-O 121.114 0.483 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 69.7 mt -64.1 -42.71 96.8 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.402 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -67.17 -38.48 85.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.667 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -60.9 -50.7 72.37 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.6 m -59.77 -40.1 87.11 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 121.075 0.464 . . . . 0.0 111.008 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -59.7 -45.13 93.07 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -75.6 -34.23 60.6 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.791 1.281 . . . . 0.0 108.776 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tptt -64.63 -39.65 94.09 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.834 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.5 mm -72.1 -40.47 66.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 -42.31 84.24 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.26 98.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -62.07 -46.91 87.04 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.352 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -63.48 -48.04 79.29 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.051 -0.406 . . . . 0.0 110.718 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.6 -37.19 79.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.014 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -74.2 -10.5 59.67 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.077 -1.014 . . . . 0.0 111.765 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.0 m -94.77 12.69 27.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.0 2.63 66.33 Favored Glycine 0 CA--C 1.517 0.204 0 N-CA-C 116.496 1.359 . . . . 0.0 116.496 175.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -70.36 115.09 9.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 118.444 1.122 . . . . 0.0 109.237 178.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.34 133.86 20.44 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.0 t -78.6 118.69 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 40.6 mt -90.27 -44.92 14.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 177.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -149.65 124.65 9.99 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.451 -177.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.685 0 N-CA-C 104.689 -2.337 . . . . 0.0 104.689 173.097 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 . . . . . 0 N--CA 1.456 -0.173 0 N-CA-C 115.667 1.728 . . . . 0.0 115.667 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -136.93 147.09 46.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 116.511 2.041 . . . . 0.0 116.511 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.1 mt -136.36 130.05 47.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 174.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.9 m95 -103.23 127.25 50.6 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 177.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -123.02 142.37 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.039 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -92.26 133.84 35.45 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 175.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.22 114.0 29.07 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.22 -29.13 14.65 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 116.667 -1.756 . . . . 0.0 113.245 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -74.15 -11.76 60.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.006 0.523 . . . . 0.0 111.279 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 mttm 59.4 41.6 19.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 123.355 1.55 . . . . 0.0 107.896 -178.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -177.57 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 110.898 -2.864 . . . . 0.0 117.952 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 p -50.4 -26.78 5.35 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.537 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -117.12 139.09 51.16 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -81.98 -35.04 29.4 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.4 mt -133.62 158.84 42.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.831 -177.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.58 134.38 66.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -116.39 102.86 9.9 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.18 129.17 34.3 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.167 -2.16 . . . . 0.0 105.167 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -136.37 138.32 41.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -105.22 95.22 5.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.73 122.78 7.63 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.203 0.525 . . . . 0.0 111.065 -178.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -91.54 134.56 34.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -124.36 126.61 46.27 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -171.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -72.9 -41.18 64.9 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -129.18 152.07 49.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -63.41 -19.72 64.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -73.22 -33.01 65.1 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 121.982 -0.449 . . . . 0.0 109.938 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -67.25 -28.41 68.02 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.755 -0.591 . . . . 0.0 109.484 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 77.4 mtp -63.86 -51.73 63.26 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 9.1 m -65.8 -31.79 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.541 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -61.46 -43.91 98.03 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.543 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -64.52 -46.61 82.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.278 0.561 . . . . 0.0 110.187 -178.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mp -68.22 -33.25 59.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 121.272 -0.892 . . . . 0.0 110.618 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.188 -0.945 . . . . 0.0 110.08 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -76.56 -43.64 38.16 Favored 'General case' 0 C--O 1.243 0.729 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -56.93 -40.08 75.68 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.628 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -35.88 75.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.045 0.384 . . . . 0.0 111.276 -178.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -72.46 -40.05 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.502 0.667 . . . . 0.0 109.308 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.4 -38.57 84.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 89.3 t -70.43 -38.4 73.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 CA-C-O 118.628 -0.701 . . . . 0.0 110.802 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.84 -34.32 77.1 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.414 1.461 . . . . 0.0 110.123 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttt-85 -62.56 -44.8 95.43 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.611 -0.436 . . . . 0.0 109.926 175.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 84.4 t -66.62 -41.39 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.19 -42.87 77.82 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 123.271 0.628 . . . . 0.0 109.411 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -67.7 -40.9 84.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.623 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -58.53 -41.51 85.68 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -100.44 6.65 44.43 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.11 12.38 60.3 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 117.213 1.645 . . . . 0.0 117.213 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.8 ttt85 -62.07 145.1 54.18 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.854 0.827 . . . . 0.0 109.825 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -68.2 -34.91 77.14 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 122.039 -0.413 . . . . 0.0 110.755 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -149.05 160.66 43.13 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.0 mmm -127.92 136.08 50.86 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.48 138.06 50.66 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 tt -138.55 140.98 39.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 118.356 0.525 . . . . 0.0 112.251 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -104.44 118.43 36.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 173.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -107.99 127.38 53.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.3 t -121.79 111.91 32.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 121.363 -0.135 . . . . 0.0 111.171 -178.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -81.59 147.57 29.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -120.76 115.95 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 171.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 t -131.25 160.5 34.72 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.568 0.543 . . . . 0.0 111.128 -173.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.1 m -67.1 -46.75 73.25 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -149.29 170.87 17.51 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.45 152.95 70.87 Favored Pre-proline 0 C--N 1.314 -0.971 0 CA-C-N 115.385 -0.825 . . . . 0.0 108.92 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.75 151.42 47.92 Favored 'Trans proline' 0 C--N 1.35 0.618 0 O-C-N 122.358 0.662 . . . . 0.0 112.008 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -61.18 -20.03 21.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 117.761 2.504 . . . . 0.0 117.761 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -155.51 145.63 21.66 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.6 t0 39.9 30.15 0.06 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 174.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -73.47 -22.4 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.339 -0.85 . . . . 0.0 110.705 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -64.85 -32.02 73.53 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.922 -0.486 . . . . 0.0 111.525 -176.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -64.18 -25.11 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.713 -0.395 . . . . 0.0 109.996 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.6 mm -73.96 -43.43 52.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -178.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.83 -16.95 63.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.665 0.745 . . . . 0.0 110.105 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -95.1 4.03 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.61 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -126.64 118.76 25.46 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.7 m -68.28 126.83 30.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 173.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -85.72 111.77 20.43 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -110.67 125.23 53.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.933 0.397 . . . . 0.0 110.951 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.4 ttpp -138.58 101.9 4.46 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.01 -112.72 5.08 Favored Glycine 0 C--N 1.322 -0.231 0 C-N-CA 120.164 -1.017 . . . . 0.0 111.806 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.9 p -89.66 9.15 28.06 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 44.7 t -115.46 143.48 25.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.6 m -127.76 118.18 23.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 171.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.5 t -120.49 130.88 73.97 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.304 0 CA-C-O 121.624 0.726 . . . . 0.0 111.21 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.49 110.9 61.66 Favored Pre-proline 0 N--CA 1.433 -1.322 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.587 177.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -80.14 150.56 20.37 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.169 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.92 154.14 37.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 176.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.0 tt -147.4 125.8 3.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -177.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.7 t -102.37 120.96 52.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.05 136.24 47.24 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.67 -22.53 53.32 Favored Glycine 0 C--O 1.228 -0.257 0 N-CA-C 114.694 0.637 . . . . 0.0 114.694 -177.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 54.3 p -59.47 -32.08 69.91 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.1 ptm -139.89 29.5 2.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 122.051 0.929 . . . . 0.0 108.845 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 tt -46.1 -41.25 12.06 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -172.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -62.35 -45.0 95.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.006 0.821 . . . . 0.0 111.126 -176.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -74.44 -39.75 62.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.783 0.801 . . . . 0.0 111.287 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -66.58 -37.84 85.78 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.007 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 14.4 tp -62.1 -36.37 81.51 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.928 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.33 -15.93 61.88 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.71 -31.37 59.63 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.01 -40.28 10.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.258 -179.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -125.83 77.05 70.63 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.441 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -67.49 -19.82 48.42 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.427 0.895 . . . . 0.0 114.427 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.2 m -80.06 -9.46 59.7 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -64.82 140.01 58.82 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.286 0.565 . . . . 0.0 111.346 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? . . . . . 0 CA--C 1.511 -0.543 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.576 179.842 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 . . . . . 0 C--O 1.215 -0.729 0 N-CA-C 111.46 0.17 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.66 96.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.435 0.636 . . . . 0.0 110.054 177.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -68.92 -39.56 79.58 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 90.5 mtp -65.82 -36.7 84.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.98 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.95 78.78 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.263 . . . . 0.0 110.524 178.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -65.44 -44.85 85.99 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 177.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.02 -44.23 96.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.521 0.677 . . . . 0.0 109.73 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 -61.11 -41.12 96.11 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.645 179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.32 -41.38 98.51 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.66 -38.28 90.5 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.349 -0.844 . . . . 0.0 110.142 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 59.9 p -69.94 -30.02 67.31 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.854 175.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.49 -43.97 92.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.357 0.663 . . . . 0.0 109.898 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 76.7 t -57.95 -46.54 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.659 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 C--N 1.323 -0.552 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.107 179.747 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 N--CA 1.469 0.524 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -61.75 -30.56 70.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -62.84 -35.46 80.02 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.1 m -61.93 -42.78 99.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.53 0.681 . . . . 0.0 111.845 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -59.92 -51.03 71.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.511 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -69.75 -27.34 64.87 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 121.867 -0.521 . . . . 0.0 111.357 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -66.21 -43.56 86.36 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.811 -0.555 . . . . 0.0 110.886 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.7 mm -70.62 -37.5 69.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.0 -45.35 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.49 -44.52 90.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.377 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -57.58 -46.74 83.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.37 -178.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.12 -50.91 59.79 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -66.0 -31.04 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.54 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -68.16 -14.34 62.9 Favored 'General case' 0 C--O 1.221 -0.425 0 O-C-N 121.855 -0.528 . . . . 0.0 110.719 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.7 m -95.91 8.9 42.35 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 122.767 0.427 . . . . 0.0 109.998 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.64 -2.88 58.94 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 115.435 0.934 . . . . 0.0 115.435 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -65.44 115.23 5.47 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 109.905 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.3 138.57 27.96 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.374 -176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.2 t -83.11 107.35 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.0 mt -71.91 -47.23 56.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.92 130.56 10.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.232 178.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.587 0 N-CA-C 101.146 -3.65 . . . . 0.0 101.146 170.305 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 . . . . . 0 C--O 1.23 0.051 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -142.32 149.72 39.84 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.1 mt -141.25 133.1 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -103.5 130.02 50.8 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -124.39 141.18 52.28 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -99.29 145.79 26.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.47 105.65 17.02 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.02 -16.47 32.28 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 118.012 -0.858 . . . . 0.0 111.49 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -61.62 -28.7 69.56 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.017 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 58.79 37.79 24.87 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.2 p -76.75 -176.28 3.78 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 112.495 -2.139 . . . . 0.0 109.593 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 p -54.87 -8.91 0.29 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -132.9 136.12 45.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -80.27 -35.94 35.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.305 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 40.4 mt -138.6 163.34 32.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.116 -177.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.2 p -138.63 139.41 41.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -119.34 132.87 55.94 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mp -106.24 122.46 46.27 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 177.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.53 121.28 18.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 118.118 0.417 . . . . 0.0 110.659 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -100.8 114.93 29.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.677 0.751 . . . . 0.0 109.188 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -151.64 150.37 30.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.456 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.0 147.72 44.87 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 174.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 73.6 mt -139.83 107.64 5.66 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -83.0 -40.55 19.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.64 0.734 . . . . 0.0 110.892 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -132.44 156.72 46.22 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.927 -0.578 . . . . 0.0 112.145 -178.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 95' ' ' ASP . 15.9 ptt180 -64.97 -15.33 62.1 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.098 0.475 . . . . 0.0 111.093 175.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -63.35 -37.44 87.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -75.46 -30.86 60.08 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.952 0.406 . . . . 0.0 110.057 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 97.1 mtp -63.58 -47.35 81.87 Favored 'General case' 0 C--O 1.211 -0.972 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.92 -30.74 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.682 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 mtm-85 -61.49 -43.41 98.91 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -59.13 -42.18 89.99 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.17 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -64.51 -30.79 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -61.03 -40.18 92.62 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 177.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -72.96 -37.22 67.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.207 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 68.2 mm-40 -56.2 -50.54 70.95 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.25 -36.57 82.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 122.161 -0.337 . . . . 0.0 111.841 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.47 -43.49 97.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.991 0.424 . . . . 0.0 109.871 178.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -67.33 -42.42 83.61 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.94 -37.55 79.59 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.168 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -58.42 -41.0 84.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.008 0.822 . . . . 0.0 110.137 178.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 87.4 mtt-85 -63.87 -41.66 97.7 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.3 t -69.81 -43.42 79.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.118 0.485 . . . . 0.0 110.167 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -57.53 -41.14 80.29 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -65.85 -37.67 86.81 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.357 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -68.94 -40.26 79.09 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.076 0.465 . . . . 0.0 110.463 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 mp -75.42 -13.21 60.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.136 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.69 6.41 55.19 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 114.084 0.394 . . . . 0.0 114.084 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -73.57 140.78 46.51 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.801 . . . . 0.0 110.352 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -66.45 -38.03 86.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.634 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -131.16 161.3 32.46 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mtp -144.87 148.63 34.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 118.708 0.685 . . . . 0.0 109.824 174.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -121.47 143.49 49.22 Favored 'General case' 0 CA--C 1.514 -0.41 0 O-C-N 123.594 0.559 . . . . 0.0 110.97 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -139.76 125.66 19.64 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.0 tp -93.53 121.75 35.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -111.98 112.61 24.38 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.126 -0.359 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.3 t -105.98 110.94 33.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-O 121.201 0.524 . . . . 0.0 111.834 -176.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -80.1 136.64 36.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -114.18 112.31 22.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 173.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.6 m -132.13 158.23 42.2 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.846 0.355 . . . . 0.0 111.108 -175.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.5 t -74.86 -28.93 60.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.826 -0.546 . . . . 0.0 110.393 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -154.99 166.12 34.6 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 -178.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.4 155.09 54.33 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.15 154.34 73.98 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 117.328 -1.315 . . . . 0.0 111.994 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.57 -12.54 13.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 120.402 3.482 . . . . 0.0 120.402 -168.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -151.54 140.45 21.0 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -175.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 54' ' ' ARG . 7.3 m-20 42.69 15.3 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 120.153 3.39 . . . . 0.0 120.153 173.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 25.3 p-90 -63.68 -21.41 66.37 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 120.837 -1.164 . . . . 0.0 113.598 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.66 -29.46 70.65 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -62.39 -33.5 74.88 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.616 0.722 . . . . 0.0 109.615 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 mm -69.19 -40.49 80.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.825 -174.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.73 -15.19 63.1 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.866 0.365 . . . . 0.0 111.793 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -102.2 3.27 38.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -177.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -117.42 130.32 56.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.483 0.659 . . . . 0.0 112.155 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -80.71 125.27 29.83 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 173.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -84.02 126.08 32.7 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -123.85 135.61 53.86 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.84 0.829 . . . . 0.0 110.502 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -135.49 91.73 2.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.75 -109.54 2.85 Favored Glycine 0 C--O 1.22 -0.76 0 N-CA-C 107.336 -2.305 . . . . 0.0 107.336 -177.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.0 p -110.85 7.26 21.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.777 0.323 . . . . 0.0 111.558 178.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -87.68 139.36 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 175.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.7 m -126.86 136.99 53.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.9 t -132.09 135.35 58.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -111.14 115.83 52.14 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -79.69 151.08 21.87 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 117.373 -1.284 . . . . 0.0 112.331 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.15 152.72 42.1 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 175.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.7 tt -146.81 131.31 10.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.2 m -113.68 128.45 70.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 103.598 -2.742 . . . . 0.0 103.598 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.33 136.32 54.88 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -47.16 -39.9 13.27 Favored Glycine 0 C--O 1.226 -0.382 0 N-CA-C 117.173 1.629 . . . . 0.0 117.173 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.58 -29.31 58.81 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -142.46 32.7 1.48 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.099 1.428 . . . . 0.0 108.934 -178.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 tp -52.04 -36.4 50.18 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -60.17 -49.86 75.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.562 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.68 -32.98 64.23 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.735 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -63.45 -45.33 91.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.829 0.347 . . . . 0.0 110.719 177.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.68 -44.08 96.94 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -75.37 -14.08 60.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.819 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.52 -41.82 37.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.945 0.402 . . . . 0.0 110.03 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.2 p -88.91 -33.98 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.244 0.545 . . . . 0.0 110.577 -179.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -126.78 75.62 75.38 Favored Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 122.0 -0.438 . . . . 0.0 110.233 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -67.29 -10.75 29.71 Favored 'Trans proline' 0 C--N 1.349 0.593 0 CA-C-O 121.415 0.506 . . . . 0.0 113.006 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.4 p -80.26 -9.97 59.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.459 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.84 135.64 33.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.424 0.63 . . . . 0.0 110.5 -178.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 85.9 mtt-85 . . . . . 0 CA--C 1.507 -0.696 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -179.882 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 . . . . . 0 C--O 1.221 -0.411 0 CA-C-O 121.52 0.676 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.1 -39.98 76.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.839 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -78.7 -31.12 46.38 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.969 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 94.0 mmm -63.26 -34.48 77.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.319 176.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -67.86 -44.61 76.73 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.5 -40.88 96.47 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.669 0.747 . . . . 0.0 109.34 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -61.57 -42.26 98.59 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.647 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.42 -42.31 98.73 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 177.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 47.7 mt -64.27 -31.8 73.15 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.235 -0.291 . . . . 0.0 110.334 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.4 m -76.18 -36.36 58.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.771 0.796 . . . . 0.0 110.543 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.36 -34.72 77.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.813 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 2.1 p -52.97 -28.09 13.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.479 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.218 -0.59 0 O-C-N 121.066 -1.021 . . . . 0.0 109.26 178.663 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.0 mt . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.66 -35.32 80.46 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -63.02 -31.76 72.97 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.021 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -63.02 -51.64 65.98 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -64.64 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.294 0.568 . . . . 0.0 111.271 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -56.58 -50.77 70.97 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.264 0.626 . . . . 0.0 111.04 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.385 -0.822 . . . . 0.0 111.71 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -66.3 -42.88 87.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.073 -0.392 . . . . 0.0 110.064 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.8 mm -69.2 -39.54 79.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.35 -44.21 79.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.53 99.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.093 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -46.47 90.41 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.913 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.2 mt -65.01 -46.24 82.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.156 0.503 . . . . 0.0 110.889 -179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.8 -38.34 82.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.702 -178.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -78.93 -3.5 45.18 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.242 -0.911 . . . . 0.0 112.374 178.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.9 t -96.46 17.44 16.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.058 0.456 . . . . 0.0 110.008 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.89 -0.77 64.87 Favored Glycine 0 CA--C 1.518 0.246 0 N-CA-C 116.257 1.263 . . . . 0.0 116.257 175.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -75.96 135.47 40.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.109 0.955 . . . . 0.0 110.043 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.77 146.48 20.64 Favored Glycine 0 CA--C 1.505 -0.589 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.1 t -90.19 121.25 40.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 117.794 0.797 . . . . 0.0 109.22 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.6 mt -87.98 -45.66 15.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -161.07 147.49 14.79 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 175.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.37 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -177.37 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 CA-C-O 121.513 0.673 . . . . 0.0 112.581 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.66 158.99 38.54 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.6 mt -131.2 131.43 63.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -110.3 129.65 55.7 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -117.1 133.8 55.55 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.859 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -85.26 124.32 31.76 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.35 120.93 83.53 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.55 -22.87 37.75 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 117.164 -1.424 . . . . 0.0 113.599 -175.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.98 -18.49 55.9 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -176.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm 59.76 29.0 18.56 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-O 121.961 0.886 . . . . 0.0 109.509 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 t -65.91 -177.56 0.49 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 113.872 -1.513 . . . . 0.0 110.243 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.1 m -45.53 -44.64 12.82 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -81.68 106.14 13.38 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 170.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -84.86 -24.74 28.42 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -138.38 156.13 47.88 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.345 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 69.9 t -136.74 144.56 32.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 104.81 -2.293 . . . . 0.0 104.81 176.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.02 149.95 46.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 119.047 0.84 . . . . 0.0 111.755 174.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -115.4 132.54 56.59 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.663 -1.977 . . . . 0.0 105.663 179.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -136.5 126.81 26.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.206 0.457 . . . . 0.0 112.135 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.15 115.13 27.03 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -150.58 125.26 9.68 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -87.35 111.4 21.04 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.6 mt -106.5 121.05 43.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -171.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -91.03 -36.03 14.29 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.578 0.704 . . . . 0.0 111.773 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -128.14 147.38 50.55 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.869 -0.52 . . . . 0.0 111.391 -177.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -65.29 -20.37 66.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -63.54 -33.33 75.35 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.05 -30.57 63.82 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 121.659 -0.651 . . . . 0.0 109.263 179.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 84.5 mtp -66.32 -51.85 53.19 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.8 m -60.94 -36.42 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.186 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -66.12 -36.82 84.16 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -62.04 -40.21 94.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.977 0.418 . . . . 0.0 110.022 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.5 mp -73.25 -34.2 43.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 121.42 -0.8 . . . . 0.0 111.058 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -58.74 -37.94 77.32 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -74.87 -43.43 54.5 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.603 0.716 . . . . 0.0 109.881 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -58.79 -39.38 80.91 Favored 'General case' 0 C--O 1.212 -0.872 0 O-C-N 121.765 -0.584 . . . . 0.0 111.409 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.83 -34.41 74.51 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 118.114 0.416 . . . . 0.0 110.505 -178.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -71.62 -42.58 67.48 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -60.15 -42.86 95.8 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.276 0.56 . . . . 0.0 109.508 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -67.46 -39.17 82.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 123.111 0.564 . . . . 0.0 110.336 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.55 -41.87 81.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.107 0.479 . . . . 0.0 110.736 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -65.12 -41.18 95.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.827 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.7 t -68.88 -39.69 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.4 ttp85 -60.09 -40.74 90.66 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.819 -0.55 . . . . 0.0 109.846 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -63.39 -41.11 98.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.906 -0.134 . . . . 0.0 110.845 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.55 -41.38 98.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.061 0.458 . . . . 0.0 110.899 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.82 -15.87 55.24 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.82 15.58 71.51 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-O 121.546 0.526 . . . . 0.0 112.227 -177.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -70.2 140.08 52.43 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 122.153 -0.616 . . . . 0.0 110.617 -175.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -64.45 -39.41 93.78 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.438 HH22 ' CD ' ' A' ' 105' ' ' GLU . 11.2 mtp180 -148.35 156.37 42.42 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 177.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.0 mmm -131.97 124.34 29.18 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.145 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -105.35 135.73 46.19 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 175.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -130.61 132.84 45.72 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.9 tp -94.74 123.51 38.24 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -120.06 114.47 22.03 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 122.159 0.184 . . . . 0.0 111.389 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.06 116.86 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.989 0.424 . . . . 0.0 111.671 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -80.92 152.81 27.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.514 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -128.09 115.87 19.11 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.508 -2.404 . . . . 0.0 104.508 171.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -136.88 151.87 49.58 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.474 0.484 . . . . 0.0 110.621 -173.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 87.7 m -67.22 -49.85 63.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 168.53 11.12 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -176.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.32 140.61 22.13 Favored Pre-proline 0 C--N 1.313 -0.991 0 N-CA-C 104.818 -2.29 . . . . 0.0 104.818 176.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.1 145.88 83.92 Favored 'Trans proline' 0 C--N 1.345 0.386 0 N-CA-C 114.706 1.002 . . . . 0.0 114.706 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.2 m -76.63 -4.24 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -175.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -120.86 100.46 7.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 119.461 -0.304 . . . . 0.0 111.513 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 22.53 50.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 32.7 p-90 -66.84 -22.84 65.98 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.488 -0.758 . . . . 0.0 112.276 -178.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -63.06 -31.25 72.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 121.914 -0.491 . . . . 0.0 110.742 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -63.78 -34.82 78.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.2 mm -63.99 -38.53 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 122.486 0.314 . . . . 0.0 110.283 -177.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.13 -25.78 68.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 111.181 -179.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -90.81 -2.33 57.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -96.0 102.34 14.12 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.957 -0.465 . . . . 0.0 111.749 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -68.4 118.76 11.88 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 103.039 -2.948 . . . . 0.0 103.039 169.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -82.93 110.77 18.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.438 ' CD ' HH22 ' A' ' 79' ' ' ARG . 5.1 mt-10 -107.81 121.12 44.08 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 122.094 0.949 . . . . 0.0 110.257 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -119.62 78.52 1.33 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.62 5.04 Favored Glycine 0 C--O 1.221 -0.694 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.448 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.7 p -76.81 -19.93 56.98 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 122.248 -0.56 . . . . 0.0 112.342 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.5 t -89.12 146.66 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.091 -0.38 . . . . 0.0 110.997 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 57.8 p -137.88 139.91 40.11 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 171.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.8 t -132.48 136.85 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.638 0 CA-C-O 122.021 0.915 . . . . 0.0 109.799 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -106.13 103.09 43.42 Favored Pre-proline 0 N--CA 1.428 -1.56 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.434 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -82.25 152.73 16.11 Favored 'Trans proline' 0 C--N 1.347 0.47 0 N-CA-C 114.129 0.78 . . . . 0.0 114.129 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.57 158.05 39.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 175.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.4 tt -149.66 128.48 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 118.369 0.531 . . . . 0.0 109.873 -178.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.3 t -100.08 116.97 44.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.82 139.96 38.82 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.54 -27.8 68.62 Favored Glycine 0 C--N 1.322 -0.2 0 CA-C-N 116.056 -0.52 . . . . 0.0 114.153 -177.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 27.0 p -54.01 -33.82 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -177.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.59 30.89 1.88 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.529 0.68 . . . . 0.0 110.107 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.9 tt -44.85 -36.96 3.54 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -175.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 18.3 ptp180 -55.61 -51.38 67.37 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.78 -38.56 38.2 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.976 0.893 . . . . 0.0 111.114 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.58 -38.09 86.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.975 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.24 -49.43 74.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 -178.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -72.72 -16.12 61.67 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.391 -177.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.05 -34.97 64.25 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 46.6 t -91.35 -42.19 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.245 0.545 . . . . 0.0 110.285 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.9 76.53 66.2 Favored Pre-proline 0 C--N 1.324 -0.512 0 C-N-CA 122.93 0.492 . . . . 0.0 111.734 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.67 -11.92 33.23 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 118.325 -0.65 . . . . 0.0 113.123 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -75.84 -12.82 60.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.905 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -90.85 131.19 36.64 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 . . . . . 0 C--N 1.324 -0.532 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.903 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 44.8 m-20 . . . . . 0 N--CA 1.463 0.212 0 CA-C-O 120.509 0.195 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -37.26 69.3 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -64.97 -43.49 92.46 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 37.3 mtt -64.09 -36.59 84.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.369 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.27 -38.28 89.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.271 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -65.47 -43.04 91.52 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.007 0.432 . . . . 0.0 109.921 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -64.43 -41.98 96.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.472 0.653 . . . . 0.0 109.772 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -42.39 99.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.714 177.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -62.74 -43.02 99.88 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 122.82 0.448 . . . . 0.0 112.15 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.35 -37.31 86.79 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.585 -0.697 . . . . 0.0 109.948 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 21.5 m -67.64 -33.39 74.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.688 0.756 . . . . 0.0 110.673 176.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.81 -38.56 73.31 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.669 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.2 t -56.14 -42.48 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--N 1.322 -0.614 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.317 -179.22 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.501 0 CA-C-O 121.988 0.899 . . . . 0.0 109.516 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -73.68 -36.51 65.31 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.946 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -39.18 84.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.059 0.39 . . . . 0.0 109.961 177.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -60.03 -53.14 61.27 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.9 m -63.05 -42.92 99.82 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.241 0.544 . . . . 0.0 111.114 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -56.91 -51.28 69.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.496 0.718 . . . . 0.0 112.14 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -71.31 -28.75 64.32 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.605 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -68.74 -36.48 78.45 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.664 -0.647 . . . . 0.0 109.511 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 22.2 mm -72.88 -36.01 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.62 85.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.02 -41.89 97.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.887 177.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -57.51 -49.87 74.91 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.549 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.24 -49.87 57.8 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.299 -178.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -39.45 82.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.722 -175.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -11.67 61.09 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.263 -0.898 . . . . 0.0 111.855 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.0 m -95.92 11.53 33.51 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 122.559 0.344 . . . . 0.0 110.32 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.25 -3.57 56.78 Favored Glycine 0 C--O 1.228 -0.26 0 N-CA-C 116.176 1.23 . . . . 0.0 116.176 175.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -66.79 126.14 28.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.065 0.932 . . . . 0.0 108.886 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.89 135.71 14.06 Favored Glycine 0 C--O 1.227 -0.318 0 N-CA-C 110.524 -1.031 . . . . 0.0 110.524 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.1 t -79.45 124.08 37.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 117.496 0.648 . . . . 0.0 109.258 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.6 mt -96.08 -45.5 13.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -148.56 141.96 25.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 117.941 0.337 . . . . 0.0 111.088 178.064 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.2 159.46 37.68 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 72.2 mt -132.59 125.89 53.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 105.46 -2.052 . . . . 0.0 105.46 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -99.14 129.63 45.41 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.86 138.27 54.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.914 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -81.59 129.78 34.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.23 118.07 68.68 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -74.37 -21.13 17.74 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 116.862 -1.625 . . . . 0.0 113.894 -175.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -77.44 -22.14 51.89 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 56.54 34.36 24.25 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 123.075 1.417 . . . . 0.0 111.092 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.5 p -74.48 -172.91 1.6 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.438 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.8 m -42.23 -28.24 0.18 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 112.675 0.621 . . . . 0.0 112.675 172.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -91.22 129.25 37.23 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 173.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -105.71 -41.46 5.44 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 31.4 mt -132.15 154.67 49.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.13 0.491 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -129.93 139.23 52.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -125.19 120.09 30.35 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.2 mt -96.02 120.54 36.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 104.035 -2.58 . . . . 0.0 104.035 175.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -135.09 127.93 31.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.937 0.789 . . . . 0.0 111.403 -175.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -103.18 105.78 16.16 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.018 0.913 . . . . 0.0 112.208 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -151.56 131.53 13.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.313 178.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -82.24 151.29 26.89 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 176.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -134.54 141.97 46.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.827 0.285 . . . . 0.0 110.432 -174.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -94.9 -45.64 7.2 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -128.4 154.62 45.82 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -178.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -64.3 -15.32 60.0 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.989 176.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -64.45 -34.93 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.26 178.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -75.81 -41.63 52.21 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -47.75 83.54 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.358 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.08 -34.73 72.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.993 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 83.5 mtt85 -71.14 -32.43 68.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -177.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.85 -42.62 89.75 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.8 mp -71.49 -37.16 63.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.975 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.07 -33.39 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 119.067 0.849 . . . . 0.0 109.688 -179.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -74.29 -44.94 50.65 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -36.21 73.86 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 121.833 -0.542 . . . . 0.0 111.308 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.28 -43.93 72.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.79 -42.68 93.9 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -63.78 -56.93 11.81 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.707 0.765 . . . . 0.0 113.044 178.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.9 p -64.14 -30.41 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.86 -173.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.17 -37.48 64.52 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -64.43 -42.82 95.81 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.837 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 17.7 t -68.28 -37.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.419 0.628 . . . . 0.0 109.734 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -42.73 98.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.703 -178.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.6 m80 -67.53 -35.96 80.1 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.648 178.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -30.49 71.42 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.78 -9.6 58.68 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 177.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.22 18.29 71.06 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -76.55 121.96 23.91 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 122.011 -0.7 . . . . 0.0 110.407 -175.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.3 mtp180 -66.53 -35.39 80.12 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -157.58 149.72 22.45 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 172.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -147.34 126.15 12.68 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.958 -173.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -88.24 117.39 27.12 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.502 1.047 . . . . 0.0 111.309 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.05 121.91 34.06 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.2 tp -87.39 100.27 12.61 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -100.28 113.27 25.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.2 t -114.4 111.19 34.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -79.73 144.66 33.44 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.39 116.76 25.39 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 172.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.7 p -136.12 152.16 50.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -172.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.9 m -67.18 -48.62 67.4 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -138.55 157.92 45.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 -176.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.59 152.64 63.96 Favored Pre-proline 0 C--N 1.312 -1.048 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.14 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -64.53 149.74 89.41 Favored 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 117.632 -1.112 . . . . 0.0 112.059 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.02 -6.9 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 119.021 2.971 . . . . 0.0 119.021 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -126.91 112.89 15.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.479 1.288 . . . . 0.0 114.479 -173.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 21.07 45.71 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 118.977 2.954 . . . . 0.0 118.977 175.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.1 p-90 -72.11 -15.52 61.99 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.133 -0.979 . . . . 0.0 110.796 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.38 -31.3 72.45 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.539 -0.726 . . . . 0.0 111.202 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.89 -37.23 76.11 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 174.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.4 mm -67.45 -40.97 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.42 -32.82 73.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.264 0.554 . . . . 0.0 111.881 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -88.48 2.49 52.75 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.251 0.548 . . . . 0.0 110.289 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.8 ttpp -114.51 103.06 10.66 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 123.169 0.587 . . . . 0.0 111.849 -176.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 81.9 m -68.35 126.92 31.12 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 174.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -83.78 117.73 23.45 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -116.74 135.62 53.62 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.703 0.763 . . . . 0.0 111.072 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -144.41 85.82 1.8 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.66 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.69 5.21 Favored Glycine 0 C--O 1.225 -0.456 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.436 178.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.7 p -82.75 10.21 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.7 t -122.29 144.53 31.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -176.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.56 144.01 43.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 100.826 -3.768 . . . . 0.0 100.826 169.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.8 t -138.54 134.44 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.953 0 CA-C-N 119.449 1.022 . . . . 0.0 109.01 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -99.45 114.56 65.67 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -82.16 62.85 8.16 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 121.839 1.692 . . . . 0.0 113.76 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.01 147.2 48.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.7 tt -148.15 138.11 16.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 59.4 t -110.62 114.09 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.8 137.24 35.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -21.14 65.03 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.343 -0.456 . . . . 0.0 114.141 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.6 p -59.65 -31.56 69.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -177.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptm -140.43 34.2 1.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 tt -42.13 -42.86 3.1 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 117.187 2.292 . . . . 0.0 117.187 -172.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -61.04 -51.31 69.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 118.631 0.65 . . . . 0.0 112.255 -176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -74.08 -35.54 64.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.528 0.68 . . . . 0.0 111.798 -179.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -67.84 -36.41 80.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.842 0.83 . . . . 0.0 111.512 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.51 -43.38 76.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -70.75 -14.73 62.55 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.133 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.68 -34.04 66.92 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 176.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -94.38 -36.77 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -126.07 77.65 71.12 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 122.232 -0.292 . . . . 0.0 110.924 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -69.45 -9.33 25.93 Favored 'Trans proline' 0 C--N 1.347 0.483 0 N-CA-C 113.704 0.617 . . . . 0.0 113.704 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.0 p -83.5 -9.72 58.79 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 122.73 0.412 . . . . 0.0 111.852 178.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -80.98 141.64 34.24 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.191 0.52 . . . . 0.0 111.434 -177.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 . . . . . 0 CA--C 1.512 -0.502 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 179.951 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 120.222 0.058 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.4 -37.02 84.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.298 0.57 . . . . 0.0 109.483 175.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -73.88 -40.82 62.93 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.1 mtt -65.14 -30.79 71.74 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 120.693 0.282 . . . . 0.0 110.742 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.48 91.29 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -67.63 -44.75 77.23 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.34 -42.85 99.36 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.648 0.737 . . . . 0.0 109.869 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -58.86 -44.83 91.12 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.15 176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.81 -32.27 73.88 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.819 -0.55 . . . . 0.0 109.832 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.94 -35.16 59.82 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.155 0.979 . . . . 0.0 110.538 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.67 -37.55 87.98 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -176.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -60.03 -37.17 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 118.838 0.744 . . . . 0.0 110.946 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 C--N 1.327 -0.395 0 O-C-N 121.196 -0.94 . . . . 0.0 108.64 177.013 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 71.4 mt -54.94 -35.23 64.01 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.435 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 47.7 mt-10 -56.81 -26.01 57.02 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -58.37 -49.4 77.37 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 m -71.82 -41.77 67.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.0 0.428 . . . . 0.0 110.934 178.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.435 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 64.1 t80 -56.05 -56.22 23.43 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -67.61 -29.73 69.13 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.853 -0.529 . . . . 0.0 110.766 -178.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -69.12 -39.42 78.92 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.352 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.2 mm -62.24 -46.22 96.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -42.18 79.48 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.37 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -60.83 -46.33 90.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 mt -66.53 -51.44 56.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.936 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.9 t -56.04 -46.74 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.81 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -22.03 66.64 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.756 -0.59 . . . . 0.0 112.431 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.3 m -87.19 1.08 54.21 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.02 -0.94 27.06 Favored Glycine 0 C--O 1.228 -0.277 0 N-CA-C 115.898 1.119 . . . . 0.0 115.898 176.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -68.0 122.66 18.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.377 1.088 . . . . 0.0 108.438 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.79 116.3 4.25 Favored Glycine 0 CA--C 1.507 -0.424 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -178.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -71.81 111.98 6.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.1 mt -75.6 -42.9 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -143.01 116.45 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.904 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.493 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.722 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.442 -0.833 0 CA-C-O 120.01 -0.043 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.42 ' CD ' HH21 ' A' ' 45' ' ' ARG . 11.2 pt-20 -139.56 148.52 42.69 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 86.0 mt -140.1 132.26 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -108.3 136.02 48.64 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.059 0.39 . . . . 0.0 109.968 176.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mp -131.16 129.98 42.45 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.346 0.658 . . . . 0.0 109.749 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -79.58 136.41 36.85 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.34 115.29 41.85 Favored Pre-proline 0 CA--C 1.546 0.795 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.48 -25.56 9.51 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 117.334 -1.311 . . . . 0.0 112.668 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.85 59.31 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.883 0.873 . . . . 0.0 111.482 -179.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt 57.34 45.49 20.0 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 t -60.13 -177.69 0.07 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 112.433 -2.167 . . . . 0.0 112.955 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 p -55.88 -29.02 59.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.239 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -109.36 136.96 47.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -80.18 -30.54 38.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.725 -175.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.0 mt -137.57 162.45 33.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.186 -176.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.3 t -129.59 135.39 61.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.42 HH21 ' CD ' ' A' ' 30' ' ' GLU . 59.1 ttt180 -125.01 134.59 52.52 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 175.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.2 129.56 54.23 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 104.427 -2.434 . . . . 0.0 104.427 177.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -136.43 132.56 35.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 117.891 0.314 . . . . 0.0 110.736 -177.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 tmtm? -106.76 110.8 23.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.832 -0.542 . . . . 0.0 109.673 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -151.52 144.91 24.8 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -106.77 101.22 10.67 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.65 135.57 35.53 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -92.29 -37.27 12.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 175.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -126.27 150.86 48.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.009 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -65.02 -15.54 62.44 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.854 -0.529 . . . . 0.0 110.998 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -63.38 -36.33 83.37 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -73.47 -40.52 64.07 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.8 ttm -57.39 -48.75 78.26 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.934 -0.306 . . . . 0.0 111.0 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.33 -31.84 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.832 0.742 . . . . 0.0 112.108 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.0 mtt180 -66.82 -41.21 87.86 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -179.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.28 -36.29 77.49 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.85 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.5 mm -64.38 -30.81 51.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 121.626 -0.671 . . . . 0.0 112.243 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -63.39 -36.87 85.15 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -72.38 -38.69 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -56.58 -49.89 73.54 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.66 -27.94 68.73 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.97 -46.06 83.09 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -66.48 -42.59 87.25 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.93 -40.83 88.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 119.034 -0.507 . . . . 0.0 112.116 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.31 -33.34 74.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.014 1.279 . . . . 0.0 109.999 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.3 ttm-85 -64.05 -42.12 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.6 t -68.66 -41.68 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -57.03 -41.37 78.48 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.795 0.438 . . . . 0.0 111.35 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.5 t-80 -62.23 -40.54 96.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.758 0.314 . . . . 0.0 110.883 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -73.27 -41.86 63.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.739 0.304 . . . . 0.0 111.791 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.69 -17.94 59.78 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.47 7.18 63.71 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.444 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -65.42 140.45 58.63 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 122.068 -0.666 . . . . 0.0 109.356 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.02 -32.45 73.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.613 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.401 HH21 ' CD ' ' A' ' 105' ' ' GLU . 19.7 ttt85 -150.73 154.04 36.64 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 177.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 29.7 mmm -124.38 150.36 45.66 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -127.33 142.43 51.45 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.554 0.534 . . . . 0.0 109.651 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -142.35 124.81 15.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.922 0.391 . . . . 0.0 111.198 -176.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.6 tp -90.87 108.08 19.61 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -102.09 111.52 23.82 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 10.8 t -100.98 106.87 20.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.061 0.458 . . . . 0.0 112.002 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -75.69 139.68 42.08 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -118.22 113.23 21.2 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 172.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.2 m -128.28 155.0 45.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.6 m -67.16 -48.39 68.15 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.818 0.818 . . . . 0.0 108.908 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.27 170.87 15.17 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 -177.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.93 151.16 43.11 Favored Pre-proline 0 C--N 1.314 -0.966 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -62.16 151.51 81.56 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 122.194 0.576 . . . . 0.0 112.307 176.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -63.62 -18.39 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 N-CA-C 121.176 3.769 . . . . 0.0 121.176 -167.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -150.21 137.93 19.96 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 116.241 1.941 . . . . 0.0 116.241 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 t0 37.87 24.1 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 119.179 3.029 . . . . 0.0 119.179 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 30.6 p-90 -67.59 -22.32 65.37 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 120.742 -1.224 . . . . 0.0 110.376 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.25 -31.26 71.06 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.4 . . . . 0.0 111.944 -178.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -59.77 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.8 mm -66.04 -39.58 84.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.911 -175.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.26 -14.7 60.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.35 0.595 . . . . 0.0 111.658 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -100.16 3.28 43.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.789 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -124.2 144.6 49.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.598 0.714 . . . . 0.0 110.979 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.7 m -79.89 147.16 31.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 104.468 -2.419 . . . . 0.0 104.468 172.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -107.61 123.67 48.81 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . 0.401 ' CD ' HH21 ' A' ' 79' ' ' ARG . 8.6 mt-10 -125.95 130.94 52.25 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.455 0.645 . . . . 0.0 109.645 179.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.05 75.52 1.3 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 178.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.36 -112.65 3.7 Favored Glycine 0 C--O 1.224 -0.528 0 C-N-CA 119.722 -1.228 . . . . 0.0 111.15 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.2 p -93.19 22.15 5.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.532 0.682 . . . . 0.0 110.975 -178.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 54.2 t -123.86 141.03 45.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.7 t -127.68 140.92 51.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 104.286 -2.487 . . . . 0.0 104.286 170.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.2 t -135.86 138.5 47.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -114.33 114.44 45.45 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.08 157.73 30.4 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 115.955 -2.23 . . . . 0.0 111.122 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.09 149.78 31.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 103.023 -2.954 . . . . 0.0 103.023 175.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -147.88 137.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 118.776 0.716 . . . . 0.0 109.602 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 83.1 t -114.18 117.27 55.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.2 140.42 36.5 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.52 -22.68 61.78 Favored Glycine 0 C--N 1.322 -0.222 0 C-N-CA 121.06 -0.591 . . . . 0.0 113.823 -176.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 37.2 p -61.05 -32.06 71.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 18.0 ptp -142.66 40.69 1.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.5 tt -43.29 -45.98 6.12 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.79 -1.55 . . . . 0.0 114.906 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -61.16 -37.29 82.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -43.73 61.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.354 0.597 . . . . 0.0 110.68 -176.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -64.49 -41.16 96.63 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.919 0.866 . . . . 0.0 109.45 179.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.49 -43.29 97.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.035 -176.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -73.7 -18.68 60.98 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.298 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.26 -34.85 61.42 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.2 t -90.03 -41.65 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 121.319 0.581 . . . . 0.0 110.283 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.29 79.48 70.17 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.154 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -66.78 -14.19 42.86 Favored 'Trans proline' 0 N--CA 1.474 0.376 0 N-CA-C 114.233 0.82 . . . . 0.0 114.233 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 7.2 m -83.16 2.62 34.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -68.54 132.02 46.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.51 0.672 . . . . 0.0 111.101 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 . . . . . 0 C--N 1.325 -0.482 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 176.831 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 34.2 m120 . . . . . 0 N--CA 1.464 0.227 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.8 71.85 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.941 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -69.06 -45.05 71.34 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 36.3 mmt -62.75 -28.92 70.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.131 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -61.98 -35.53 78.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.172 -0.33 . . . . 0.0 111.742 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -67.32 -44.48 79.05 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.14 0.495 . . . . 0.0 109.713 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -65.21 -38.58 90.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.732 0.777 . . . . 0.0 109.458 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -58.85 -46.68 87.17 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.377 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -66.98 -45.31 78.05 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.0 -40.5 93.79 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.595 -176.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 33.9 p -71.81 -34.74 69.61 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.203 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.28 -34.64 76.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.726 0.41 . . . . 0.0 111.712 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 71.2 t -56.94 -46.94 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 118.47 0.577 . . . . 0.0 110.675 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 C--N 1.324 -0.509 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.432 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.3 tt . . . . . 0 C--O 1.222 -0.389 0 CA-C-O 121.558 0.694 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.03 -35.25 78.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -60.82 -29.73 69.66 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.5 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -61.2 -51.07 70.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -179.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 m -63.76 -42.0 97.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.489 0.661 . . . . 0.0 110.837 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -59.09 -51.75 68.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.97 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -72.37 -28.66 63.17 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.746 -0.596 . . . . 0.0 111.547 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -64.68 -44.42 90.39 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.1 mm -70.84 -37.67 69.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.23 81.64 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.52 -46.12 89.86 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 116.894 -0.139 . . . . 0.0 111.305 178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -54.73 -47.18 74.1 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.228 0.611 . . . . 0.0 112.037 -177.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.07 -45.82 55.14 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.409 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.6 t -56.97 -41.92 77.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 O-C-N 122.032 -0.417 . . . . 0.0 111.4 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.451 HD22 ' C ' ' A' ' 17' ' ' ASN . 0.2 OUTLIER -72.08 -4.78 30.89 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.141 -0.974 . . . . 0.0 112.734 -179.862 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.4 m -98.31 13.56 31.03 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.68 -3.92 53.4 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.394 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.423 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.0 m-85 -69.67 121.69 17.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.627 0.727 . . . . 0.0 109.694 -178.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.62 129.94 9.59 Favored Glycine 0 N--CA 1.449 -0.495 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.5 t -74.01 126.9 35.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.0 mt -96.2 -44.04 12.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -150.17 133.23 16.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 118.936 0.789 . . . . 0.0 112.404 179.434 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.382 0.611 . . . . 0.0 111.541 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -129.89 159.08 37.7 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 115.1 1.519 . . . . 0.0 115.1 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.6 mt -139.25 131.19 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.86 0.864 . . . . 0.0 109.036 176.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -100.92 135.9 41.62 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 mp -129.46 138.1 51.22 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 122.975 0.51 . . . . 0.0 110.095 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.05 137.78 32.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -88.45 107.47 16.96 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 117.905 0.32 . . . . 0.0 111.513 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 81.9 Cg_endo -70.06 -17.01 36.48 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 120.58 0.854 . . . . 0.0 112.474 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -66.62 -25.26 66.52 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.884 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 60.7 42.96 12.94 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 -174.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.2 t -66.47 -177.52 0.57 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 112.577 -2.102 . . . . 0.0 112.943 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.9 p -55.07 -33.98 63.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 178.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.467 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 7.8 p80 -107.29 143.24 35.83 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -89.73 -29.72 18.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.721 -173.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.69 164.43 28.85 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.479 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.1 t -130.54 138.07 54.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -123.85 113.65 18.81 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tp -94.57 128.56 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -136.46 118.4 15.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.426 0.557 . . . . 0.0 111.607 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -86.47 94.68 9.47 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.383 -0.823 . . . . 0.0 109.084 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -147.25 135.81 21.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.164 0.506 . . . . 0.0 111.314 -176.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -89.99 151.54 21.63 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 124.951 1.3 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.7 mt -138.32 140.06 39.36 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -176.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -92.86 -44.71 8.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -129.64 160.57 32.92 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.712 -0.618 . . . . 0.0 109.634 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -64.65 -22.42 66.97 Favored 'General case' 0 C--O 1.219 -0.513 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -66.28 -33.36 75.57 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.252 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -69.16 -35.06 75.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 177.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.27 -50.53 67.55 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.327 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.3 m -63.72 -32.79 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 O-C-N 121.452 -0.78 . . . . 0.0 110.297 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.55 -36.92 83.85 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.663 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.78 -46.71 86.72 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.2 mp -69.22 -33.94 60.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.418 -0.801 . . . . 0.0 110.744 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -57.91 -40.81 81.27 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -69.29 -44.74 71.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.477 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.53 -42.92 97.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.1 -31.28 66.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -41.49 98.15 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.214 1.007 . . . . 0.0 109.474 177.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -73.6 -33.93 64.82 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -65.32 -43.34 95.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.92 -33.68 75.16 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.395 0.998 . . . . 0.0 110.556 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.18 -45.36 93.75 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.095 -0.378 . . . . 0.0 110.184 175.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.51 -40.43 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -37.56 69.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.126 -0.359 . . . . 0.0 110.739 178.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -63.08 -40.52 97.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.519 0.2 . . . . 0.0 110.787 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -65.91 -39.62 90.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.192 0.52 . . . . 0.0 110.307 179.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -77.28 -9.66 58.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.868 -0.606 . . . . 0.0 112.6 -179.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.69 14.67 60.86 Favored Glycine 0 CA--C 1.52 0.396 0 CA-C-O 121.43 0.461 . . . . 0.0 113.837 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.5 mtp85 -73.51 148.65 42.9 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.955 -0.733 . . . . 0.0 112.665 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.48 -33.75 71.61 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.539 176.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -154.4 151.67 29.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.5 mmm -118.43 141.84 48.15 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.467 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 43.4 tttp -120.82 130.75 54.1 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -132.68 125.92 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.901 0.382 . . . . 0.0 111.857 -171.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.3 tp -88.23 123.32 32.73 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 175.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -116.41 127.97 55.09 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.18 116.36 47.57 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 120.991 0.424 . . . . 0.0 110.734 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -83.56 145.4 28.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -121.45 112.0 17.99 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 173.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.5 m -130.28 154.03 48.03 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -170.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.2 m -67.21 -48.28 68.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -141.41 159.59 41.9 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 -177.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.86 157.84 45.59 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.616 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -61.45 146.86 96.7 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 117.715 -1.056 . . . . 0.0 111.168 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.0 m -70.66 -11.71 15.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 118.983 2.957 . . . . 0.0 118.983 -168.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.42 137.41 21.74 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t0 47.17 14.48 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 119.242 3.053 . . . . 0.0 119.242 171.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -69.02 -21.38 64.13 Favored 'General case' 0 C--N 1.318 -0.771 0 O-C-N 121.026 -1.046 . . . . 0.0 113.605 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -59.3 -31.15 68.88 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.019 -0.425 . . . . 0.0 111.473 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.34 -31.07 72.13 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.196 0.522 . . . . 0.0 109.821 177.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.7 mm -71.1 -40.73 75.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.028 0.442 . . . . 0.0 110.159 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.97 5.38 8.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.461 0.648 . . . . 0.0 110.569 178.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.34 -2.69 15.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.815 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -125.24 137.9 54.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.776 0.798 . . . . 0.0 112.512 -175.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 28.2 m -83.28 122.79 28.9 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.395 -2.446 . . . . 0.0 104.395 175.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -82.79 118.42 23.38 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -119.78 126.2 50.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.943 0.877 . . . . 0.0 111.287 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -127.46 75.45 1.59 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.228 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.76 -112.74 5.26 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 119.951 -1.119 . . . . 0.0 111.277 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 46.8 p -77.98 17.7 0.56 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 83.0 t -130.47 140.53 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 123.01 0.524 . . . . 0.0 110.663 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.8 m -131.51 132.54 44.28 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 169.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.3 t -132.01 133.43 60.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -114.13 109.04 49.73 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.18 159.57 20.37 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 117.247 -1.369 . . . . 0.0 113.644 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.93 159.17 44.73 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 102.973 -2.973 . . . . 0.0 102.973 176.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.0 tt -149.23 139.76 16.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.72 108.72 26.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.61 136.29 33.35 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.11 -23.43 67.88 Favored Glycine 0 C--O 1.225 -0.45 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.404 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 26.7 p -59.0 -28.62 66.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -143.43 35.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.244 1.021 . . . . 0.0 108.355 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.8 tt -46.03 -40.55 10.78 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 -173.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.6 -37.93 85.74 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 119.227 -0.989 . . . . 0.0 112.606 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -42.45 29.27 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.958 0.885 . . . . 0.0 110.573 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -39.42 92.09 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.404 -174.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -68.27 -44.01 76.51 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 122.082 -0.386 . . . . 0.0 110.35 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -73.62 -14.32 61.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.928 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.12 -31.58 62.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 177.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.61 -37.86 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 120.695 0.283 . . . . 0.0 110.964 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -130.16 77.07 77.02 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 122.101 -0.374 . . . . 0.0 111.5 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.64 -13.8 37.99 Favored 'Trans proline' 0 C--N 1.348 0.548 0 N-CA-C 113.819 0.661 . . . . 0.0 113.819 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.9 m -73.26 -10.51 59.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 178.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -102.53 125.64 49.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 . . . . . 0 CA--C 1.513 -0.445 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.33 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 . . . . . 0 C--O 1.223 -0.3 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.33 -36.5 78.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.07 0.462 . . . . 0.0 110.209 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -72.66 -40.92 65.94 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 54.2 mtt -62.09 -37.81 86.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.946 0.403 . . . . 0.0 109.988 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.85 97.47 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 122.178 -0.326 . . . . 0.0 110.247 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -64.58 -44.7 89.84 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.958 0.408 . . . . 0.0 110.121 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -63.38 -43.29 98.02 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.545 0.688 . . . . 0.0 109.953 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 37.6 ttt85 -64.02 -34.68 78.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.786 178.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -63.84 -39.56 94.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.215 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.96 -37.68 88.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.951 0.405 . . . . 0.0 109.995 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 14.5 m -69.74 -35.02 74.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.55 0.69 . . . . 0.0 110.904 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -42.93 74.3 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -62.57 -32.99 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 120.494 -0.483 . . . . 0.0 109.882 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.211 -0.968 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.538 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.468 0.43 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.1 -36.79 82.8 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.193 -0.317 . . . . 0.0 111.138 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -32.36 73.93 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.412 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -62.95 -52.54 62.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.2 m -59.96 -42.09 93.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.766 0.317 . . . . 0.0 110.73 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -56.29 -55.37 34.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 123.063 0.545 . . . . 0.0 112.15 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -71.07 -28.98 64.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 121.725 -0.61 . . . . 0.0 111.94 -178.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -70.51 -35.58 73.28 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.834 -0.541 . . . . 0.0 110.153 176.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.0 mm -69.38 -42.05 81.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.27 81.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.31 92.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.522 178.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -59.47 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.728 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.7 mt -63.87 -50.01 70.5 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.464 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.95 -42.34 89.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.757 0.313 . . . . 0.0 110.569 -177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -4.35 38.12 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.8 m -103.12 7.82 38.73 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.722 0.409 . . . . 0.0 110.655 176.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.98 0.33 35.95 Favored Glycine 0 C--O 1.228 -0.246 0 N-CA-C 116.527 1.371 . . . . 0.0 116.527 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.422 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.9 m-85 -72.89 117.96 15.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 118.312 1.056 . . . . 0.0 109.519 177.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.79 134.89 17.01 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.8 t -78.12 126.1 38.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 117.733 0.767 . . . . 0.0 109.481 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 51.9 mt -98.64 -47.98 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -149.64 138.68 21.18 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 118.847 0.749 . . . . 0.0 112.65 179.897 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 . . . . . 0 C--O 1.237 0.407 0 CA-C-O 121.61 0.719 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.63 154.94 47.36 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.126 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.2 mt -139.4 132.23 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 41.5 m95 -108.58 127.5 54.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.422 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.9 mm? -124.01 140.93 52.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.557 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -84.62 126.61 33.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 176.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.73 123.84 88.51 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.4 -29.22 14.0 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 115.56 -2.493 . . . . 0.0 113.12 -178.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -71.3 -31.97 68.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.186 0.517 . . . . 0.0 112.11 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 58.07 38.31 26.57 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.829 1.775 . . . . 0.0 108.68 -176.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.6 t -60.78 -172.63 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.725 171.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.0 m -41.52 -26.13 0.06 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -114.92 139.92 49.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 165.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -86.34 -31.58 21.47 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.843 -0.536 . . . . 0.0 109.786 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.9 mt -140.43 164.62 29.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 -177.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.2 p -135.29 137.36 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -111.83 125.17 53.73 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.13 124.66 39.29 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 104.009 -2.589 . . . . 0.0 104.009 174.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -136.44 125.55 24.51 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -175.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -107.34 99.16 8.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.878 0.847 . . . . 0.0 112.454 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.92 150.1 34.54 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.618 -179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.88 144.44 33.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.72 133.85 55.32 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -85.0 -39.88 17.53 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 122.37 1.081 . . . . 0.0 108.93 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -132.05 157.34 44.41 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -64.35 -19.55 65.54 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -178.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -62.34 -33.24 74.33 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -69.5 -33.04 72.27 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 4.8 ttm -72.65 -48.45 39.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.798 177.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 23.6 m -58.05 -36.75 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.16 -29.8 65.66 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.668 -178.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -64.52 -39.18 93.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mt -74.12 -38.32 48.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 122.004 -0.435 . . . . 0.0 111.857 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -66.59 -29.66 69.77 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.53 -37.76 56.17 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -56.71 -34.29 67.32 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.535 178.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.01 67.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.04 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -69.3 -46.17 67.8 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.908 0.776 . . . . 0.0 109.097 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 -56.74 -43.78 81.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.4 -34.2 57.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.076 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.84 -42.0 95.28 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.685 1.13 . . . . 0.0 109.636 176.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.43 -46.37 90.39 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.36 -38.95 82.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 178.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.57 -44.2 89.66 Favored 'General case' 0 CA--C 1.511 -0.54 0 O-C-N 121.842 -0.536 . . . . 0.0 110.22 179.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -66.06 -45.18 82.29 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -61.3 -41.43 96.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -90.0 -5.78 56.31 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.04 9.0 45.62 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 116.413 1.325 . . . . 0.0 116.413 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -67.22 146.62 54.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.912 -0.758 . . . . 0.0 110.477 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -62.41 -35.59 79.71 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.068 0.461 . . . . 0.0 110.338 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -149.49 148.37 29.33 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 175.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -113.75 139.04 49.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -116.06 132.06 56.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -134.56 125.57 27.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.514 0.597 . . . . 0.0 111.022 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.8 tp -89.13 124.44 34.33 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 174.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -113.89 108.64 17.33 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.53 111.55 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.807 0.337 . . . . 0.0 110.52 -176.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -82.78 133.06 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 176.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -111.27 109.47 19.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.0 m -127.31 155.59 43.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.057 0.456 . . . . 0.0 112.108 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.6 m -71.2 -46.92 60.2 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 175.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -138.85 158.76 43.63 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -175.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 146.13 39.61 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.862 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.68 150.3 88.41 Favored 'Trans proline' 0 C--N 1.345 0.363 0 O-C-N 121.895 0.418 . . . . 0.0 113.177 178.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -79.46 -7.49 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 116.728 2.121 . . . . 0.0 116.728 -173.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -108.49 97.0 6.73 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 14.96 55.62 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -73.12 -12.83 61.04 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.71 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.62 -31.16 70.36 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.828 -0.545 . . . . 0.0 111.735 -177.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.77 -33.2 74.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.219 0.533 . . . . 0.0 110.249 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.0 mm -67.25 -37.11 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -176.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.21 73.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.383 0.611 . . . . 0.0 110.824 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.76 -9.31 54.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.367 0.603 . . . . 0.0 111.078 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -88.14 95.74 10.27 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.157 -178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 86.3 m -68.51 124.24 23.02 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 173.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -87.41 108.28 18.93 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -106.18 128.41 53.91 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.516 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -132.15 75.54 1.64 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.524 -1.288 . . . . 0.0 107.524 177.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.68 5.21 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.116 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.1 p -79.32 20.72 0.51 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.2 t -127.68 141.12 47.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.5 t -139.21 112.89 8.42 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.225 -1.769 . . . . 0.0 106.225 173.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.6 t -109.73 129.4 64.67 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 122.561 1.172 . . . . 0.0 110.311 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -102.07 99.73 13.2 Favored Pre-proline 0 N--CA 1.425 -1.699 0 CA-C-N 111.801 -2.454 . . . . 0.0 107.919 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.94 151.87 21.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 115.292 -2.672 . . . . 0.0 113.032 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.54 150.84 31.76 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 175.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -144.15 134.29 20.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.8 m -115.36 127.59 72.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 103.679 -2.711 . . . . 0.0 103.679 175.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.68 136.34 54.87 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -176.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -46.91 -39.03 10.82 Favored Glycine 0 N--CA 1.461 0.304 0 N-CA-C 117.268 1.667 . . . . 0.0 117.268 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -37.34 63.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.4 ptm -136.53 34.38 2.72 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.961 1.362 . . . . 0.0 108.673 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.3 tp -51.0 -38.52 51.76 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 116.966 2.21 . . . . 0.0 116.966 -172.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -64.97 -41.15 95.71 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.656 0.662 . . . . 0.0 111.255 -177.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.92 -37.57 70.02 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -65.91 -40.89 91.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.596 0.712 . . . . 0.0 110.811 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.36 -49.03 78.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.161 -177.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -71.76 -15.11 62.17 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.432 -177.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.99 -35.66 57.0 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.249 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.0 p -94.81 -37.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 120.853 0.359 . . . . 0.0 111.583 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -130.1 75.51 79.27 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 122.036 -0.415 . . . . 0.0 110.662 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.43 -13.83 40.51 Favored 'Trans proline' 0 C--N 1.349 0.598 0 CA-C-O 121.392 0.497 . . . . 0.0 112.813 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 11.9 p -75.62 -8.3 56.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.074 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -78.3 124.83 28.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.301 0.572 . . . . 0.0 110.704 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 . . . . . 0 C--N 1.322 -0.59 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.004 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 C--O 1.217 -0.618 0 CA-C-O 120.992 0.425 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.7 64.72 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.47 -45.91 85.32 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 75.4 mtm -69.6 -28.93 66.36 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.017 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.97 -31.22 69.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 122.159 -0.338 . . . . 0.0 111.575 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -65.81 -43.72 87.78 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -69.62 -36.63 76.32 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.434 0.635 . . . . 0.0 109.363 -179.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.28 92.55 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.657 177.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -66.78 -40.61 88.24 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.787 0.435 . . . . 0.0 111.86 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.7 mt -64.99 -37.78 88.8 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 121.68 -0.638 . . . . 0.0 110.039 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 38.7 m -69.06 -31.72 70.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.612 0.72 . . . . 0.0 110.282 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.88 -45.49 64.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.943 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.09 -33.06 60.99 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 CA--C 1.536 0.406 0 O-C-N 121.428 -0.795 . . . . 0.0 109.37 176.15 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 pp . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 121.024 0.44 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.32 -36.54 82.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.897 0.379 . . . . 0.0 111.385 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -68.58 -29.58 68.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.332 -0.23 . . . . 0.0 110.679 -179.348 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.97 -50.0 73.84 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.157 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -64.79 -41.48 95.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.529 179.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -54.5 -52.34 62.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.986 0.422 . . . . 0.0 110.936 179.548 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -73.3 -29.27 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.005 -0.434 . . . . 0.0 111.977 -179.852 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -68.7 -36.09 78.01 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.546 -0.721 . . . . 0.0 111.304 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.6 mm -70.25 -39.08 76.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.843 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.27 -44.56 84.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.72 -42.32 95.33 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.968 178.347 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -62.2 -43.06 99.69 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.655 0.264 . . . . 0.0 111.371 -179.097 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 mt -69.84 -46.26 66.0 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.173 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 40.9 t -54.56 -42.55 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.956 -0.465 . . . . 0.0 110.857 173.171 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -61.35 -33.82 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 110.839 178.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -79.65 9.49 5.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 122.922 0.489 . . . . 0.0 112.271 177.886 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.19 -0.21 61.93 Favored Glycine 0 CA--C 1.517 0.212 0 N-CA-C 116.415 1.326 . . . . 0.0 116.415 175.507 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -68.27 132.23 46.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.93 0.865 . . . . 0.0 110.075 179.891 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.33 133.4 11.77 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.217 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.9 t -75.38 121.45 27.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.3 mt -85.67 -46.07 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 177.102 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -160.52 132.3 5.94 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 174.731 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.515 -0.373 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -147.68 143.89 27.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -136.69 133.08 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 177.039 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 57.5 m95 -112.25 133.12 54.55 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.142 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.59 131.59 48.16 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 123.426 0.69 . . . . 0.0 109.69 -178.716 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -80.92 132.91 35.46 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.686 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.74 109.59 12.53 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.338 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.72 -19.0 19.01 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 117.182 -1.412 . . . . 0.0 112.239 -178.044 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -68.83 -27.88 66.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.908 178.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 77.7 mttt 58.74 41.96 20.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 123.175 1.465 . . . . 0.0 107.106 -178.535 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -177.08 0.24 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 111.188 -2.733 . . . . 0.0 113.409 -179.47 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.7 p -51.9 -28.22 15.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.704 175.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 46.8 p-80 -107.36 143.82 35.11 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 173.916 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -85.94 -36.9 19.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.566 -172.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -141.66 163.26 33.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.13 -177.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.0 t -122.84 134.57 65.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 175.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.25 127.7 38.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.759 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.9 mt -97.51 129.81 44.64 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -136.56 150.37 48.58 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -115.08 131.5 56.91 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 173.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.69 140.43 20.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.588 0.233 . . . . 0.0 111.265 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -93.01 125.51 37.64 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 175.085 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -128.49 101.48 6.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.137 -0.352 . . . . 0.0 111.11 -174.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.0 -42.15 58.03 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.925 0.869 . . . . 0.0 111.251 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -129.19 156.89 43.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.316 -179.324 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.7 ptt180 -65.82 -20.58 66.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 122.05 -0.406 . . . . 0.0 111.249 -178.355 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -62.34 -33.31 74.45 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -72.47 -34.65 67.88 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 121.537 -0.727 . . . . 0.0 109.186 178.264 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -65.25 -47.43 76.8 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.005 178.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.2 m -64.78 -31.76 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.538 -0.726 . . . . 0.0 111.207 179.442 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -68.13 -36.17 79.29 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.619 179.417 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.39 -44.81 92.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.4 -30.74 51.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -176.924 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.15 -40.5 96.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -70.59 -41.07 72.83 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -57.08 -48.22 79.12 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.009 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.36 94.25 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.603 -177.891 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.55 -38.85 88.01 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 121.545 0.688 . . . . 0.0 110.281 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -61.19 -42.78 99.18 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.345 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 81.9 t -69.06 -38.71 78.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 119.131 -0.461 . . . . 0.0 112.111 -179.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -56.55 -41.16 76.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.038 0.835 . . . . 0.0 110.201 179.812 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.3 mtm-85 -63.55 -33.46 75.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.496 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.8 t -76.72 -44.38 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.4 mmt-85 -61.05 -34.82 75.48 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -58.04 -39.64 78.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.144 0.497 . . . . 0.0 109.884 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -73.41 -38.65 65.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.918 0.389 . . . . 0.0 111.087 179.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.28 -18.02 60.78 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -177.261 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.38 -3.08 1.95 Allowed Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.776 1.471 . . . . 0.0 116.776 179.311 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.27 143.39 43.05 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -62.18 -36.58 82.31 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -149.14 157.86 43.71 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.231 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.38 157.76 27.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 17.5 mmtt -143.41 132.01 22.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 174.509 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tt -142.47 127.41 18.35 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -175.198 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.4 tp -83.12 104.08 13.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 175.309 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -102.62 108.55 19.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.7 t -100.38 112.32 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.314 -176.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -91.41 106.78 18.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.417 0.627 . . . . 0.0 112.045 -179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -79.19 126.89 31.35 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 92.2 p -141.42 164.04 31.3 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 122.696 0.398 . . . . 0.0 110.669 -174.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 74.3 m -69.7 -49.07 56.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 176.231 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -153.54 177.85 10.48 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 -175.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.01 151.19 38.12 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.638 -174.873 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.58 149.74 80.42 Favored 'Trans proline' 0 C--N 1.351 0.661 0 O-C-N 122.475 0.724 . . . . 0.0 113.079 174.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.0 m -80.26 -10.71 12.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -175.45 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -117.57 74.87 0.95 Allowed 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -172.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 53.38 49.16 20.3 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 174.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 49.5 p-90 -68.16 -19.71 64.82 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 121.522 -0.736 . . . . 0.0 109.875 175.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -63.06 -34.56 77.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.59 -35.2 70.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 176.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.3 mm -71.12 -44.57 74.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.132 0.491 . . . . 0.0 111.095 -176.341 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . 0.434 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -67.96 -27.89 66.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.645 0.736 . . . . 0.0 111.79 -177.414 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -93.89 6.22 49.14 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.236 -177.049 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -119.89 144.41 47.42 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.407 0.622 . . . . 0.0 111.436 176.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.7 m -88.2 127.77 35.45 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.415 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -85.0 129.77 34.74 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 175.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -132.32 128.96 38.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.543 0.687 . . . . 0.0 110.091 178.475 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -149.54 114.78 5.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.251 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 58.01 -127.29 44.71 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.477 -0.868 . . . . 0.0 114.195 177.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.8 p -82.46 13.11 3.85 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 122.746 0.419 . . . . 0.0 111.155 -178.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 2.3 t -123.57 149.9 27.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -176.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.9 t -138.43 139.75 39.02 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 100.259 -3.978 . . . . 0.0 100.259 171.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.6 t -136.31 136.57 48.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 118.42 0.554 . . . . 0.0 109.806 -177.189 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -105.62 113.77 63.73 Favored Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 171.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . 0.434 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 69.6 Cg_endo -76.36 158.28 36.88 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 116.158 -2.094 . . . . 0.0 111.638 176.873 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 152.78 37.66 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.2 tt -145.13 138.01 21.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -177.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 96.5 t -118.16 119.97 63.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.016 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -85.91 156.55 20.46 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 179.687 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.69 -27.67 53.44 Favored Glycine 0 C--N 1.318 -0.456 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 168.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 p -67.66 -42.82 81.56 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -177.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptp -128.28 37.98 4.06 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.559 1.171 . . . . 0.0 109.281 -179.272 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -45.55 -43.27 11.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.59 -1.641 . . . . 0.0 115.07 -177.233 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.3 mtm180 -69.5 -31.49 69.78 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.495 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -72.31 -41.54 66.44 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.443 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -64.5 -41.5 96.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.495 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.38 -42.14 98.24 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.568 -0.73 . . . . 0.0 112.371 -179.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -76.38 -14.34 60.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 119.813 1.188 . . . . 0.0 112.105 -179.07 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -85.09 -40.01 17.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.27 0.557 . . . . 0.0 110.246 178.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 42.6 t -91.57 -40.87 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.417 0.627 . . . . 0.0 110.816 -177.523 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -128.44 70.57 79.73 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.876 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.04 -15.69 49.54 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 CA-C-N 118.39 0.461 . . . . 0.0 113.147 179.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.7 m -83.37 0.34 46.4 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -73.34 137.02 44.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.327 0.584 . . . . 0.0 109.683 179.376 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 . . . . . 0 C--N 1.325 -0.496 0 CA-C-O 121.592 0.71 . . . . 0.0 109.805 -179.151 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 . . . . . 0 C--O 1.216 -0.689 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.15 90.2 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.854 -0.529 . . . . 0.0 111.496 177.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -65.86 -41.98 90.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 179.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 63.2 mtt -67.68 -29.01 68.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.397 178.299 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.06 -34.07 75.56 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.048 -0.407 . . . . 0.0 111.803 -179.298 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 76.7 ttt-85 -65.41 -46.68 79.06 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 178.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.65 -46.07 91.35 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.356 -0.537 . . . . 0.0 109.881 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -60.7 -35.52 76.49 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.328 -178.364 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -65.76 -41.36 92.18 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.538 0.208 . . . . 0.0 111.004 176.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.2 mt -66.07 -35.94 81.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.033 0.444 . . . . 0.0 110.109 -179.523 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.5 t -69.77 -42.94 73.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.483 0.659 . . . . 0.0 109.422 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.32 -46.0 90.7 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -177.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -58.68 -39.4 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 118.966 0.803 . . . . 0.0 111.986 -175.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--N 1.326 -0.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.165 178.305 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.47 0.559 0 CA-C-O 121.824 0.821 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 36.2 mt -59.9 -35.32 74.6 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.986 -178.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -67.38 -26.0 66.24 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.17 -177.165 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.24 -52.74 63.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.65 -41.89 68.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.899 178.691 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -56.85 -52.16 66.18 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -73.8 -33.53 64.23 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.653 -0.654 . . . . 0.0 112.269 -179.506 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -69.16 -34.82 75.57 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.417 -0.802 . . . . 0.0 111.034 178.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.8 mm -72.72 -34.05 46.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 177.045 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.09 84.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 175.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.81 87.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.568 178.032 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -60.33 -46.06 91.24 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.23 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -64.99 -43.14 93.56 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.523 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.72 -43.01 94.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.28 179.775 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.5 p30 -75.38 -10.56 59.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.3 -0.875 . . . . 0.0 112.079 178.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.2 m -89.98 6.05 43.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 173.723 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.92 -0.51 67.1 Favored Glycine 0 CA--C 1.517 0.172 0 N-CA-C 116.353 1.301 . . . . 0.0 116.353 175.623 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -66.39 131.1 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 118.187 0.993 . . . . 0.0 110.0 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.94 131.65 10.56 Favored Glycine 0 N--CA 1.451 -0.357 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 -178.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.6 t -74.57 125.82 34.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 61.3 mt -93.65 -48.43 13.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.58 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -149.49 128.76 12.87 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.302 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 175.119 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 . . . . . 0 C--O 1.222 -0.366 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -133.28 152.07 51.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.262 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 25.8 mt -140.55 134.61 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 175.063 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 m95 -109.04 132.25 54.29 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -125.72 135.38 52.02 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -94.75 133.59 38.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 175.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.75 128.17 93.75 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -77.78 -28.54 5.1 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 116.657 -1.762 . . . . 0.0 114.378 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -77.67 -28.62 51.21 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 123.62 0.768 . . . . 0.0 112.033 -178.39 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 55.09 40.6 31.95 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.4 m -66.09 -173.12 0.17 Allowed 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 164.612 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.7 t -41.25 -39.45 1.36 Allowed 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -75.84 123.8 26.26 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -104.82 -26.32 12.28 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 176.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.4 mt -140.35 155.41 46.79 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -176.488 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.4 t -132.83 136.12 56.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 175.176 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -124.8 129.93 51.4 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.8 mt -102.55 131.43 49.28 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 174.448 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -136.4 103.03 5.14 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -174.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.9 96.38 7.02 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 178.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -151.69 122.73 7.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.125 -173.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.04 151.38 28.42 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.1 mt -138.59 110.46 7.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -173.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.26 -40.37 67.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -134.15 155.59 49.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.902 -175.206 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -63.87 -22.92 67.14 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 177.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.6 -39.51 88.42 Favored 'General case' 0 C--O 1.211 -0.945 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.424 -179.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.26 -37.02 80.32 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 18.1 ttt -60.45 -51.6 68.77 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.379 178.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.42 -32.53 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 118.895 0.771 . . . . 0.0 111.116 -179.138 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.1 mtm105 -66.53 -38.1 86.43 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.834 0.349 . . . . 0.0 110.439 -178.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -60.34 -39.72 88.12 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.013 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.7 mp -74.18 -34.36 37.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.305 -0.872 . . . . 0.0 111.364 179.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -63.06 -35.33 79.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -68.7 -43.44 76.03 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 175.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -58.42 -40.99 83.97 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 121.663 -0.648 . . . . 0.0 110.539 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.65 -43.4 84.72 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 122.233 -0.292 . . . . 0.0 110.777 -178.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -64.64 -47.5 78.3 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.338 0.59 . . . . 0.0 110.017 179.146 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -59.14 -49.41 77.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.955 179.353 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.1 p -72.91 -32.34 39.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.685 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.0 -40.16 94.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 118.984 0.811 . . . . 0.0 111.036 -178.074 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -61.16 -35.3 76.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.232 -178.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.08 -50.46 19.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 178.371 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -71.08 -30.35 66.45 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -172.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -56.87 -29.65 63.13 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.613 0.642 . . . . 0.0 110.5 177.24 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.63 -21.19 66.55 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 mp -82.73 -12.35 57.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.912 0.387 . . . . 0.0 110.255 178.592 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.18 11.04 66.74 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.224 -0.513 . . . . 0.0 113.459 -178.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -67.26 136.94 55.71 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.258 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -63.18 -35.69 81.15 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -174.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.1 ptt85 -153.25 156.55 38.69 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 174.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -115.85 154.31 29.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.982 0.513 . . . . 0.0 111.451 -177.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -136.51 125.37 24.1 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 167.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.59 145.02 42.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.662 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.4 tp -108.64 121.28 44.69 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 172.486 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -115.86 108.69 16.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.035 0.38 . . . . 0.0 110.254 -178.641 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -104.94 107.71 23.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 111.997 -176.433 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -77.17 147.94 36.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.176 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -127.14 114.95 18.38 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 171.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -133.55 160.15 38.31 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.34 0.656 . . . . 0.0 109.978 -173.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -75.97 -50.14 15.73 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.572 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -124.26 158.39 32.63 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 106.553 -1.647 . . . . 0.0 106.553 -176.231 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.36 150.11 56.63 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 177.229 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -58.2 146.61 87.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 118.152 -0.766 . . . . 0.0 113.353 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.56 -12.43 15.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 115.808 1.781 . . . . 0.0 115.808 -174.035 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -133.34 137.84 46.1 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 121.947 -0.471 . . . . 0.0 112.21 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.9 t0 14.57 59.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 119.087 2.995 . . . . 0.0 119.087 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 22.7 p-90 -87.43 -24.1 24.29 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 121.133 -0.98 . . . . 0.0 109.73 178.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -64.17 -35.4 80.67 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 121.392 -0.818 . . . . 0.0 112.905 -174.446 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.8 -20.84 61.08 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.223 178.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.7 mm -70.41 -39.09 76.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.557 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.542 0.687 . . . . 0.0 111.153 -179.591 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -89.1 1.17 55.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.174 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -103.31 101.15 11.07 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.8 m -70.19 123.25 21.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 173.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -84.22 123.3 29.97 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 178.001 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.82 127.96 48.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.795 0.807 . . . . 0.0 109.302 179.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -145.5 122.12 11.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.229 -178.746 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.21 -112.95 5.42 Favored Glycine 0 C--O 1.226 -0.405 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 75.7 p -105.01 -2.9 23.89 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 178.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.0 t -96.84 139.47 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 76.3 p -119.69 140.15 51.11 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.631 -2.359 . . . . 0.0 104.631 168.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.32 130.96 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.795 0 CA-C-O 121.984 0.897 . . . . 0.0 110.044 179.106 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -100.59 109.46 57.45 Favored Pre-proline 0 N--CA 1.427 -1.624 0 CA-C-N 113.632 -1.622 . . . . 0.0 109.384 -179.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.5 154.61 21.16 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 117.894 -0.937 . . . . 0.0 112.085 178.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.89 151.95 30.96 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 175.553 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.7 tt -145.69 132.71 15.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.777 0.799 . . . . 0.0 110.489 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 99.2 t -104.72 126.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 175.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.89 142.91 43.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 104.511 -2.403 . . . . 0.0 104.511 176.329 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.5 -20.64 59.27 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.531 -0.366 . . . . 0.0 113.926 -175.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 55.6 p -62.49 -27.82 69.4 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.261 0.838 . . . . 0.0 113.261 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 19.5 ptp -146.9 44.46 1.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.71 1.243 . . . . 0.0 107.714 178.231 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tp -42.79 -50.41 5.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.606 -1.634 . . . . 0.0 114.777 -175.473 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -66.99 -36.23 81.7 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.63 -38.77 64.93 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.876 0.47 . . . . 0.0 110.347 -175.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -68.77 -38.97 80.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 176.128 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -59.39 -50.18 74.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.439 -177.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -71.92 -14.54 61.96 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.58 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.64 -37.26 50.39 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 122.061 -0.399 . . . . 0.0 109.957 177.123 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.7 p -90.28 -36.99 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -128.67 76.13 79.04 Favored Pre-proline 0 C--N 1.326 -0.44 0 C-N-CA 122.613 0.365 . . . . 0.0 110.657 178.205 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.02 -14.68 41.7 Favored 'Trans proline' 0 C--N 1.349 0.596 0 CA-C-O 121.1 0.375 . . . . 0.0 112.904 178.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -76.47 -8.98 58.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.798 177.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -72.39 138.54 47.28 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.548 0 CA-C-O 121.738 0.78 . . . . 0.0 112.254 -179.398 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 . . . . . 0 C--O 1.217 -0.648 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.06 88.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.03 0.443 . . . . 0.0 110.681 177.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.9 tm0? -68.53 -49.81 56.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.5 mtt -64.92 -29.74 70.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -178.308 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.92 -33.24 64.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.518 0.192 . . . . 0.0 111.518 -179.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -63.98 -47.43 80.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-O 120.959 0.409 . . . . 0.0 109.925 177.878 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -68.18 -38.95 82.57 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.213 0.53 . . . . 0.0 110.573 -177.496 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -66.11 -38.17 87.53 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.153 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -63.9 -44.04 94.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.872 0.368 . . . . 0.0 111.207 176.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.18 -33.29 75.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.991 0.425 . . . . 0.0 110.452 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -76.06 -35.77 59.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.576 0.703 . . . . 0.0 110.954 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.2 tt -65.63 -41.23 92.89 Favored 'General case' 0 C--O 1.218 -0.58 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.655 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.5 p -58.08 -39.5 72.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.149 -0.621 . . . . 0.0 111.248 -176.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.0 tm? . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.15 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 N--CA 1.464 0.264 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.8 tp -57.61 -43.7 84.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.064 0.459 . . . . 0.0 110.886 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.99 -29.82 70.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.336 -179.61 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -59.56 -55.65 31.86 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 179.785 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.9 m -60.41 -40.68 91.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.164 0.507 . . . . 0.0 111.561 -178.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -56.85 -43.55 81.27 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 178.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -78.84 -35.15 44.44 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 123.086 1.422 . . . . 0.0 109.151 -177.236 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -64.91 -39.11 93.02 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 113.131 -1.85 . . . . 0.0 111.798 -176.912 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 26.0 mm -70.23 -37.68 72.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.17 -42.54 91.03 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.318 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.19 -41.89 94.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 177.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -58.27 -46.71 85.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -67.85 -49.42 62.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.21 -43.01 88.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.052 -177.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -11.28 60.86 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.73 -0.606 . . . . 0.0 112.478 -179.028 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.9 m -95.49 6.79 48.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.7 -1.2 52.51 Favored Glycine 0 C--O 1.228 -0.247 0 N-CA-C 115.989 1.156 . . . . 0.0 115.989 176.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.03 118.85 11.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 118.519 1.159 . . . . 0.0 109.103 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.66 127.52 16.31 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 108.772 -1.731 . . . . 0.0 108.772 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.48 130.51 35.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.539 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.39 -41.41 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.244 -176.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -140.71 140.24 34.86 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 103.881 -2.637 . . . . 0.0 103.881 178.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.41 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.206 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.97 158.63 28.67 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.2 mt -138.33 127.42 32.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.515 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.51 132.47 55.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -127.62 131.85 49.84 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 123.542 0.526 . . . . 0.0 109.684 -178.421 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -84.15 134.48 34.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 114.97 34.88 Favored Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.389 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -73.61 -28.07 12.21 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 117.239 -1.374 . . . . 0.0 114.157 -174.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -9.88 59.25 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 122.171 -0.331 . . . . 0.0 111.461 -179.502 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.7 mtmm 62.2 39.68 12.44 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 -175.176 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -177.71 0.63 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 111.519 -2.582 . . . . 0.0 115.726 -176.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -44.99 -28.09 0.63 Allowed 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 177.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -114.51 141.43 47.72 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 174.053 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.06 -36.85 55.62 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -178.739 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.7 mt -140.65 163.02 33.99 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 87.0 t -128.19 136.56 59.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 105.213 -2.144 . . . . 0.0 105.213 174.569 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -123.48 129.19 50.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.881 0.372 . . . . 0.0 110.23 179.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.4 mt -109.87 120.86 43.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 176.407 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -136.45 132.85 35.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 117.95 0.341 . . . . 0.0 110.289 -176.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -106.96 118.79 37.62 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.212 0.529 . . . . 0.0 110.41 179.518 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -151.55 150.18 30.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -86.05 143.27 28.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.9 mt -143.69 103.58 4.09 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -79.62 -38.41 33.89 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 121.769 0.795 . . . . 0.0 111.99 -178.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.1 152.77 48.33 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.952 -0.468 . . . . 0.0 110.116 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -64.02 -20.9 66.24 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.7 -33.49 76.08 Favored 'General case' 0 C--O 1.213 -0.863 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.875 179.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.07 -32.28 64.92 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' MET . . . . . 0.426 ' HE3' ' CE3' ' A' ' 96' ' ' TRP . 28.6 ttm -66.23 -51.02 61.64 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.448 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.4 m -61.91 -34.55 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 118.82 0.736 . . . . 0.0 111.291 178.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -64.71 -38.25 90.34 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 120.752 0.311 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.75 -44.07 94.0 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.3 mm -66.14 -31.15 52.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.54 -0.464 . . . . 0.0 112.13 -177.474 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.14 -39.77 94.72 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 177.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -68.52 -44.9 73.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.145 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -57.97 -44.17 86.91 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.87 -43.85 90.94 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 111.477 0.177 . . . . 0.0 111.477 -176.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.08 -36.26 77.41 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.88 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -64.21 -45.74 86.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.548 177.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.69 -37.87 81.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.648 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -61.6 -41.65 97.74 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 122.211 -0.306 . . . . 0.0 110.643 178.76 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.8 mtt85 -62.98 -44.72 95.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.426 179.139 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.24 -40.81 90.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.461 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.2 OUTLIER -68.0 -40.54 83.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.249 -0.907 . . . . 0.0 111.619 179.659 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -60.16 -35.96 76.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.926 0.393 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -60.75 -31.11 70.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -179.241 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.81 9.06 10.62 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -177.348 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.09 5.67 21.43 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 121.472 3.349 . . . . 0.0 121.472 171.274 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.44 146.61 53.83 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.877 1.839 . . . . 0.0 107.44 178.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.8 tpt85 -62.31 -42.67 99.56 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -174.596 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -147.39 152.31 37.95 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 118.918 0.781 . . . . 0.0 110.307 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' MET . . . . . 0.426 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -100.4 163.83 12.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.37 123.08 12.58 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.775 -3.787 . . . . 0.0 100.775 174.746 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.41 114.27 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.879 0.763 . . . . 0.0 111.803 -173.777 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 62.2 tp -81.46 117.26 21.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.011 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -111.47 109.52 19.51 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.28 112.18 35.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 120.866 0.365 . . . . 0.0 111.955 -176.483 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -85.76 117.78 24.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.11 177.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -94.23 111.44 23.18 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 174.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.2 p -122.16 155.19 36.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.83 0.348 . . . . 0.0 111.111 -176.038 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 16.4 m -67.24 -48.41 67.86 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 176.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -148.72 159.81 43.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 -177.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.09 159.12 40.45 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.717 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.34 147.84 65.0 Favored 'Trans proline' 0 C--N 1.351 0.699 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 179.151 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.2 m -84.44 -5.24 9.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.4 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -115.03 97.11 6.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.649 0.38 . . . . 0.0 111.316 -177.325 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 14.55 64.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 117.9 2.555 . . . . 0.0 117.9 176.506 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.426 ' CE3' ' HE3' ' A' ' 57' ' ' MET . 54.8 p-90 -83.57 -16.74 44.21 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 112.34 -178.821 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -37.06 71.54 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -173.957 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -66.06 -23.95 66.63 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.644 -0.66 . . . . 0.0 111.686 178.533 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.1 mm -67.07 -37.3 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -176.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.99 -22.9 64.95 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -92.04 3.27 55.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.217 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -102.72 98.45 8.47 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 122.033 -0.417 . . . . 0.0 111.63 -178.23 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.6 m -68.04 126.54 29.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 174.251 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -82.72 109.03 16.53 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -111.07 114.43 27.7 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.327 -176.226 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -134.57 80.48 1.85 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.609 -177.774 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.13 -108.48 2.49 Favored Glycine 0 CA--C 1.517 0.185 0 C-N-CA 118.902 -1.618 . . . . 0.0 112.747 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.0 p -86.92 11.59 13.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.221 0.608 . . . . 0.0 111.062 179.489 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 92.6 t -120.68 141.06 42.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -176.317 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.8 t -141.23 127.4 19.63 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 104.45 -2.426 . . . . 0.0 104.45 169.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.1 t -133.64 123.49 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -102.89 115.8 63.59 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.046 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -79.86 157.58 24.21 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 116.033 -2.178 . . . . 0.0 112.975 179.257 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.78 151.83 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.615 -2.735 . . . . 0.0 103.615 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.1 tt -146.18 142.68 21.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.1 m -124.34 138.19 54.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 104.478 -2.415 . . . . 0.0 104.478 174.373 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.38 142.35 43.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 178.569 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.86 -19.48 61.02 Favored Glycine 0 C--N 1.323 -0.194 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.806 -176.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.1 p -63.9 -33.38 75.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -178.012 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.4 ptm -138.33 36.63 2.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.738 1.256 . . . . 0.0 108.54 -178.74 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 20.4 tp -49.87 -36.53 27.39 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 -173.238 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.64 -48.2 78.2 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.706 -0.621 . . . . 0.0 110.862 -178.111 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.87 -34.17 66.54 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.294 -177.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.79 -42.64 81.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.961 178.264 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.7 -48.6 81.05 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.703 -177.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -68.85 -13.78 62.62 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.529 -177.201 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.05 -32.48 50.91 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.171 -0.33 . . . . 0.0 110.66 176.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 6.9 p -95.63 -38.19 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 120.887 0.375 . . . . 0.0 111.078 178.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -126.87 76.12 75.55 Favored Pre-proline 0 C--N 1.325 -0.495 0 C-N-CA 122.475 0.31 . . . . 0.0 110.534 178.53 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -13.98 39.59 Favored 'Trans proline' 0 C--N 1.347 0.493 0 CA-C-O 121.195 0.415 . . . . 0.0 112.412 178.443 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.4 m -69.87 -13.71 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.3 177.07 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -105.65 127.88 53.32 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.07 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 . . . . . 0 C--N 1.324 -0.507 0 CA-C-O 121.167 0.508 . . . . 0.0 112.242 -179.478 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 . . . . . 0 C--O 1.216 -0.659 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.29 80.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.979 0.419 . . . . 0.0 110.293 178.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -74.26 -45.88 45.03 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 20.2 mmt -59.14 -31.4 68.93 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.339 179.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.2 81.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 122.244 -0.285 . . . . 0.0 111.147 179.453 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -67.85 -47.39 69.08 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.22 -42.86 99.68 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 -176.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.39 -34.44 74.53 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.635 178.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -66.35 -45.45 80.14 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.075 0.398 . . . . 0.0 110.13 176.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.18 -39.72 93.63 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 40.1 m -67.02 -37.47 84.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.675 177.223 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.14 -38.83 91.87 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.278 -179.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.3 t -57.75 -47.96 84.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.462 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 C--N 1.325 -0.46 0 O-C-N 121.808 -0.558 . . . . 0.0 110.342 179.928 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.02 -35.28 78.02 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.332 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.64 -33.03 74.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -176.275 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -60.38 -48.59 81.09 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.0 m -68.84 -40.11 79.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.046 0.45 . . . . 0.0 111.198 179.362 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -54.44 -52.23 62.45 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -70.14 -27.01 64.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.604 -0.685 . . . . 0.0 111.339 -179.885 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -68.51 -36.75 79.32 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.796 -0.565 . . . . 0.0 110.23 176.452 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.488 ' HA ' ' HD1' ' A' ' 14' ' ' HIS . 21.8 mm -67.0 -45.09 87.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 177.421 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.34 77.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.221 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.5 99.28 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . 0.488 ' HD1' ' HA ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -68.79 -35.71 77.37 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.889 -178.308 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -69.72 -47.25 63.78 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.62 -41.59 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.168 177.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -75.05 -6.65 50.58 Favored 'General case' 0 C--O 1.217 -0.618 0 O-C-N 121.026 -1.046 . . . . 0.0 112.34 179.45 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.3 m -92.6 10.3 31.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 173.583 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.62 -3.55 56.25 Favored Glycine 0 C--N 1.329 0.167 0 N-CA-C 116.147 1.219 . . . . 0.0 116.147 175.716 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -67.53 125.23 25.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.649 0.724 . . . . 0.0 110.246 -179.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.71 131.24 10.29 Favored Glycine 0 C--O 1.225 -0.437 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.135 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.6 t -73.55 126.69 34.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 179.334 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.8 mt -92.72 -43.12 13.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 177.305 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -149.16 121.03 8.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.607 -176.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.617 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 171.501 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.69 129.72 20.75 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -177.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 89.1 mt -135.89 131.78 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.077 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.8 m95 -109.17 138.74 45.06 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.046 0.45 . . . . 0.0 110.882 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mp -132.57 137.97 47.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.131 0.972 . . . . 0.0 109.963 -178.31 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -86.57 133.92 33.68 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.375 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 119.76 77.93 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 103.393 -2.818 . . . . 0.0 103.393 174.964 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.55 -23.32 27.32 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 116.356 -1.962 . . . . 0.0 112.807 -173.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -71.35 -34.82 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 179.632 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 58.05 41.08 24.66 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.818 1.771 . . . . 0.0 108.652 -169.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -75.12 -172.78 1.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 110.939 -2.846 . . . . 0.0 105.681 172.816 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.2 m -41.22 -27.79 0.08 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -108.58 133.84 52.16 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.085 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -87.69 -44.73 10.96 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.185 0.516 . . . . 0.0 111.152 -178.224 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.2 mt -137.07 160.64 38.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.674 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.1 t -130.7 135.61 59.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 177.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 135.66 52.54 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 174.588 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -106.04 130.21 54.0 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 -179.591 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -130.27 124.74 33.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.846 0.355 . . . . 0.0 111.54 -176.823 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -103.3 94.52 5.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -149.36 133.85 17.58 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -175.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -78.28 144.64 35.95 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.739 -1.119 . . . . 0.0 108.439 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -135.93 110.05 8.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -81.42 -39.66 24.58 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.661 0.743 . . . . 0.0 111.4 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -127.0 149.78 49.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.567 -178.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -66.29 -18.86 65.6 Favored 'General case' 0 CA--C 1.504 -0.803 0 O-C-N 122.341 -0.225 . . . . 0.0 111.378 -178.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -62.99 -33.42 75.37 Favored 'General case' 0 C--O 1.211 -0.97 0 C-N-CA 119.616 -0.834 . . . . 0.0 108.874 178.054 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.36 -38.26 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.964 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.5 ttm -59.8 -51.18 70.83 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.802 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 15.1 m -64.55 -31.83 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-O 121.166 0.508 . . . . 0.0 111.496 -178.112 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -70.06 -41.47 74.12 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.55 -177.64 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -58.57 -41.99 86.94 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.9 mm -70.07 -33.69 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 119.776 -0.769 . . . . 0.0 111.788 -178.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -31.05 69.98 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.763 -178.772 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -45.33 58.77 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 175.15 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -57.49 -35.05 69.7 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.176 179.525 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.72 -34.48 74.45 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 122.354 -0.216 . . . . 0.0 111.261 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -69.91 -38.97 76.42 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -61.59 -43.43 98.88 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.679 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.98 -44.24 96.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 179.41 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.41 -46.06 87.2 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm105 -61.33 -42.3 98.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -177.719 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.3 -38.54 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.695 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -30.21 70.1 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.151 -0.968 . . . . 0.0 111.533 -177.959 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -40.24 78.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.759 0.314 . . . . 0.0 110.415 179.354 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -67.18 -39.38 86.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.917 -178.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.11 -8.13 59.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.892 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.38 19.44 68.6 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 114.029 0.372 . . . . 0.0 114.029 179.787 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.2 mtp85 -67.39 141.23 57.13 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 121.761 -0.846 . . . . 0.0 111.936 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.35 -35.14 78.77 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 178.002 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -155.72 147.56 23.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -122.45 139.91 53.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 178.104 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -113.46 121.39 44.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.92 0.39 . . . . 0.0 111.033 177.703 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -110.95 130.54 55.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.363 -178.121 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -93.05 121.13 34.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.607 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -115.89 128.33 55.71 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.4 t -125.45 113.87 37.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.969 0.414 . . . . 0.0 110.676 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -80.05 146.21 32.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.056 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -123.85 111.85 16.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 173.209 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 46.3 t -135.41 161.08 36.44 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -75.17 -29.06 60.32 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.799 -0.563 . . . . 0.0 110.042 -177.615 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -152.76 167.35 29.3 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.73 160.76 27.09 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -55.24 149.77 43.64 Favored 'Trans proline' 0 C--N 1.35 0.626 0 N-CA-C 115.609 1.35 . . . . 0.0 115.609 -179.339 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -76.27 -15.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -176.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -119.2 98.44 6.16 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 116.118 1.896 . . . . 0.0 116.118 -175.087 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 45.42 29.1 0.55 Allowed 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 118.549 2.796 . . . . 0.0 118.549 170.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -61.73 -22.25 65.22 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 121.089 -1.007 . . . . 0.0 111.283 178.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.69 -31.42 72.31 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 121.839 -0.538 . . . . 0.0 111.01 -178.026 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.47 -35.56 76.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.8 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.58 -40.06 83.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -176.627 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.68 -15.85 63.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.56 0.56 50.24 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 122.054 -0.404 . . . . 0.0 110.912 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -123.8 116.01 22.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.791 0.805 . . . . 0.0 111.466 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.1 m -68.19 128.3 36.06 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 176.19 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -82.74 107.81 15.65 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -178.32 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -117.11 137.63 52.17 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.894 0.854 . . . . 0.0 111.926 -176.312 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -137.21 75.29 1.52 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 177.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.42 -111.09 3.9 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 119.491 -1.338 . . . . 0.0 112.221 178.767 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.5 p -73.43 8.9 1.53 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.547 1.139 . . . . 0.0 113.39 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 67.6 t -127.82 143.79 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 C-N-CA 122.793 0.437 . . . . 0.0 111.307 -177.687 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.8 p -143.62 131.32 21.33 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 171.56 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.0 t -136.77 138.9 45.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 122.178 -0.326 . . . . 0.0 110.284 -179.033 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.25 122.62 53.45 Favored Pre-proline 0 CA--C 1.535 0.381 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.672 175.557 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -83.31 65.28 7.73 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 121.829 1.686 . . . . 0.0 113.708 178.151 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -79.26 153.69 29.72 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 tt -149.37 143.23 18.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.5 t -116.41 112.31 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 173.222 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.414 ' HE ' ' CG ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -94.52 136.18 35.12 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.353 0.597 . . . . 0.0 109.7 178.995 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.94 -37.82 93.22 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -176.699 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.5 t -57.04 -17.77 11.44 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.298 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -146.48 31.97 0.98 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tt -46.71 -40.09 12.73 Favored 'General case' 0 C--O 1.209 -1.073 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -173.496 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -59.24 -50.23 74.81 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.985 -176.756 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -73.76 -39.45 64.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.1 0.953 . . . . 0.0 111.817 179.168 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . 0.414 ' CG ' ' HE ' ' A' ' 117' ' ' ARG . 1.8 t0 -67.11 -35.23 79.3 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.73 0.776 . . . . 0.0 112.136 -176.454 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.23 -43.34 74.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.105 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -69.92 -16.96 63.3 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.92 -175.954 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.25 -25.73 61.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.905 0.383 . . . . 0.0 110.294 177.356 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.06 -41.5 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.203 0.525 . . . . 0.0 110.545 179.735 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -127.05 75.91 76.37 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 123.113 0.565 . . . . 0.0 111.434 -178.635 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.91 -17.49 41.49 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.759 1.023 . . . . 0.0 114.759 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.1 m -85.61 0.99 51.02 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -179.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -72.48 134.72 45.46 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.646 0.736 . . . . 0.0 112.877 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 . . . . . 0 CA--C 1.513 -0.442 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.902 177.674 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.238 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.34 -38.22 90.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -42.8 95.07 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.656 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 80.9 mtp -64.2 -28.94 70.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 178.397 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.39 69.38 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.59 -0.694 . . . . 0.0 110.373 178.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -68.85 -46.43 68.55 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.06 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.81 -40.95 97.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.764 0.792 . . . . 0.0 109.579 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 58.9 ttt85 -59.14 -45.49 90.81 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.387 176.77 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.21 -41.44 85.79 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.583 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.65 -39.13 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.332 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.1 m -69.58 -38.44 77.37 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.445 176.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.69 -49.07 74.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.863 -178.355 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.1 p -62.43 -38.91 82.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 118.343 0.52 . . . . 0.0 110.809 -177.371 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? . . . . . 0 C--N 1.326 -0.419 0 C-N-CA 119.857 -0.737 . . . . 0.0 110.028 179.772 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 72.4 mt . . . . . 0 N--CA 1.47 0.549 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.72 -40.39 92.12 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 114.508 -1.224 . . . . 0.0 110.328 177.247 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -67.84 -38.42 83.17 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.071 0.548 . . . . 0.0 109.988 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -60.27 -46.63 89.14 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.7 m -68.01 -40.71 82.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.511 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -55.55 -52.14 64.72 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.497 0.719 . . . . 0.0 111.907 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.33 -28.35 67.07 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.661 -0.649 . . . . 0.0 111.571 -178.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp -69.71 -38.2 76.84 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.906 -0.496 . . . . 0.0 109.684 176.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.4 mm -62.48 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 177.357 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.85 -41.91 75.04 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.132 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.32 96.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 178.518 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -62.84 -45.69 91.41 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.259 -178.874 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.84 -46.92 76.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.277 -176.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.4 t -57.38 -43.43 82.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.511 0.672 . . . . 0.0 109.537 178.798 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -78.88 3.75 16.05 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -178.04 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 60.6 m -107.58 11.21 28.85 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.645 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.24 7.06 62.49 Favored Glycine 0 CA--C 1.516 0.148 0 N-CA-C 115.528 0.971 . . . . 0.0 115.528 177.499 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -69.91 129.65 40.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.382 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.77 133.31 15.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 109.139 -1.585 . . . . 0.0 109.139 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -84.44 115.66 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 117.83 0.815 . . . . 0.0 108.999 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 73.9 mt -90.19 -44.54 14.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 178.237 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -149.86 132.43 15.78 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.514 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 172.395 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 . . . . . 0 C--O 1.215 -0.724 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -151.05 124.91 9.15 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 175.181 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -124.65 120.61 59.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 169.131 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -107.28 121.79 45.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -178.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -120.47 128.94 53.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.1 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -84.67 126.13 33.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.24 178.443 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.56 135.32 95.71 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -178.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.82 -24.85 20.82 Favored 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 115.903 -2.265 . . . . 0.0 112.641 178.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -74.94 -29.6 60.99 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.073 0.549 . . . . 0.0 112.124 179.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.0 mttm 57.04 39.69 29.09 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.188 0.994 . . . . 0.0 112.641 178.701 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.24 -177.61 0.3 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 113.892 -1.504 . . . . 0.0 110.474 176.322 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -51.87 -34.02 39.11 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 175.306 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -90.63 112.12 23.72 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 103.495 -2.78 . . . . 0.0 103.495 170.069 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -105.49 -35.14 7.57 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.12 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -127.43 154.99 44.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 122.046 -0.409 . . . . 0.0 111.81 -175.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.7 p -131.79 137.57 54.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 175.406 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.48 114.19 22.48 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 175.404 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tp -79.37 132.71 36.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -136.46 150.52 48.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -174.745 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -125.76 110.5 13.8 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -151.74 150.32 30.06 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 178.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -114.09 134.79 54.64 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 177.601 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.25 134.35 55.18 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -175.312 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -84.21 -36.58 22.67 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.678 0.752 . . . . 0.0 110.912 176.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -135.61 164.63 27.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.476 -176.619 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.4 ptt-85 -64.38 -22.75 67.06 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.787 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -67.72 -33.15 74.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.007 -177.237 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -65.75 -41.32 92.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 175.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.9 ttm -62.22 -51.88 66.01 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.828 -179.407 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.9 m -60.87 -31.85 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.813 0.733 . . . . 0.0 111.099 -178.133 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -68.6 -38.71 80.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.283 -178.02 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -65.77 -35.71 81.48 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.276 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.4 mm -67.27 -34.67 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.864 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.25 -29.09 67.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.481 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -69.75 -42.82 73.37 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.164 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -57.73 -39.7 77.91 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.411 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -37.12 79.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.591 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.49 -44.96 89.33 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -60.96 -43.09 99.24 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.404 179.09 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.65 -31.25 51.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 122.038 -0.414 . . . . 0.0 110.399 -179.05 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.76 -33.55 75.39 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 121.513 -0.742 . . . . 0.0 109.476 175.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -72.4 -46.89 53.18 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 174.096 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.96 -47.29 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.91 -30.25 67.67 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.815 -0.553 . . . . 0.0 110.804 -179.237 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -73.58 -39.99 64.24 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.111 -0.368 . . . . 0.0 110.636 176.678 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.41 -48.6 72.26 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.13 5.7 49.78 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.351 0.596 . . . . 0.0 112.124 -178.764 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.55 -3.08 6.58 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 119.297 2.479 . . . . 0.0 119.297 173.331 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.4 mtp180 -64.24 132.87 51.56 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.144 1.472 . . . . 0.0 108.767 -178.807 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -64.71 -24.34 67.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -147.0 148.89 32.16 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.094 -2.928 . . . . 0.0 103.094 178.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 8.9 mmm -136.77 148.48 47.25 Favored 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.47 0.481 . . . . 0.0 111.155 -176.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -126.61 133.94 50.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 171.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -126.84 133.76 50.67 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.525 0.73 . . . . 0.0 109.039 -176.075 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.9 tp -94.66 126.26 39.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -116.5 108.7 16.33 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.1 t -105.83 114.87 46.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.237 -176.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -83.3 156.08 23.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 176.62 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -128.18 111.48 13.48 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 172.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.9 m -130.11 158.72 38.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.576 0.547 . . . . 0.0 111.453 -173.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.9 m -67.06 -47.3 71.7 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.71 0.767 . . . . 0.0 109.051 -179.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -148.48 174.39 12.13 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.012 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.55 145.32 29.73 Favored Pre-proline 0 C--N 1.313 -0.992 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.798 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 146.25 97.48 Favored 'Trans proline' 0 C--N 1.346 0.43 0 O-C-N 122.246 0.603 . . . . 0.0 112.759 176.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.9 m -81.8 -21.61 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -86.68 83.3 7.62 Favored 'General case' 0 C--O 1.216 -0.667 0 O-C-N 121.986 -0.446 . . . . 0.0 110.906 -177.618 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 t0 14.81 78.9 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 116.996 2.221 . . . . 0.0 116.996 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -90.08 -13.63 35.45 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.326 -1.306 . . . . 0.0 109.995 177.752 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -65.49 -31.3 72.3 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 107.535 -1.284 . . . . 0.0 107.535 -179.133 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 tp10 -59.24 -34.76 72.6 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 173.835 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.0 mm -71.2 -40.09 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.847 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.91 -22.2 65.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 111.256 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -87.97 0.47 55.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -125.99 130.27 50.87 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.953 0.882 . . . . 0.0 113.064 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.0 m -74.37 128.88 36.66 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 173.766 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -82.91 124.29 30.21 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.38 129.09 45.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.624 0.726 . . . . 0.0 109.537 178.959 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -143.1 122.74 13.29 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.5 179.868 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.09 -112.7 5.21 Favored Glycine 0 C--O 1.225 -0.418 0 N-CA-C 108.8 -1.72 . . . . 0.0 108.8 -178.813 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 9.7 t -122.87 22.67 9.62 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-O 121.722 0.772 . . . . 0.0 109.641 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.24 156.72 5.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.521 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.5 t -138.51 127.96 24.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 103.657 -2.72 . . . . 0.0 103.657 178.114 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.98 136.5 58.72 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-O 122.296 1.046 . . . . 0.0 109.223 179.12 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -112.3 114.96 50.32 Favored Pre-proline 0 N--CA 1.429 -1.5 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.939 -177.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -79.56 151.69 22.56 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 116.701 -1.733 . . . . 0.0 112.204 178.269 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 149.74 29.85 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 102.639 -3.097 . . . . 0.0 102.639 174.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 tt -149.43 122.29 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 118.431 0.559 . . . . 0.0 109.63 -176.732 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.7 t -95.32 110.36 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 177.704 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.63 136.23 37.44 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 178.778 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.43 -25.46 57.91 Favored Glycine 0 C--O 1.229 -0.211 0 CA-C-N 116.359 -0.382 . . . . 0.0 113.99 -177.396 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -58.0 -30.4 66.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -139.19 25.14 2.49 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.315 0.579 . . . . 0.0 110.292 -177.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.5 tt -44.41 -37.63 3.53 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -174.541 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -56.93 -49.36 75.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.845 0.748 . . . . 0.0 111.772 -178.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -78.66 -39.24 37.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 122.362 1.077 . . . . 0.0 111.141 178.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -63.35 -38.14 90.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.776 -175.268 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.59 -48.36 69.81 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.006 -0.434 . . . . 0.0 110.18 -178.628 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -69.35 -17.04 63.66 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.961 -176.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.87 62.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.695 -0.23 . . . . 0.0 110.929 178.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 p -109.06 -37.32 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 120.794 0.33 . . . . 0.0 111.137 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.38 80.5 72.04 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 121.954 -0.466 . . . . 0.0 111.247 178.963 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -71.29 0.29 6.98 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 114.294 0.844 . . . . 0.0 114.294 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 42.8 p -82.4 -2.63 53.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.166 0.508 . . . . 0.0 110.942 177.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -70.5 120.57 16.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.442 0.639 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.9 ttt85 . . . . . 0 C--N 1.323 -0.55 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.352 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 C--O 1.224 -0.288 0 CA-C-O 120.372 0.13 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.47 -43.74 71.96 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.12 -31.33 65.92 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.698 -179.395 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 76.6 mtp -70.51 -28.93 65.34 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.733 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.01 72.05 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.872 -0.517 . . . . 0.0 110.241 177.556 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -67.07 -44.67 79.52 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -65.06 -40.24 94.41 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.763 0.792 . . . . 0.0 109.57 -178.98 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -58.85 -44.62 91.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.195 177.295 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -68.35 -43.33 77.7 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 178.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.3 mt -63.28 -34.88 78.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.865 0.364 . . . . 0.0 110.042 -179.367 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 26.2 m -72.72 -38.57 67.43 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.516 0.674 . . . . 0.0 110.166 175.526 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.6 tt -64.75 -39.11 93.07 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.121 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.88 -42.93 90.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 119.056 0.843 . . . . 0.0 111.561 -177.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 C--O 1.217 -0.62 0 O-C-N 121.372 -0.83 . . . . 0.0 108.861 178.323 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 C--O 1.218 -0.572 0 CA-C-O 120.888 0.375 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 78.0 mt -53.74 -35.23 60.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 179.091 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -61.34 -28.89 69.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.662 0.268 . . . . 0.0 110.734 -178.215 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -60.31 -55.1 37.81 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -41.34 68.69 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.921 -179.484 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -56.23 -55.76 29.24 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -177.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -69.83 -30.85 68.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -176.747 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -75.43 -25.76 57.76 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.183 -1.007 . . . . 0.0 112.038 178.158 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mm -73.13 -39.13 56.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 174.686 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.64 85.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.043 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.68 80.68 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.472 177.45 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -57.09 -43.88 82.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.582 -179.407 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -65.2 -44.71 87.52 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 0.0 110.133 179.177 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.91 -40.06 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.711 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -66.06 -29.17 69.46 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.636 -0.665 . . . . 0.0 110.346 179.492 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t -76.07 3.71 9.91 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.637 0.375 . . . . 0.0 111.574 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.28 -0.15 59.96 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 115.138 0.815 . . . . 0.0 115.138 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -67.22 125.77 27.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.044 0.922 . . . . 0.0 109.131 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.53 124.46 8.11 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.519 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -75.8 124.52 34.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.098 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.8 mt -90.06 -41.52 13.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -177.447 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -147.82 123.34 10.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.542 -177.475 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 174.198 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 C--O 1.225 -0.214 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.12 138.36 31.58 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 117.937 0.335 . . . . 0.0 110.567 178.687 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -140.12 132.7 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 176.624 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -109.03 135.33 50.37 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 178.602 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -129.43 137.21 50.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 124.067 0.947 . . . . 0.0 109.19 -176.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -101.24 137.3 39.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 176.911 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.05 106.42 7.91 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.836 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.45 -28.57 26.57 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 117.049 -1.501 . . . . 0.0 114.646 -176.362 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -78.01 -1.81 34.02 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.579 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.7 mtmt 58.28 43.31 20.38 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.1 m -64.56 -177.63 0.33 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.328 -1.76 . . . . 0.0 113.098 -178.651 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -41.43 -26.98 0.07 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 178.178 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -130.17 135.69 48.45 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -70.41 -37.7 74.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.412 0.625 . . . . 0.0 110.858 -178.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.9 mt -137.68 157.37 46.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.003 -177.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.44 137.18 53.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 176.682 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.03 135.95 49.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 173.118 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -102.1 132.88 47.71 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 179.338 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.35 115.78 12.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -179.187 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -86.8 96.37 10.17 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.881 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -147.34 128.79 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.663 0.744 . . . . 0.0 111.67 -176.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.13 147.25 36.68 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 125.081 1.352 . . . . 0.0 108.769 175.263 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.6 mt -143.8 118.2 9.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -177.282 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -87.43 -43.73 11.86 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 122.077 0.942 . . . . 0.0 111.467 -179.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -127.34 148.76 50.25 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.04 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -65.05 -16.0 62.97 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.307 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -63.05 -33.55 75.67 Favored 'General case' 0 C--O 1.216 -0.68 0 C-N-CA 119.702 -0.799 . . . . 0.0 109.675 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -77.57 -31.86 53.41 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 121.602 -0.687 . . . . 0.0 109.883 176.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.8 ttt -62.44 -51.84 65.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.372 178.008 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.8 m -61.07 -36.3 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-O 120.718 0.294 . . . . 0.0 111.59 179.849 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.5 -38.44 89.89 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.169 -177.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -59.47 -45.18 92.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.212 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mp -73.16 -34.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.753 -0.592 . . . . 0.0 111.534 -178.318 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -59.23 -35.8 74.3 Favored 'General case' 0 C--O 1.244 0.803 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -45.64 29.99 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.657 178.825 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -55.2 -41.51 72.07 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.285 179.346 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.5 73.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 122.201 -0.312 . . . . 0.0 111.705 -178.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -73.16 -36.09 66.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.742 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -44.76 95.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 175.852 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.61 -36.04 72.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -60.42 -40.18 90.08 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.321 -0.862 . . . . 0.0 109.68 176.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -67.64 -33.64 75.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.486 178.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.2 t -73.87 -47.97 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 122.299 -0.251 . . . . 0.0 111.431 177.678 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -62.22 -30.36 71.03 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.618 -0.677 . . . . 0.0 111.781 -177.912 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -59.46 -45.62 91.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -73.3 -42.39 62.46 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 179.563 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.3 mp -78.35 -18.08 55.63 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 -175.256 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.34 9.25 60.68 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 116.751 1.46 . . . . 0.0 116.751 177.176 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -69.99 141.68 52.92 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.202 1.001 . . . . 0.0 109.03 -178.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.19 -34.73 77.0 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -174.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -144.37 161.86 37.92 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 101.837 -3.394 . . . . 0.0 101.837 176.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.3 mmm -135.69 112.54 10.22 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 123.552 0.533 . . . . 0.0 109.799 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -93.72 132.25 38.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.855 177.484 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -128.06 121.83 30.63 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.6 tp -89.52 121.61 31.9 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.469 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -112.04 113.29 25.49 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.0 t -112.76 106.27 20.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-O 121.253 0.549 . . . . 0.0 111.301 -178.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -74.6 152.06 39.3 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -128.48 109.01 11.01 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.436 -1.69 . . . . 0.0 106.436 172.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 89.2 p -131.88 164.96 24.94 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.196 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 t -77.48 -29.01 52.42 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.674 -0.641 . . . . 0.0 109.55 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -152.59 165.52 34.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 179.714 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.95 154.61 40.74 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.534 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -57.03 145.31 86.44 Favored 'Trans proline' 0 C--N 1.351 0.66 0 N-CA-C 114.829 1.05 . . . . 0.0 114.829 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.3 m -77.62 -21.37 13.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.223 0.535 . . . . 0.0 111.331 -179.693 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -90.85 99.12 12.21 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.972 179.571 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 14.72 58.8 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 176.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -68.34 -18.72 64.56 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.446 0.641 . . . . 0.0 110.486 179.044 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.74 -36.36 82.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.884 -177.467 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -37.67 74.11 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.614 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.3 mm -66.55 -39.99 85.27 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.604 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.267 -178.205 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.15 -23.92 65.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.514 0.674 . . . . 0.0 110.987 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.6 mtmt -94.9 6.16 49.83 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.773 179.295 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -118.94 95.94 5.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -176.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -68.34 124.97 24.97 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.515 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -85.72 107.44 17.59 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.944 0.878 . . . . 0.0 109.83 -178.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -99.53 123.53 43.88 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.824 -1.08 . . . . 0.0 108.662 -178.578 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -130.17 75.4 1.65 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -178.775 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.38 -112.68 3.7 Favored Glycine 0 C--O 1.223 -0.574 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -178.334 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.7 p -83.04 -20.82 34.27 Favored 'General case' 0 C--N 1.322 -0.59 0 O-C-N 122.217 -0.578 . . . . 0.0 110.367 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 53.1 t -74.92 140.62 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.9 m -130.79 112.85 13.42 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 171.081 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -106.29 129.65 59.26 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.504 0 O-C-N 121.527 -0.733 . . . . 0.0 110.222 178.866 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.64 104.0 22.01 Favored Pre-proline 0 N--CA 1.435 -1.22 0 CA-C-N 113.995 -1.457 . . . . 0.0 108.039 178.458 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -78.24 142.91 19.48 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 116.721 -1.719 . . . . 0.0 112.13 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 153.28 38.42 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 178.05 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.6 tt -146.86 123.57 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.143 0.497 . . . . 0.0 109.766 -177.334 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 1.9 t -89.87 126.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 104.098 -2.556 . . . . 0.0 104.098 174.592 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.61 136.27 54.45 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 175.907 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -22.44 66.38 Favored Glycine 0 C--O 1.227 -0.298 0 C-N-CA 121.178 -0.534 . . . . 0.0 113.899 -176.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.7 p -57.35 -26.74 61.44 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -177.253 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.5 ptm -141.16 30.58 1.78 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.546 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -44.37 -42.45 6.88 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 116.417 2.006 . . . . 0.0 116.417 -171.612 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -58.56 -51.33 70.34 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.685 -0.634 . . . . 0.0 112.395 -178.366 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -75.22 -33.06 61.33 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.582 0.706 . . . . 0.0 111.334 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -72.08 -42.02 66.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 20.8 tp -64.27 -41.81 96.75 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 121.717 -0.615 . . . . 0.0 111.272 -176.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.63 -13.31 60.33 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.648 -178.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.0 t -91.64 -40.35 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 121.33 0.586 . . . . 0.0 110.234 179.096 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -123.02 77.21 50.86 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.602 -179.398 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.25 -13.86 38.94 Favored 'Trans proline' 0 C--N 1.348 0.543 0 N-CA-C 114.127 0.78 . . . . 0.0 114.127 -177.841 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.5 m -77.83 -7.22 56.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.719 0.295 . . . . 0.0 111.57 177.308 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -99.4 132.98 44.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.236 0.541 . . . . 0.0 110.674 -178.736 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 . . . . . 0 C--N 1.327 -0.412 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.824 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 . . . . . 0 N--CA 1.465 0.293 0 CA-C-O 121.524 0.678 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.29 -44.93 93.64 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 179.192 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.76 -31.33 56.99 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.465 -179.42 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.3 mmt -65.3 -28.78 69.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.142 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.89 70.26 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.53 -0.271 . . . . 0.0 111.298 178.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -65.52 -51.28 61.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.48 177.694 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.11 -42.12 97.93 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.163 0.982 . . . . 0.0 108.6 -178.211 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -58.9 -40.15 83.64 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.995 178.839 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -64.91 -43.19 93.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.317 0.508 . . . . 0.0 112.063 177.152 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.7 -41.31 98.13 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.346 -179.496 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.6 t -65.86 -38.82 89.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 0.0 110.466 177.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.31 -45.92 92.45 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 123.103 0.561 . . . . 0.0 110.908 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 56.0 t -56.79 -50.12 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.324 -0.512 0 CA-C-O 120.965 0.412 . . . . 0.0 110.497 -178.662 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 C--O 1.224 -0.264 0 CA-C-O 121.577 0.703 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.78 -35.2 64.93 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.306 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -65.78 -29.33 69.81 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.364 0.602 . . . . 0.0 110.272 -176.924 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -62.23 -45.16 94.6 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.196 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 m -70.54 -40.31 73.5 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.302 178.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -55.35 -51.15 67.72 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.018 0.927 . . . . 0.0 111.082 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.664 -0.647 . . . . 0.0 111.769 178.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 55.6 mttt -66.71 -37.56 84.95 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.855 -0.528 . . . . 0.0 110.955 176.665 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 mm -71.19 -39.35 73.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.009 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.32 -44.58 80.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.51 -47.24 79.61 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.56 178.018 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 34.8 t60 -55.46 -45.56 76.89 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.683 0.393 . . . . 0.0 111.415 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.7 mt -70.44 -47.89 58.57 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.588 -178.839 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.85 -40.29 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-N 118.422 0.556 . . . . 0.0 109.983 175.639 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -64.17 -27.22 68.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.147 -0.346 . . . . 0.0 111.511 179.151 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 m -86.62 10.25 16.14 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 177.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.85 0.28 58.98 Favored Glycine 0 C--O 1.229 -0.159 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 175.602 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -67.81 129.25 39.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.311 1.056 . . . . 0.0 109.748 178.611 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.17 109.41 2.98 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 179.318 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.8 p -70.32 129.15 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.192 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 85.9 mt -94.89 -47.11 13.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.773 -1.103 . . . . 0.0 108.358 -177.321 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -142.36 139.95 31.92 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 -177.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 118.111 0.414 . . . . 0.0 110.262 -179.214 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--O 1.234 0.288 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -112.92 144.69 42.04 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.674 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 90.8 mt -135.36 127.78 47.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 172.71 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -110.84 133.11 53.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.068 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 mp -131.72 129.69 41.01 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.213 0.605 . . . . 0.0 109.788 -178.383 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -81.43 132.76 35.34 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.491 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.85 117.77 60.82 Favored Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 177.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -72.6 -26.12 16.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 115.892 -2.272 . . . . 0.0 112.807 -175.899 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -72.49 -26.5 61.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.701 -179.859 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.8 mttp 59.24 41.95 19.26 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.646 1.688 . . . . 0.0 108.113 -178.83 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 96.4 p -71.09 -177.61 1.73 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 111.042 -2.799 . . . . 0.0 108.39 176.85 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.2 p -45.85 -26.63 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 176.268 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -101.51 127.19 48.31 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 174.367 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -89.8 -37.7 14.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -178.523 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.9 mt -137.36 161.61 35.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.7 t -127.29 134.53 65.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -122.46 112.99 18.72 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.79 131.12 35.2 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 175.069 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -136.36 114.67 11.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.217 0.532 . . . . 0.0 111.416 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -82.56 94.71 7.56 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 178.541 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -151.62 136.59 17.31 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.26 146.11 24.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.234 -178.729 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.26 119.35 26.14 Favored 'General case' 0 C--O 1.22 -0.45 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 -177.236 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -79.12 -43.5 23.92 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 122.661 1.219 . . . . 0.0 109.845 178.316 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -127.83 164.67 21.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.87 -178.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -64.21 -15.82 60.75 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.579 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -62.4 -41.37 98.62 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.6 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -66.59 -39.37 88.39 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.7 ttm -63.11 -51.85 64.93 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.396 -178.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.87 -31.85 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.641 0.655 . . . . 0.0 112.585 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -68.51 -35.03 76.92 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.667 -178.138 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.72 -41.73 91.5 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.297 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -67.12 -30.88 50.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.077 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -58.45 -40.06 81.58 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.097 179.529 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -76.63 -43.91 36.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.423 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.45 -36.52 69.13 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.934 -178.536 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.17 -40.43 96.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 O-C-N 121.938 -0.476 . . . . 0.0 111.102 179.463 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -76.02 -29.68 58.21 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.313 -0.867 . . . . 0.0 109.638 178.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -60.7 -41.48 95.26 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 173.62 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.9 t -64.83 -39.67 86.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.05 177.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -54.56 -37.95 66.06 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.779 0.718 . . . . 0.0 111.69 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -61.68 -48.08 82.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.996 179.579 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.3 t -70.63 -41.41 77.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.564 0.697 . . . . 0.0 110.943 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -41.67 93.54 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.971 -0.456 . . . . 0.0 109.942 179.719 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -64.59 -45.82 85.33 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.106 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -58.64 -42.28 87.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.433 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.75 -3.69 58.02 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -179.489 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.68 20.1 67.83 Favored Glycine 0 C--O 1.242 0.615 0 C-N-CA 121.508 -0.377 . . . . 0.0 113.654 179.656 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -73.04 147.84 44.69 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.825 -0.809 . . . . 0.0 110.944 -176.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -69.45 -37.52 77.37 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.47 159.62 39.94 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 171.569 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.9 ttp -134.15 147.19 50.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.745 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -116.0 136.67 52.81 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.4 tp -119.81 134.0 55.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 123.056 0.543 . . . . 0.0 110.699 178.448 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.78 109.85 22.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -97.71 127.34 43.59 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.053 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.9 t -122.08 109.31 24.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.177 0.513 . . . . 0.0 110.937 179.055 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -81.24 151.83 27.94 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 176.489 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -127.29 107.63 10.16 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 103.61 -2.737 . . . . 0.0 103.61 171.658 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.3 m -127.17 158.65 36.53 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.683 0.614 . . . . 0.0 110.896 -174.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.5 m -67.06 -45.21 78.07 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -177.434 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -146.81 176.74 9.65 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.711 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.19 143.39 29.6 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.395 -0.821 . . . . 0.0 108.874 -176.119 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.71 147.06 73.81 Favored 'Trans proline' 0 C--N 1.35 0.622 0 N-CA-C 114.93 1.088 . . . . 0.0 114.93 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 26.9 m -81.17 -10.23 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 N-CA-C 114.525 1.305 . . . . 0.0 114.525 -177.092 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -112.67 95.77 5.61 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 119.339 -0.362 . . . . 0.0 111.559 -178.378 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.9 t0 14.83 67.33 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 176.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 56.6 p-90 -83.99 -13.99 51.9 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.195 179.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -66.65 -31.48 72.19 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.119 -0.988 . . . . 0.0 111.905 -175.21 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -65.31 -21.74 66.75 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.958 175.615 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 15.5 mm -72.7 -40.48 61.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.3 -5.03 33.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.983 179.22 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -111.35 3.14 18.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.797 -179.383 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -126.74 128.42 46.62 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.88 0.847 . . . . 0.0 112.142 179.068 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 26.5 m -78.46 126.79 31.26 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 176.819 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -82.64 111.44 18.61 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 177.016 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -118.17 120.99 39.39 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.461 0.648 . . . . 0.0 109.76 -178.392 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -116.69 75.31 0.96 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 178.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.31 -112.7 4.85 Favored Glycine 0 C--O 1.225 -0.466 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.774 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.0 p -81.96 24.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.561 0.744 . . . . 0.0 112.173 -178.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 86.2 t -134.83 140.63 45.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.264 -178.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.8 t -130.62 126.49 36.78 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 175.67 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.9 t -136.7 136.42 48.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 176.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -125.56 131.33 24.01 Favored Pre-proline 0 C--N 1.317 -0.841 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 175.865 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -84.56 154.73 12.05 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 CA-C-O 122.101 0.792 . . . . 0.0 113.774 -177.61 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.78 150.73 39.0 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 174.438 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.7 tt -146.42 124.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -176.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 52.1 t -97.44 115.95 38.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 175.057 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.35 138.17 39.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.061 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.86 -25.88 53.48 Favored Glycine 0 C--O 1.223 -0.591 0 N-CA-C 114.728 0.651 . . . . 0.0 114.728 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.7 p -59.66 -27.2 66.17 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.545 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.8 ptm -143.07 18.42 1.94 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.925 0.869 . . . . 0.0 109.906 -177.831 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tt -42.08 -42.41 2.91 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 118.418 2.747 . . . . 0.0 118.418 -170.613 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -60.79 -51.54 68.91 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 119.562 -0.855 . . . . 0.0 112.278 -174.078 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -78.54 -33.27 48.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 176.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -58.86 -32.15 69.18 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.432 1.111 . . . . 0.0 110.818 -178.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.63 -36.35 73.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.953 -1.021 . . . . 0.0 113.178 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -75.33 -15.0 60.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -176.269 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.55 -28.56 62.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.163 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 22.7 t -95.56 -41.63 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.858 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -126.22 80.19 68.89 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.33 -178.908 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -67.55 -14.53 42.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 118.08 -0.813 . . . . 0.0 112.774 179.752 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.2 m -75.72 -5.71 46.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.923 176.461 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -99.48 135.5 40.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.706 0.765 . . . . 0.0 110.575 -179.022 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.344 179.963 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 . . . . . 0 N--CA 1.454 -0.252 0 CA-C-O 120.566 0.222 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.49 90.69 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.404 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -62.73 -51.08 68.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 21.5 ptp -65.33 -28.84 69.59 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.353 179.419 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.05 -37.37 85.68 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.456 -0.778 . . . . 0.0 110.034 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 44.5 ttt180 -65.64 -45.86 81.39 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.595 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -65.01 -40.31 94.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.843 0.83 . . . . 0.0 110.316 -178.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -64.71 -40.0 94.62 Favored 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.872 178.491 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.34 -41.22 98.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.83 0.348 . . . . 0.0 111.639 176.568 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.8 mt -65.17 -33.13 75.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.043 0.449 . . . . 0.0 109.823 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.05 -34.81 61.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.624 0.726 . . . . 0.0 110.571 175.086 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -65.06 -44.15 89.92 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.639 -178.624 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.7 p -62.16 -36.78 76.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.014 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.207 -1.165 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.024 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.25 -35.3 80.61 Favored 'General case' 0 C--O 1.208 -1.084 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.277 178.507 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -65.14 -42.21 94.03 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 178.575 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 177.484 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -59.12 -43.69 91.97 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.613 -178.216 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -57.26 -52.31 65.84 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 123.073 0.549 . . . . 0.0 110.363 179.906 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -69.3 -33.32 73.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.979 -179.268 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.69 -31.48 69.55 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.683 -0.636 . . . . 0.0 111.018 178.803 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.8 mm -77.06 -39.2 28.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.18 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.1 80.94 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.09 -45.85 86.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.915 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.95 -47.45 77.57 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.454 0.302 . . . . 0.0 110.623 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 34.4 mt -67.1 -51.03 59.29 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -178.64 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.2 t -57.33 -42.71 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.979 178.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -19.09 65.7 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.351 -0.843 . . . . 0.0 111.814 -179.642 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.4 t -87.53 8.1 26.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.021 0.439 . . . . 0.0 111.046 177.876 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.59 1.24 56.53 Favored Glycine 0 C--O 1.228 -0.266 0 N-CA-C 116.033 1.173 . . . . 0.0 116.033 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.426 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 38.3 m-85 -71.9 110.52 6.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 118.046 0.923 . . . . 0.0 109.018 178.215 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.41 134.48 30.89 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.945 -177.454 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -75.79 125.81 35.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.717 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.3 mt -92.22 -43.83 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.014 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -153.41 127.55 9.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.793 175.661 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 174.352 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 N--CA 1.457 -0.107 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -136.39 146.97 47.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 178.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 83.6 mt -134.92 134.23 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.681 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -110.41 135.57 50.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.0 0.429 . . . . 0.0 111.45 -179.229 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mp -132.37 143.02 49.55 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.105 0.962 . . . . 0.0 109.226 -177.58 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -102.47 135.56 43.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.76 115.62 39.73 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 93.9 Cg_endo -73.56 -24.43 16.09 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 117.373 -1.285 . . . . 0.0 112.547 -177.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -76.28 -24.45 54.43 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.971 178.78 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.69 42.72 6.09 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -178.378 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 m -59.87 -177.52 0.06 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 112.559 -2.11 . . . . 0.0 115.078 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.4 m -52.98 -28.84 25.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.652 173.603 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.428 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 14.4 p-80 -100.53 140.48 34.74 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 172.101 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -97.42 -43.83 7.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.032 0.444 . . . . 0.0 111.761 -172.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.1 mt -130.5 158.1 40.86 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.8 t -127.6 136.63 59.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 177.777 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.48 134.26 35.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.871 0.843 . . . . 0.0 109.371 173.032 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -97.55 137.06 37.05 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -178.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -136.01 108.81 7.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -175.381 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.22 94.78 6.12 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 179.505 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -151.52 118.88 5.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.342 0.592 . . . . 0.0 111.657 -175.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -87.16 151.48 23.15 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.47 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.3 mt -141.19 143.53 34.25 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.856 -172.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -98.11 -39.46 8.89 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.102 0.477 . . . . 0.0 110.356 176.628 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -133.77 151.09 51.49 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -176.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.437 ' H ' ' HB3' ' A' ' 94' ' ' ASP . 9.3 ptt180 -64.48 -21.13 66.57 Favored 'General case' 0 C--O 1.212 -0.908 0 O-C-N 121.528 -0.733 . . . . 0.0 112.535 179.937 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -33.05 72.78 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.914 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -72.49 -45.51 59.12 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.0 ttt -55.0 -49.03 72.5 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.591 -178.584 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.6 m -65.06 -35.25 75.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.758 178.529 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -71.13 -32.99 69.66 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.214 -177.106 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.4 -38.02 76.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 175.897 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.1 mm -71.58 -30.91 40.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.745 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.89 -40.18 87.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -74.55 -42.7 58.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 178.816 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.22 -43.71 87.82 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.012 -0.43 . . . . 0.0 110.683 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.7 -40.27 84.32 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.633 -178.529 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -64.17 -49.37 72.33 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.294 -0.563 . . . . 0.0 109.59 177.883 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -40.61 95.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.89 -33.33 43.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.675 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -66.74 -38.23 86.24 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -60.32 -43.83 96.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.092 -176.398 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.23 -35.82 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.626 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -30.31 66.51 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.888 -1.133 . . . . 0.0 113.552 -178.542 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -58.18 -31.75 67.59 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.554 179.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -20.47 65.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.705 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.01 9.37 34.47 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.927 0.394 . . . . 0.0 110.195 177.503 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.79 29.19 71.56 Favored Glycine 0 C--O 1.236 0.24 0 N-CA-C 115.754 1.062 . . . . 0.0 115.754 175.81 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 38.2 ttt85 -69.89 128.29 35.87 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 121.728 -0.866 . . . . 0.0 108.678 -178.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.73 -36.16 82.95 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.326 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.22 149.17 29.82 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 176.932 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -120.66 147.98 44.53 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.66 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -134.96 117.47 15.83 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.257 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 tp -112.89 128.31 56.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.13 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -94.26 104.1 16.11 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 174.232 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -101.85 128.48 48.2 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.319 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.6 t -123.48 109.38 23.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.316 176.551 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -72.9 141.91 47.88 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 175.247 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -118.27 103.75 10.12 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 174.261 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 83.5 p -123.07 158.74 29.97 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.991 0.424 . . . . 0.0 110.557 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -75.94 -28.87 58.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 121.482 -0.761 . . . . 0.0 108.999 -179.335 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -155.32 166.61 33.01 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 177.247 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.18 150.31 43.0 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 110.507 -0.183 . . . . 0.0 110.507 -176.008 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.87 145.23 85.49 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 118.03 -0.847 . . . . 0.0 112.046 177.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 m -76.25 -19.74 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -172.56 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.437 ' HB3' ' H ' ' A' ' 54' ' ' ARG . 43.7 t0 -84.31 87.43 7.2 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-O 119.484 -0.293 . . . . 0.0 111.333 -177.526 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 27.56 48.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 118.041 2.608 . . . . 0.0 118.041 176.221 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 34.1 p-90 -62.06 -20.21 63.74 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.03 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -61.03 -31.23 70.86 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.841 -0.537 . . . . 0.0 110.356 -179.253 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -60.03 -35.19 74.56 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.7 mm -72.45 -43.52 63.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.94 -176.06 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.33 64.52 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.755 -0.591 . . . . 0.0 112.244 -178.525 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -101.92 17.06 24.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -131.02 104.25 7.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.601 -176.507 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.0 m -68.25 125.9 27.87 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.355 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -82.71 127.79 33.75 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 179.255 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -126.03 133.06 51.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.795 0.807 . . . . 0.0 111.311 179.351 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -142.26 111.47 6.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.441 -1.254 . . . . 0.0 108.08 178.354 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.75 -115.94 8.26 Favored Glycine 0 C--N 1.322 -0.195 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.091 179.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 60.7 p -87.46 -12.61 45.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.442 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.6 t -94.1 141.33 15.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -174.163 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.3 m -120.76 138.45 54.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 167.234 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 25.2 t -132.39 134.03 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -96.09 114.48 64.28 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 176.818 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -84.28 59.63 5.97 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 121.987 1.792 . . . . 0.0 114.209 -177.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.33 153.01 44.27 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.88 -178.328 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.7 tt -147.46 135.43 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.0 m -112.18 132.72 60.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.2 141.17 50.16 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -176.307 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.1 -26.44 55.82 Favored Glycine 0 C--O 1.227 -0.283 0 N-CA-C 114.808 0.683 . . . . 0.0 114.808 -176.559 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.0 p -55.3 -29.6 58.54 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -179.345 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.7 ptm -141.63 26.49 1.93 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.348 0.594 . . . . 0.0 110.298 -178.025 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 12.1 tp -45.35 -37.75 5.2 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 119.328 3.084 . . . . 0.0 119.328 -169.301 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -65.98 -43.37 88.01 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.301 0.955 . . . . 0.0 110.778 -179.235 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -73.7 -36.0 65.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 122.218 1.009 . . . . 0.0 109.495 178.562 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -62.81 -42.72 99.84 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 11.2 mt -62.13 -43.93 97.76 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -75.07 -15.24 60.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.355 -177.311 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.61 -40.85 48.13 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.232 -0.292 . . . . 0.0 110.716 178.123 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.2 p -92.25 -32.91 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 120.995 0.426 . . . . 0.0 111.252 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -127.24 80.67 71.29 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.396 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -65.5 -11.84 32.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 N-CA-C 114.694 0.998 . . . . 0.0 114.694 -177.704 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.9 m -77.97 -2.85 38.97 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.123 -0.361 . . . . 0.0 111.666 176.332 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -77.0 127.43 32.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.596 0.712 . . . . 0.0 111.85 -179.1 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 59.9 mtt180 . . . . . 0 C--N 1.322 -0.6 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.701 178.795 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 31.5 m120 . . . . . 0 C--O 1.22 -0.471 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -32.49 57.53 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.96 -0.463 . . . . 0.0 111.759 178.43 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -62.99 -41.05 99.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.635 0.731 . . . . 0.0 109.41 177.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtp -70.84 -29.01 65.03 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.567 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.36 -40.42 95.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.164 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.2 ttt180 -63.43 -46.63 85.45 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -59.43 -42.7 92.47 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.301 0.572 . . . . 0.0 110.317 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -58.73 -44.68 90.52 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.951 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -65.9 -46.2 79.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 179.171 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.7 -41.51 86.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.219 0.533 . . . . 0.0 109.667 -178.156 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.7 m -69.76 -35.73 75.18 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.418 178.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.7 tt -65.47 -39.44 91.97 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -177.126 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 88.7 t -53.68 -54.01 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.586 0.63 . . . . 0.0 112.696 -174.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.326 -0.445 0 CA-C-O 121.342 0.592 . . . . 0.0 109.833 -179.555 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.8 tt . . . . . 0 C--O 1.218 -0.573 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.79 -35.3 80.31 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.315 179.255 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.14 -32.15 70.75 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.149 0.5 . . . . 0.0 109.793 -179.817 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.78 -54.47 38.54 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.6 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' THR . . . . . 0.408 ' HG1' HD13 ' A' ' 121' ' ' LEU . 6.8 m -64.17 -38.13 89.96 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.196 0.522 . . . . 0.0 111.381 -179.646 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -56.23 -52.98 62.47 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.46 0.704 . . . . 0.0 110.538 178.234 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -70.72 -28.09 64.46 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.211 -0.931 . . . . 0.0 111.744 179.094 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -65.26 -43.43 91.33 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 176.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.0 mm -69.28 -38.55 77.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.835 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 -45.18 80.08 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.15 -42.5 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.954 0.407 . . . . 0.0 111.382 178.98 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -60.15 -46.81 88.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.399 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 mt -65.1 -53.52 44.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.86 0.362 . . . . 0.0 111.132 -179.911 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.6 t -59.41 -43.57 90.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.465 -175.226 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -14.2 62.71 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.513 -0.742 . . . . 0.0 112.592 -179.385 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.9 m -89.71 1.49 56.0 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 177.914 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.05 -3.0 27.04 Favored Glycine 0 C--O 1.224 -0.48 0 N-CA-C 115.588 0.995 . . . . 0.0 115.588 176.806 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -67.35 118.33 10.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 118.284 1.042 . . . . 0.0 109.427 178.571 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.64 133.95 14.52 Favored Glycine 0 C--O 1.226 -0.403 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -177.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.4 t -77.1 132.62 32.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.34 0.591 . . . . 0.0 110.154 179.457 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 53.7 mt -105.5 -48.51 9.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 174.436 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -141.64 116.2 9.63 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 118.25 0.477 . . . . 0.0 111.597 178.19 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -116.66 151.9 35.36 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.365 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.8 mt -137.62 126.48 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 104.597 -2.372 . . . . 0.0 104.597 165.082 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -108.09 125.48 51.63 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.427 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.71 135.24 54.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.821 -177.874 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -84.88 132.95 34.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 175.238 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.11 124.95 91.87 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.259 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -74.52 -23.67 14.68 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 116.591 -1.806 . . . . 0.0 112.486 -179.79 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -67.96 -37.24 81.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.792 -178.633 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.7 mttt 59.07 28.13 17.3 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 123.548 1.642 . . . . 0.0 109.858 -176.073 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -77.38 -173.13 2.75 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 110.871 -2.877 . . . . 0.0 108.5 173.802 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.48 -28.84 0.14 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 117.418 2.377 . . . . 0.0 117.418 -174.576 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.496 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 11.6 p80 -107.69 131.54 54.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.004 1.275 . . . . 0.0 108.709 169.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -87.12 -39.79 15.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.837 -1.529 . . . . 0.0 111.582 -172.267 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.3 mt -135.37 164.08 28.58 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.333 -178.6 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 96.6 t -128.68 136.76 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 175.678 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -120.95 116.48 25.19 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -93.68 130.08 39.76 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 175.459 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -136.2 124.39 23.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -174.92 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.87 94.87 5.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.213 0.53 . . . . 0.0 110.076 -179.315 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -144.16 141.64 30.07 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.561 -0.904 . . . . 0.0 108.561 178.188 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -99.17 137.0 38.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 -177.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.84 145.59 47.92 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 -174.903 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -107.36 -39.69 5.59 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.172 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -122.47 161.26 23.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.878 179.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -66.19 -15.47 63.17 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.095 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.74 -43.15 94.38 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.53 -46.8 88.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.367 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 81.0 mtp -56.64 -51.96 66.7 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.34 -179.426 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.9 m -67.08 -31.84 55.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.325 -175.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.0 mtt-85 -67.53 -43.77 79.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.478 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -58.37 -45.22 88.67 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.602 -179.378 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.419 HG22 ' CD1' ' A' ' 104' ' ' PHE . 2.5 mt -74.12 -34.2 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.313 -0.867 . . . . 0.0 112.067 -177.446 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.33 -37.68 72.92 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 177.321 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -76.62 -46.22 26.91 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.925 179.219 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -55.29 -43.8 75.12 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.244 -178.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.72 -39.68 81.53 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.382 0.537 . . . . 0.0 111.312 -177.518 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.413 ' HB3' HH21 ' A' ' 70' ' ' ARG . 26.1 mt-10 -73.42 -30.23 63.1 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 121.436 -0.79 . . . . 0.0 111.094 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -40.03 78.55 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 174.918 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 73.0 t -65.9 -36.45 77.54 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -54.35 -38.72 66.4 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.902 0.774 . . . . 0.0 111.69 178.726 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.413 HH21 ' HB3' ' A' ' 66' ' ' GLU . 6.8 mmt180 -67.31 -43.27 82.1 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.847 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.76 -42.89 90.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.78 -44.34 86.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 123.101 0.56 . . . . 0.0 109.999 178.573 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -65.61 -42.22 91.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.656 0.265 . . . . 0.0 110.467 179.605 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -62.54 -40.59 97.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 0.0 111.161 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.94 0.97 41.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -179.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.31 22.59 71.17 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 114.24 0.456 . . . . 0.0 114.24 178.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -76.68 140.25 40.82 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.972 -0.722 . . . . 0.0 110.8 -176.931 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.64 -35.72 62.88 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 178.869 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -150.65 162.37 40.79 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 102.631 -3.1 . . . . 0.0 102.631 176.399 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.6 mtp -137.31 152.93 50.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.496 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 7.0 tttp -129.75 133.7 47.17 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 176.588 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.23 125.44 34.88 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.387 0.43 . . . . 0.0 110.588 -174.571 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.8 tp -88.04 107.81 18.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 176.601 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -101.96 128.65 48.28 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.3 t -121.31 110.0 26.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 117.945 0.338 . . . . 0.0 111.232 178.443 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -75.04 149.41 39.22 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -128.79 103.67 7.19 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 174.351 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 88.8 p -130.24 150.57 51.43 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.84 0.352 . . . . 0.0 111.823 -175.946 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -67.08 -29.36 69.11 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -178.083 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -138.61 167.4 22.02 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 -178.099 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.13 144.02 27.37 Favored Pre-proline 0 C--N 1.318 -0.787 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 177.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.47 149.47 66.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 114.802 1.039 . . . . 0.0 114.802 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 15.1 m -76.64 -15.34 14.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 117.209 2.3 . . . . 0.0 117.209 -174.71 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -123.73 98.31 5.76 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -176.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.4 t0 38.07 50.02 1.3 Allowed 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 170.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . 0.407 ' CZ3' HG22 ' A' ' 115' ' ' ILE . 53.0 p-90 -80.03 -14.39 58.59 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 176.849 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -66.84 -31.79 72.63 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 121.489 -0.757 . . . . 0.0 110.625 -177.439 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.12 -20.66 66.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 109.99 173.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 12.3 mm -79.27 -45.52 23.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.897 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 -179.299 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.03 -24.42 67.48 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.74 0.781 . . . . 0.0 110.184 178.09 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -77.6 -16.11 58.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.373 -179.29 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -113.1 126.58 55.62 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -176.039 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 46.5 m -70.44 126.41 29.57 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 103.496 -2.779 . . . . 0.0 103.496 171.545 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . 0.419 ' CD1' HG22 ' A' ' 61' ' ' ILE . 81.1 t80 -82.82 119.31 24.21 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.012 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -121.73 122.68 40.1 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.912 0.863 . . . . 0.0 109.51 178.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -143.79 129.25 19.01 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.81 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.11 -127.0 32.21 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 107.899 -2.08 . . . . 0.0 107.899 -176.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -104.46 7.89 35.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.171 0.51 . . . . 0.0 110.228 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.9 t -97.72 147.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -176.088 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 m -125.22 138.78 54.12 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 171.196 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.1 t -137.29 134.61 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -99.63 114.27 65.51 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.769 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -81.52 77.18 4.04 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.515 2.143 . . . . 0.0 114.644 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -86.15 155.25 20.83 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . 0.407 HG22 ' CZ3' ' A' ' 96' ' ' TRP . 11.6 tt -147.83 146.16 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -176.617 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 72.7 t -114.48 118.16 57.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.85 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -73.4 143.27 46.84 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.01 175.42 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.42 -41.96 8.14 Favored Glycine 0 C--O 1.223 -0.548 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 169.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.9 t -57.74 -23.9 54.33 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -178.278 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.8 ptm -139.94 40.35 1.98 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 122.151 0.977 . . . . 0.0 109.721 177.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.408 HD13 ' HG1' ' A' ' 7' ' ' THR . 0.5 OUTLIER -50.79 -45.79 59.41 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -172.615 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 23.3 mtm105 -57.06 -51.31 69.8 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.967 0.803 . . . . 0.0 111.686 -178.301 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -73.79 -35.22 64.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.551 -175.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.7 -38.23 54.75 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -178.5 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.35 -41.98 98.89 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.745 -0.597 . . . . 0.0 110.964 -177.381 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -69.72 -13.38 62.26 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.235 -177.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.42 49.94 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -93.01 -36.57 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 120.872 0.367 . . . . 0.0 110.373 179.383 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -127.83 75.67 77.94 Favored Pre-proline 0 C--N 1.326 -0.434 0 O-C-N 122.149 -0.344 . . . . 0.0 111.246 178.229 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 -15.04 42.14 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-O 121.276 0.448 . . . . 0.0 112.953 178.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.5 m -79.99 -7.14 58.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 178.771 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -75.87 132.91 40.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.451 0.643 . . . . 0.0 110.72 -179.461 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 . . . . . 0 C--N 1.323 -0.574 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 175.353 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.224 -0.256 0 CA-C-O 120.502 0.191 . . . . 0.0 110.972 . . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.88 -37.62 79.87 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.71 0.29 . . . . 0.0 110.682 175.304 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.5 -42.29 68.23 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.527 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 23.9 mmt -60.28 -33.8 72.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 0.0 110.137 178.424 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.69 -38.64 87.18 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.056 -0.403 . . . . 0.0 110.328 178.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.25 -43.89 85.23 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.023 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.05 -41.59 97.33 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.2 0.524 . . . . 0.0 109.886 -178.517 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -63.01 -42.31 99.78 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -62.15 -41.53 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.168 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.0 mt -63.58 -37.68 88.25 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.098 0.475 . . . . 0.0 110.034 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.9 m -69.83 -35.16 74.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.695 0.76 . . . . 0.0 110.505 176.146 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.85 -47.32 69.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.621 -178.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.1 p -64.99 -40.3 88.6 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.639 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.226 -178.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.913 -179.418 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.7 tp . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.813 0.34 . . . . 50.0 110.834 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -73.73 -55.25 6.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.442 . . . . 50.0 110.958 179.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.04 -35.45 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 50.0 110.851 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -52.46 -46.1 66.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 50.0 110.948 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.22 -54.32 11.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.093 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -51.19 -38.94 55.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.421 . . . . 50.0 110.926 -179.893 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -75.63 -48.26 22.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.114 -0.494 . . . . 50.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -48.3 74.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.84 -48.09 81.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 50.0 111.138 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.49 -44.15 62.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.0 -33.09 67.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.087 179.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.85 -51.86 59.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mt -56.66 -56.13 25.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 50.0 110.903 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -56.57 -33.0 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 50.0 111.134 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.97 -17.88 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.283 -0.417 . . . . 50.0 110.891 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.0 33.87 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.86 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.82 94.86 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.713 -0.756 . . . . 25.0 112.457 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -103.4 104.06 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.857 0.36 . . . . 25.0 110.878 -179.764 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -50.9 111.42 1.26 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.798 -0.715 . . . . 25.0 112.438 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.7 t -69.98 106.53 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.763 0.316 . . . . 50.0 111.078 -179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.9 mt -69.12 -34.77 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.138 -0.483 . . . . 25.0 111.106 179.905 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -169.28 116.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.863 179.957 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.079 179.926 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.778 0.323 . . . . 50.0 110.869 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.57 173.12 15.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 50.0 110.916 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.9 mt -103.65 130.24 54.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.18 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -109.76 135.73 50.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.124 -0.489 . . . . 50.0 110.918 179.94 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.3 mt -146.03 124.51 12.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 50.0 110.942 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.24 133.64 42.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 50.0 110.9 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.4 104.04 38.97 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.594 0.711 . . . . 25.0 111.112 179.907 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -32.35 18.68 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.627 2.218 . . . . 50.0 112.328 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -25.63 60.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 50.0 110.823 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 66.27 39.7 4.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.93 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.07 -176.52 1.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 25.0 110.843 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.07 -34.54 13.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 50.0 110.945 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -105.51 122.8 46.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 50.0 110.909 179.848 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.12 -56.03 5.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 50.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.0 mt -119.59 155.26 32.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 50.0 110.895 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.9 148.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 50.0 111.169 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -132.23 140.15 48.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 25.0 110.827 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mp -134.35 126.56 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 50.0 110.891 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -126.71 150.01 49.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 25.0 110.987 -179.967 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 94.84 4.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.164 -0.471 . . . . 50.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -151.57 148.95 28.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 50.0 110.875 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -92.99 140.06 29.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 25.0 110.874 179.958 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.34 152.09 35.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 50.0 110.871 -179.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.32 -36.25 7.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 50.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -135.97 -175.13 3.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 25.0 110.932 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt85 -80.38 -30.54 37.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 50.0 110.796 -179.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -35.1 62.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 50.0 110.917 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -34.87 61.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 50.0 110.905 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.8 tpp -72.57 -52.28 16.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 50.0 110.877 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.2 m -58.95 -34.26 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.268 -0.424 . . . . 50.0 111.154 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 mtm-85 -66.51 -37.68 85.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.165 -0.47 . . . . 50.0 110.868 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -54.13 46.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 50.0 110.879 179.949 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -60.73 -37.85 77.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.288 -0.414 . . . . 50.0 111.139 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -51.43 -34.89 37.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 50.0 110.942 179.944 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -76.78 -35.67 57.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 50.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -54.42 -59.72 4.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 50.0 110.924 -179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.22 -38.35 57.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.083 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.89 -42.04 97.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 50.0 110.886 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.48 -37.2 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.884 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 68.1 t -52.85 -35.74 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 50.0 111.124 179.985 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -53.93 -36.69 63.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 50.0 110.813 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -72.29 -37.12 69.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.176 -0.466 . . . . 50.0 110.842 -179.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 86.5 t -70.87 -52.8 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 25.0 111.166 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -36.36 75.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 50.0 110.806 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -58.25 -45.27 88.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.818 -179.924 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -72.54 -37.55 68.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 50.0 110.9 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mp -70.98 -19.63 62.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 50.0 110.896 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.32 33.34 58.2 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.773 -0.727 . . . . 25.0 112.501 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.03 175.34 6.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 50.0 110.897 -179.89 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -71.27 -52.83 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -148.74 163.86 36.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 50.0 110.859 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 mmm -134.9 130.97 36.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 50.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.7 120.12 39.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 50.0 110.901 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.57 130.99 55.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.314 -0.403 . . . . 50.0 110.967 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.3 tp -104.08 97.72 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 50.0 110.917 179.856 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -100.21 126.68 46.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 25.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.0 p -129.6 154.87 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 50.0 111.133 179.971 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -122.56 127.4 49.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 50.0 110.866 -179.953 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -98.39 114.61 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 50.0 110.865 -179.938 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 60.2 p -143.76 169.52 17.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 50.0 110.862 -179.778 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.8 m -89.86 -51.22 5.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 25.0 111.157 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -120.58 135.24 55.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 50.0 110.837 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.24 160.15 80.1 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.54 0.686 . . . . 25.0 111.092 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.58 -170.48 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.753 2.302 . . . . 50.0 112.383 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.6 m -145.79 80.67 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 50.0 111.151 179.83 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -172.98 45.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 50.0 110.786 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.9 t70 63.51 55.85 1.7 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.858 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 24.3 p-90 -84.39 -29.63 26.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 50.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -50.7 -48.2 58.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.199 -0.455 . . . . 50.0 110.846 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.92 -33.57 37.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 50.0 110.847 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.99 -46.4 94.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 50.0 111.098 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.82 -31.11 71.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.02 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -73.0 -38.07 66.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 50.0 110.932 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt -89.08 156.54 18.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 50.0 110.881 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.3 m -122.81 143.98 49.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.445 . . . . 25.0 111.161 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -90.75 104.16 16.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 50.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -112.43 101.09 9.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 50.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.01 103.28 15.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 50.0 110.823 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 52.75 -112.41 2.14 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.725 . . . . 25.0 112.437 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.1 p -95.08 29.81 2.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 25.0 111.125 -179.824 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.46 151.61 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 50.0 111.096 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.8 t -137.73 112.5 8.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 50.0 110.893 -179.818 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 18.9 t -140.94 138.9 34.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 50.0 111.082 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.04 141.86 38.21 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.648 0.737 . . . . 50.0 110.885 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.65 135.61 31.16 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.669 2.246 . . . . 50.0 112.351 179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -134.26 135.14 42.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 25.0 111.111 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.98 137.93 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 50.0 111.165 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 4.7 m -130.74 101.85 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 75.0 111.203 179.862 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.2 154.73 17.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.137 -0.483 . . . . 50.0 110.889 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.65 -29.46 18.37 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.765 -0.731 . . . . 25.0 112.482 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.1 p -57.51 -45.37 85.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 25.0 111.172 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 1.7 mtm -134.59 46.93 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 50.0 110.819 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.31 -59.19 5.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 50.0 110.85 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.72 -35.58 80.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.91 179.908 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.57 -41.09 89.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 50.0 110.8 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.43 -33.25 54.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 50.0 110.897 -179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.66 -33.8 48.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.495 . . . . 50.0 110.932 -179.954 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -75.36 -30.2 60.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 50.0 110.846 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.54 -37.83 65.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 25.0 111.17 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -90.34 -60.63 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.441 . . . . 50.0 111.108 179.979 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -112.44 77.54 2.32 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.586 0.708 . . . . 50.0 110.881 -179.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 -29.45 23.44 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.643 2.229 . . . . 50.0 112.321 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 43.3 t -69.44 -16.04 63.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 25.0 110.799 -179.813 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -54.24 146.17 15.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 50.0 110.854 -179.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 50.0 110.854 -179.93 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.458 -0.051 0 CA-C-O 120.854 0.359 . . . . 50.0 110.969 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.88 -35.39 61.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 25.0 111.154 179.763 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -61.47 -44.76 96.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 50.0 110.852 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.2 mmt -76.93 -35.73 57.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.437 . . . . 50.0 110.852 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.65 66.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.252 -0.431 . . . . 25.0 111.132 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.3 ttt180 -65.13 -53.81 39.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 50.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -43.79 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 25.0 110.877 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -39.5 93.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 50.0 110.959 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -53.57 -44.23 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.861 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -51.93 -46.12 64.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 50.0 110.884 -179.908 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.5 m -76.15 -36.22 58.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 50.0 110.869 -179.933 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 10.5 tt -57.17 -34.99 69.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 50.0 110.89 179.994 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 84.1 t -52.63 -54.5 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 50.0 111.101 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 50.0 110.886 -179.961 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -133.59 156.96 46.9 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 122.32 -0.238 . . . . 0.0 110.675 -177.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -64.14 -43.81 94.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.312 0.577 . . . . 0.0 109.996 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.68 -34.63 78.3 Favored 'General case' 0 C--O 1.215 -0.763 0 O-C-N 122.017 -0.427 . . . . 0.0 110.976 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -61.62 -32.95 73.12 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.602 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -63.15 -52.44 62.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.2 m -59.38 -40.82 87.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.371 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -55.26 -48.35 74.12 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.425 0.69 . . . . 0.0 110.983 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -70.49 -34.08 71.96 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.718 -0.614 . . . . 0.0 111.749 178.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -67.97 -34.88 77.4 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.095 -0.378 . . . . 0.0 111.397 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.512 ' HA ' ' HD1' ' A' ' 14' ' ' HIS . 24.2 mm -71.85 -41.1 69.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 177.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.86 78.04 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.51 -49.8 73.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.519 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.512 ' HD1' ' HA ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -64.99 -37.92 89.26 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.28 -176.503 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.47 -48.79 63.56 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.2 p -65.22 -30.61 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.202 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -78.17 -8.56 58.45 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.971 -0.455 . . . . 0.0 111.312 178.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 55.4 m -101.25 9.94 41.27 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.95 0.83 61.76 Favored Glycine 0 N--CA 1.452 -0.282 0 N-CA-C 116.836 1.494 . . . . 0.0 116.836 176.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.42 132.08 46.41 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.13 131.29 10.28 Favored Glycine 0 C--O 1.22 -0.753 0 N-CA-C 110.271 -1.132 . . . . 0.0 110.271 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.44 106.23 7.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 118.332 1.066 . . . . 0.0 109.329 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 74.3 mt -72.78 -42.46 61.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -148.7 116.34 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.32 116.4 10.47 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 123.189 0.306 . . . . 0.0 111.035 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 168.12 -31.93 0.18 Allowed Glycine 0 C--N 1.319 -0.406 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.228 175.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -66.45 154.69 39.59 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 m -95.7 0.56 52.72 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 121.985 -0.447 . . . . 0.0 111.554 -176.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -126.78 -27.42 3.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -131.6 131.68 43.45 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.8 mt -136.6 132.79 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 175.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -108.17 129.2 55.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.88 126.26 48.28 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 123.434 0.694 . . . . 0.0 109.565 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -76.32 132.26 39.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.29 116.62 50.93 Favored Pre-proline 0 CA--C 1.546 0.809 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.28 -23.58 20.7 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 117.592 -1.139 . . . . 0.0 113.812 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.9 -27.49 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.654 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.7 mttt 54.83 39.54 31.5 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.952 1.834 . . . . 0.0 108.353 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 t -73.95 -176.26 2.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 110.816 -2.902 . . . . 0.0 107.927 176.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.2 m -47.22 -30.62 3.1 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -90.03 129.9 36.28 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 172.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -89.15 -37.36 15.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.956 0.408 . . . . 0.0 111.891 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.49 166.42 30.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.257 0.551 . . . . 0.0 111.534 -175.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 49.1 t -127.16 136.39 60.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -114.98 126.35 54.66 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mp -95.87 129.46 43.11 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 102.98 -2.97 . . . . 0.0 102.98 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -136.45 113.43 10.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.644 0.735 . . . . 0.0 112.478 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -87.67 96.88 10.59 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.82 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -151.62 139.19 19.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -93.68 137.82 32.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -121.81 120.1 33.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.353 0.121 . . . . 0.0 111.115 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -80.09 -48.63 12.94 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.559 0.695 . . . . 0.0 111.297 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -120.2 156.33 31.36 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.256 0.551 . . . . 0.0 112.4 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HE ' ' CB ' ' A' ' 95' ' ' ASP . 8.4 ptt85 -64.33 -15.52 60.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.249 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -65.11 -45.66 84.2 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -72.52 -36.29 68.29 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -178.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 20.5 ttt -57.46 -48.08 80.12 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -72.29 -31.81 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.744 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.48 -36.43 84.16 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -60.81 -41.23 95.28 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -66.34 -30.93 51.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 O-C-N 122.12 -0.363 . . . . 0.0 111.527 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -61.04 -39.44 89.81 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -76.55 -41.83 45.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.019 0.437 . . . . 0.0 110.168 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -55.99 -43.23 77.45 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.79 88.68 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -71.78 -34.18 69.2 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 121.72 -0.613 . . . . 0.0 109.989 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -63.28 -42.16 99.07 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.5 t -67.17 -32.24 56.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.782 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.9 -33.56 68.87 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.239 -0.913 . . . . 0.0 110.447 177.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.87 -40.45 79.26 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.99 0.424 . . . . 0.0 109.97 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.73 -36.75 75.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.082 0.468 . . . . 0.0 109.746 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -55.79 -39.44 71.28 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.113 -0.367 . . . . 0.0 110.668 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -59.28 -50.86 72.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.048 -178.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -73.37 -22.45 60.27 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -82.59 -18.06 42.61 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 122.015 -0.428 . . . . 0.0 112.032 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.09 2.06 12.05 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -75.58 152.71 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 118.108 0.954 . . . . 0.0 112.976 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.5 ttt85 -69.11 -22.84 63.95 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.903 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 -147.35 151.85 37.23 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 104.16 -2.533 . . . . 0.0 104.16 177.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -119.99 135.79 54.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.882 -1.895 . . . . 0.0 105.882 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -126.13 126.13 43.65 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 53.8 tp -114.13 134.47 54.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.817 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.6 tp -95.08 120.43 35.28 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 169.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -114.24 114.79 26.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.312 0.505 . . . . 0.0 110.362 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.5 t -109.08 111.01 34.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.004 0.431 . . . . 0.0 112.048 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -77.21 141.69 39.94 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -116.11 103.68 10.8 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.7 m -128.36 150.62 50.02 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.546 0.529 . . . . 0.0 111.141 -174.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.3 t -70.61 -29.0 65.27 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.511 -0.743 . . . . 0.0 110.458 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -148.54 164.06 35.35 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.64 157.51 49.37 Favored Pre-proline 0 C--N 1.319 -0.718 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.87 147.33 62.8 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.44 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 19.8 m -65.84 -14.16 16.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -152.0 146.64 25.73 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -177.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.48 ' CB ' ' HE ' ' A' ' 54' ' ' ARG . 60.1 m-20 47.22 6.28 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 120.243 3.423 . . . . 0.0 120.243 176.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -58.95 -25.89 63.93 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.86 -1.15 . . . . 0.0 112.61 -175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.67 -32.24 73.27 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.996 -0.44 . . . . 0.0 112.18 -177.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.07 -33.49 75.54 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.853 0.835 . . . . 0.0 109.187 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.3 mm -69.21 -41.14 81.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.483 -173.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.87 -12.55 61.02 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.082 0.468 . . . . 0.0 111.469 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -98.56 0.24 44.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.416 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -121.88 135.75 54.9 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.479 0.656 . . . . 0.0 112.346 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.8 m -82.59 126.95 32.88 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -85.42 119.0 25.29 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 176.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -123.45 131.79 53.75 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -139.31 103.6 4.78 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.738 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.96 -112.7 4.35 Favored Glycine 0 C--O 1.224 -0.497 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.0 p -108.59 8.31 27.06 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.171 0.51 . . . . 0.0 110.578 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 86.1 t -95.38 141.49 15.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.6 t -127.35 135.67 50.84 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 175.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.4 t -134.25 134.94 54.88 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.603 0 CA-C-O 122.107 0.956 . . . . 0.0 109.284 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -103.18 101.88 24.94 Favored Pre-proline 0 N--CA 1.427 -1.582 0 CA-C-N 113.26 -1.791 . . . . 0.0 108.207 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.31 145.43 24.02 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 116.941 -1.573 . . . . 0.0 112.451 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.36 154.57 40.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 tt -147.33 128.78 6.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.36 121.53 60.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.45 140.03 42.34 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -175.875 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.56 -32.54 53.42 Favored Glycine 0 C--O 1.229 -0.176 0 CA-C-N 115.568 -0.742 . . . . 0.0 114.188 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 32.9 p -53.35 -30.19 38.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 115.718 1.747 . . . . 0.0 115.718 -178.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.5 ptm -140.94 26.92 2.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.86 0.838 . . . . 0.0 109.44 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.7 tp -47.86 -40.88 22.69 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 118.263 2.69 . . . . 0.0 118.263 -168.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -41.75 94.93 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.675 1.125 . . . . 0.0 112.028 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.55 -40.25 35.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.981 0.896 . . . . 0.0 110.878 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -61.69 -41.86 98.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.589 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.96 -42.48 89.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.44 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -76.64 -15.09 59.91 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.626 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.35 -34.63 63.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.4 t -90.18 -43.17 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 109.903 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -120.49 78.89 28.78 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.773 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -69.68 -9.12 25.36 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 117.669 -1.087 . . . . 0.0 112.515 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 p -74.28 -14.92 60.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.396 176.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -96.72 134.17 40.34 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 -90.04 130.03 36.28 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 77.1 p -66.3 -23.15 66.33 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.107 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -64.46 -26.69 68.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.022 0.439 . . . . 0.0 111.078 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -76.43 -11.65 59.92 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.962 0.887 . . . . 0.0 110.176 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 17.0 t -118.74 44.58 2.25 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.83 143.77 46.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.958 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -59.33 -34.48 72.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.155 0.502 . . . . 0.0 112.209 -176.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -69.78 -11.61 60.99 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -116.77 -26.62 6.9 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.278 0.561 . . . . 0.0 111.27 -177.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -81.94 88.82 6.36 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 121.86 -0.525 . . . . 0.0 110.643 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 24.5 p -130.94 164.6 24.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.333 0.587 . . . . 0.0 111.089 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -59.93 -38.46 82.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.195 -178.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -72.55 -37.84 68.14 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.014 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -62.59 -24.38 67.53 Favored 'General case' 0 C--O 1.214 -0.797 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.506 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -31.72 55.91 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.112 -0.368 . . . . 0.0 111.662 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -64.58 -48.31 75.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.0 mmt -66.4 -35.64 80.83 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.913 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.55 -38.33 77.57 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.33 -0.231 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -65.34 -45.9 82.41 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.29 -43.43 98.88 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.148 0.499 . . . . 0.0 111.029 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.9 mmt-85 -63.17 -44.01 96.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.14 -41.56 88.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 177.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 80.2 mt -65.48 -35.8 81.96 Favored 'General case' 0 C--N 1.321 -0.657 0 O-C-N 121.646 -0.658 . . . . 0.0 111.2 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 87.6 p -75.81 -27.81 58.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.487 -0.758 . . . . 0.0 110.53 175.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.69 -43.68 65.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.474 -177.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.3 -33.07 57.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -73.84 -41.27 62.51 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 121.719 -0.613 . . . . 0.0 109.584 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -61.71 -32.35 72.56 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.464 -0.772 . . . . 0.0 111.059 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.77 -28.58 61.51 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 122.729 0.411 . . . . 0.0 110.689 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -62.37 -39.52 93.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.295 0.569 . . . . 0.0 109.739 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -76.03 -38.55 57.11 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.358 0.599 . . . . 0.0 109.729 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -59.65 -43.19 94.0 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 -66.39 -17.84 65.01 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -72.59 -48.57 38.68 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 43.9 p -72.43 -25.75 61.59 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -58.37 -28.98 65.64 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.531 0.732 . . . . 0.0 112.342 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.02 -26.97 51.09 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -84.19 62.54 7.18 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 177.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 31.6 m -60.59 140.89 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.592 0.71 . . . . 0.0 110.835 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -145.29 3.7 1.03 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -176.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -148.97 149.58 31.42 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 122.222 -0.299 . . . . 0.0 110.671 -175.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -146.88 160.69 42.0 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 178.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -170.06 171.88 43.63 Favored Glycine 0 C--O 1.228 -0.257 0 N-CA-C 109.123 -1.591 . . . . 0.0 109.123 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -158.06 169.79 23.76 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 39.4 tp -123.48 -35.46 2.93 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.159 0.799 . . . . 0.0 113.159 -178.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 55.39 33.61 21.23 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -73.03 110.75 7.55 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.49 150.8 50.0 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -152.35 -57.98 0.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.521 ' HG ' ' H ' ' A' ' 183' ' ' TYR . 10.4 tp 58.35 -161.52 0.24 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 123.975 0.797 . . . . 0.0 109.687 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . 0.521 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 49.6 p90 -159.68 159.94 33.57 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 104.224 -2.509 . . . . 0.0 104.224 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -160.93 169.44 22.6 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 105.709 -1.96 . . . . 0.0 105.709 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 . . . . . 0 C--O 1.253 1.265 0 N-CA-C 104.14 -2.541 . . . . 0.0 104.14 179.971 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.797 -0.62 . . . . 0.0 109.509 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -132.52 -51.31 0.93 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -64.33 -34.61 78.54 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 23.8 tp -63.08 -42.19 99.59 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.448 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -64.63 -41.05 96.43 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -58.59 -48.14 81.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.9 m -66.12 -43.46 87.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.352 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -55.09 -51.63 65.78 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.622 0.369 . . . . 0.0 110.984 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -72.3 -29.95 64.34 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.728 -0.607 . . . . 0.0 112.143 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -71.1 -35.54 71.84 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.557 -0.715 . . . . 0.0 111.166 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.1 mm -71.29 -37.83 67.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.14 -45.15 87.87 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 176.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.66 -40.8 96.07 Favored 'General case' 0 C--O 1.208 -1.123 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -58.94 -49.81 76.44 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.2 mp -68.35 -45.42 72.9 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.089 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.76 -42.77 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.937 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -61.97 -26.53 68.26 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 121.915 -0.491 . . . . 0.0 111.72 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -82.53 5.24 21.44 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 122.575 0.35 . . . . 0.0 111.763 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.12 -1.51 44.06 Favored Glycine 0 CA--C 1.517 0.164 0 N-CA-C 115.483 0.953 . . . . 0.0 115.483 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.01 123.05 19.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.817 0.808 . . . . 0.0 109.393 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.01 129.39 9.66 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.31 133.99 29.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.07 -41.94 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -149.2 142.24 24.87 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 104.804 -2.295 . . . . 0.0 104.804 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.2 105.2 4.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.02 41.68 26.73 Favored Glycine 0 C--O 1.225 -0.434 0 C-N-CA 120.784 -0.722 . . . . 0.0 113.128 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -60.43 -35.8 76.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 122.369 1.08 . . . . 0.0 108.773 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 m -158.4 -69.43 0.09 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 174.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -135.42 14.12 3.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.67 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -133.18 152.28 51.95 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 93.2 mt -135.21 133.48 52.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -114.44 136.11 53.37 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.14 0.576 . . . . 0.0 109.654 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mp -132.91 137.97 46.8 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.349 0.66 . . . . 0.0 109.923 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -93.86 135.82 34.78 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.77 111.93 15.38 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -73.59 -24.96 15.48 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.523 -1.184 . . . . 0.0 114.173 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.19 -8.3 55.72 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt 58.15 43.95 19.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -68.19 -177.66 0.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 113.273 -1.785 . . . . 0.0 110.915 -177.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 p -56.27 -27.64 55.97 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.484 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -105.76 133.4 50.55 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -80.11 -39.81 28.77 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 120.96 0.409 . . . . 0.0 109.933 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.4 mt -137.38 160.35 39.32 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.716 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 58.5 t -131.51 137.43 55.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -123.35 132.27 53.93 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.2 124.08 47.92 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 174.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -136.54 150.0 48.4 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -125.81 119.91 29.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 118.181 0.446 . . . . 0.0 112.019 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.71 140.43 20.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -92.61 111.98 23.76 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.7 mt -104.09 125.19 50.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -87.22 -34.7 18.89 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.18 0.514 . . . . 0.0 110.708 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -130.29 148.01 52.07 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -177.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -67.38 -21.05 65.63 Favored 'General case' 0 CA--C 1.505 -0.768 0 O-C-N 121.088 -1.008 . . . . 0.0 111.803 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -62.11 -28.52 69.69 Favored 'General case' 0 C--O 1.213 -0.865 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.69 -45.07 25.95 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 175.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.4 ttm -54.56 -49.97 69.07 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.484 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.17 -31.87 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.25 -34.57 76.45 Favored 'General case' 0 CA--C 1.506 -0.745 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.238 -176.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -42.24 89.71 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -74.18 -34.43 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 122.019 -0.426 . . . . 0.0 111.355 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -41.54 92.05 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -76.3 -33.73 59.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.948 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -58.2 -46.62 85.51 Favored 'General case' 0 C--O 1.219 -0.52 0 O-C-N 121.966 -0.459 . . . . 0.0 109.798 176.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.05 -32.68 74.11 Favored 'General case' 0 N--CA 1.444 -0.755 0 O-C-N 122.403 -0.185 . . . . 0.0 110.623 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -46.54 85.35 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -61.67 -41.31 97.38 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 86.7 t -61.31 -35.34 65.56 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.74 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.986 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -55.48 -38.99 69.85 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.493 1.042 . . . . 0.0 110.597 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -73.93 -45.79 48.3 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.705 0.288 . . . . 0.0 111.118 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.06 -44.33 95.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.652 0.263 . . . . 0.0 111.698 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -30.1 70.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.151 -0.968 . . . . 0.0 110.167 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -68.89 -43.15 75.86 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.12 -30.99 70.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.879 0.371 . . . . 0.0 111.246 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -83.33 -14.0 53.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.489 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.98 -3.09 30.63 Favored Glycine 0 CA--C 1.522 0.469 0 N-CA-C 114.191 0.437 . . . . 0.0 114.191 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -71.0 136.02 48.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -64.24 -45.79 86.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 122.124 -0.36 . . . . 0.0 111.785 -176.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -119.98 162.26 19.52 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 178.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.4 ttp -145.31 138.84 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.363 174.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -113.63 143.46 44.53 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 123.647 0.592 . . . . 0.0 109.863 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.1 tt -139.47 136.85 35.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.0 tp -99.22 106.35 18.49 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -97.31 108.52 21.26 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.41 116.31 46.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -175.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -85.98 151.37 23.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -126.3 129.43 48.85 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 172.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.5 p -147.62 163.02 37.94 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.017 0.198 . . . . 0.0 110.784 -174.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.0 m -67.09 -48.96 66.59 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 173.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -151.41 165.99 32.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 105.188 -2.153 . . . . 0.0 105.188 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.16 158.14 36.5 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.14 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -54.48 146.01 54.7 Favored 'Trans proline' 0 C--N 1.349 0.571 0 N-CA-C 116.902 1.847 . . . . 0.0 116.902 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.6 m -77.18 -19.51 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.01 177.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -87.71 87.22 7.31 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.755 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 19.84 51.25 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 119.054 2.983 . . . . 0.0 119.054 176.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -63.05 -20.59 65.48 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.519 -0.738 . . . . 0.0 112.875 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.35 -31.29 69.06 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 122.246 -0.284 . . . . 0.0 111.451 -177.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.73 -30.35 71.46 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.685 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.4 mm -73.46 -38.51 53.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.86 0.362 . . . . 0.0 110.3 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.07 -25.3 67.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.101 0.953 . . . . 0.0 110.441 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -97.69 21.71 10.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.215 -177.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.3 ttmm -139.36 98.02 3.41 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.574 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 65.1 m -68.24 127.07 31.58 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.266 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -86.39 112.12 21.16 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -108.4 131.98 54.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.809 0.814 . . . . 0.0 110.103 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -128.86 84.51 2.24 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.94 -110.44 3.15 Favored Glycine 0 C--O 1.22 -0.78 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 71.7 p -98.09 -1.32 42.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 95.9 t -89.52 138.55 19.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.0 m -133.98 112.72 11.46 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 173.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.9 t -121.53 130.58 74.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -113.58 133.0 22.28 Favored Pre-proline 0 C--O 1.244 0.808 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -81.58 160.88 19.4 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 O-C-N 122.253 0.607 . . . . 0.0 112.446 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.86 152.59 36.72 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 102.444 -3.169 . . . . 0.0 102.444 174.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 tt -147.76 135.46 14.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 51.7 t -108.98 117.32 54.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.41 146.91 42.54 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.295 177.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.49 -41.5 8.35 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 172.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.3 t -65.51 -19.75 66.06 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -177.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 24.4 ptm -136.63 32.0 2.78 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 122.095 0.95 . . . . 0.0 109.355 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -49.19 -43.83 42.58 Favored 'General case' 0 C--O 1.213 -0.821 0 N-CA-C 116.545 2.054 . . . . 0.0 116.545 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.4 ptt-85 -54.69 -51.35 65.82 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.309 0.504 . . . . 0.0 112.052 -177.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -75.05 -39.66 60.81 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.951 -177.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -70.37 -32.12 69.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -175.586 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.45 -41.22 93.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.721 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.11 -21.23 66.77 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.7 -22.69 60.86 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.648 0.261 . . . . 0.0 110.91 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.0 t -109.06 -42.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.167 0.508 . . . . 0.0 111.554 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -125.54 73.88 68.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.366 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.83 -12.38 32.65 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 117.991 -0.873 . . . . 0.0 113.362 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.0 m -80.39 -5.08 55.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -103.6 132.95 49.41 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 39.5 mtp85 -70.51 102.97 2.34 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 3.7 t -68.26 -18.04 64.44 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.405 ' CD ' ' H ' ' A' ' 135' ' ' GLU . 18.5 mp0 -74.31 -12.05 60.43 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 123.241 0.617 . . . . 0.0 111.416 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -82.34 7.4 14.13 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 19.8 t -128.49 137.09 51.63 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 36.4 t -138.45 132.26 31.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.545 0.688 . . . . 0.0 112.564 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 57.1 tt0 -68.28 -37.31 80.55 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.513 -1.222 . . . . 0.0 109.285 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -64.62 -27.94 69.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.967 -177.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -93.54 -9.4 38.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.017 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 63.25 -44.73 0.22 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 -178.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.6 m 54.51 25.68 6.44 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -64.72 -50.52 66.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.771 0.319 . . . . 0.0 111.565 -177.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -72.45 -28.8 63.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.892 0.853 . . . . 0.0 109.841 178.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -66.26 -23.54 66.42 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.688 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -39.85 72.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.731 0.3 . . . . 0.0 111.524 177.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -68.67 -41.94 78.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.531 0.681 . . . . 0.0 109.266 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 46.3 mtt -64.41 -37.0 86.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.84 -37.55 87.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.447 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -64.61 -52.6 56.64 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -63.85 -36.02 82.55 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.373 0.606 . . . . 0.0 111.148 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -63.86 -39.67 94.75 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -66.95 -42.14 85.74 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.129 0.171 . . . . 0.0 111.289 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.37 -34.84 75.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.177 0.513 . . . . 0.0 109.822 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 24.0 m -75.97 -35.69 59.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.392 0.615 . . . . 0.0 111.477 176.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 5.7 tt -65.56 -43.16 90.74 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.5 p -57.72 -40.76 77.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.739 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -67.91 -40.51 83.39 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.539 . . . . 0.0 110.265 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -67.44 -31.1 71.04 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 121.677 -0.639 . . . . 0.0 111.452 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -59.1 -28.48 66.56 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.953 -0.467 . . . . 0.0 111.835 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -57.36 -37.19 72.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.089 0.471 . . . . 0.0 110.095 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -76.98 -45.91 25.84 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.482 0.658 . . . . 0.0 109.864 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -60.23 -51.62 68.79 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 34.0 ptt-85 -64.96 -22.11 66.95 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.59 1.086 . . . . 0.0 113.38 -175.425 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -70.9 -39.3 72.83 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 21.5 m -72.41 -46.44 55.18 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.92 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -66.61 -24.24 66.29 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -177.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -59.96 -23.11 63.32 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.519 0.199 . . . . 0.0 111.523 177.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -81.96 69.18 8.61 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 176.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 30.0 m -65.93 143.71 15.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -158.91 -42.97 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.008 -0.997 . . . . 0.0 109.548 175.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 40.08 -145.15 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.838 1.255 . . . . 0.0 113.81 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -154.42 166.4 33.36 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -82.09 102.04 2.25 Favored Glycine 0 C--N 1.323 -0.185 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.54 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -152.43 166.1 32.98 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 176.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -154.71 162.45 41.12 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 105.373 -2.084 . . . . 0.0 105.373 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -138.6 164.18 30.15 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 53.7 ptt85 -157.99 148.17 20.34 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -154.96 171.41 19.75 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 103.975 -2.602 . . . . 0.0 103.975 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -147.83 138.5 23.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.838 0.744 . . . . 0.0 111.171 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 4.0 tt -111.18 -25.25 9.82 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 123.913 0.758 . . . . 0.0 110.698 177.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -80.72 106.76 12.97 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.778 0.799 . . . . 0.0 113.033 -175.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -127.46 114.55 17.62 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 176.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.111 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -175.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 ttt . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 119.258 -0.401 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -123.55 160.59 26.7 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.638 0.654 . . . . 0.0 109.639 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tt -67.83 -44.67 76.68 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -176.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -60.99 -32.41 71.98 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.649 0.737 . . . . 0.0 112.052 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -56.98 -27.15 61.13 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -61.29 -52.3 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 178.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 m -69.45 -40.22 77.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.141 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -52.82 -58.03 8.24 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -68.01 -28.07 67.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.476 -0.765 . . . . 0.0 111.905 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -73.18 -29.87 63.14 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 122.09 -0.381 . . . . 0.0 111.455 178.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mm -69.87 -41.88 79.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 175.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.56 80.28 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.42 98.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.094 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -39.32 86.33 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.644 -0.423 . . . . 0.0 111.27 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.45 -44.23 83.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.84 -42.58 89.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.027 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -77.96 -2.41 36.79 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.358 -0.839 . . . . 0.0 112.692 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -98.37 7.96 45.5 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 173.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.54 -1.32 57.02 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 116.694 1.437 . . . . 0.0 116.694 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.409 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 12.8 m-85 -69.69 125.32 26.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 118.336 1.068 . . . . 0.0 110.442 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.46 133.67 13.1 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.6 t -78.25 117.09 22.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 75.3 mt -87.24 -44.74 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -149.56 123.26 9.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.827 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 127.62 21.4 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.115 -2.55 . . . . 0.0 104.115 172.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 167.22 -38.57 0.24 Allowed Glycine 0 CA--C 1.503 -0.658 0 N-CA-C 108.898 -1.681 . . . . 0.0 108.898 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -67.93 146.87 53.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 106.298 -1.742 . . . . 0.0 106.298 175.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.3 m -79.34 -14.94 58.66 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -178.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.88 -18.04 10.84 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -173.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -135.53 141.02 45.17 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 42.3 mt -136.1 131.69 49.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -106.83 128.74 54.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.09 133.45 53.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.564 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -87.52 137.03 32.69 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.03 107.25 11.03 Favored Pre-proline 0 CA--C 1.549 0.921 0 O-C-N 123.034 0.209 . . . . 0.0 111.554 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 90.2 Cg_endo -73.49 -20.23 20.92 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 118.009 -0.861 . . . . 0.0 112.418 -178.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.88 -25.45 66.4 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.708 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mttt 59.59 40.75 19.86 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 -173.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.0 p -75.79 -177.52 3.82 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 112.498 -2.137 . . . . 0.0 108.728 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.2 -1.56 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -136.08 133.57 37.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -76.91 -35.75 57.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.449 0.643 . . . . 0.0 109.898 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 54.8 mt -136.24 162.62 32.47 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -179.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.0 t -126.4 133.7 68.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -118.47 115.67 25.1 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 tp -90.24 123.31 33.93 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -136.35 141.9 43.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 117.902 0.319 . . . . 0.0 111.548 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -111.39 119.73 39.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 t-160 -151.71 123.62 8.06 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.21 121.0 26.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.42 108.3 18.28 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -176.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -70.29 -46.84 63.49 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 122.458 1.123 . . . . 0.0 109.856 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -119.78 155.46 32.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.051 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -62.56 -22.29 66.23 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -65.58 -32.26 73.75 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -69.96 -49.12 54.94 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.534 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -66.48 -32.07 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -71.24 -27.65 63.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.303 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -68.5 -37.52 80.14 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.84 -30.64 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.334 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.88 -42.13 98.69 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -70.05 -41.8 73.71 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.029 0.919 . . . . 0.0 109.187 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.59 -37.11 77.67 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.005 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.34 -41.92 96.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.853 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -64.26 -39.95 94.99 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.95 -44.52 97.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.3 t -67.08 -40.86 86.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.666 0 CA-C-O 119.737 -0.173 . . . . 0.0 110.57 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -35.01 72.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.262 0.553 . . . . 0.0 109.932 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -73.6 -45.73 51.29 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.803 -0.561 . . . . 0.0 110.786 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.68 -42.69 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -59.36 -30.23 68.26 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.341 -0.849 . . . . 0.0 110.729 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -66.16 -36.73 83.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -70.27 -39.66 74.82 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 121.315 0.579 . . . . 0.0 109.689 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.6 mt -75.38 -7.79 54.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.264 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.53 10.53 63.64 Favored Glycine 0 CA--C 1.522 0.485 0 CA-C-O 121.316 0.398 . . . . 0.0 113.368 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -76.23 137.67 40.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.366 0.603 . . . . 0.0 110.333 -176.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -72.0 -30.53 65.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.994 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -151.46 149.34 29.14 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 103.791 -2.67 . . . . 0.0 103.791 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.7 ttp -131.42 143.15 50.24 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 118.913 0.779 . . . . 0.0 109.901 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.1 mtpt -107.57 136.94 46.49 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.0 tp -125.75 137.31 53.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.3 tp -94.81 121.27 36.23 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.36 135.53 42.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.0 t -132.79 111.62 17.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -82.75 150.58 26.59 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.584 0.553 . . . . 0.0 110.541 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -128.94 115.87 18.5 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 173.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 96.2 p -137.06 160.8 37.88 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 123.478 0.486 . . . . 0.0 110.6 -177.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.7 t -70.55 -30.89 67.74 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.909 -0.495 . . . . 0.0 110.992 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -152.93 170.82 19.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.85 154.8 61.45 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -58.73 148.41 83.06 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 117.469 -1.221 . . . . 0.0 111.902 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 25.6 m -61.41 -22.22 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -155.49 147.2 23.14 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 48.4 9.24 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 120.027 3.343 . . . . 0.0 120.027 172.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.2 p-90 -63.46 -23.11 67.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 114.252 1.205 . . . . 0.0 114.252 -176.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -60.58 -31.35 70.49 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.927 -0.483 . . . . 0.0 112.006 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -58.47 -32.93 69.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.622 0.725 . . . . 0.0 109.873 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.6 mm -69.85 -39.37 77.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -175.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.91 -8.02 53.7 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -112.0 2.82 17.06 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.439 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -112.73 133.68 54.63 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.405 0.621 . . . . 0.0 111.426 -178.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 54.2 m -79.39 125.0 28.96 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -86.34 121.05 28.37 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -128.07 139.89 52.27 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 122.024 0.916 . . . . 0.0 113.448 -177.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -140.34 75.27 1.5 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.056 -1.429 . . . . 0.0 108.831 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.13 -110.8 3.6 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 119.575 -1.298 . . . . 0.0 112.331 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.3 p -73.82 10.53 1.11 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.164 0.985 . . . . 0.0 112.941 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.8 t -130.46 142.94 42.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 121.869 -0.52 . . . . 0.0 111.079 -177.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.0 t -142.22 131.52 23.54 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 173.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.8 t -134.02 138.83 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.111 0 CA-C-O 121.942 0.877 . . . . 0.0 110.27 -177.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -111.89 110.07 54.67 Favored Pre-proline 0 N--CA 1.435 -1.178 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.485 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.19 157.68 20.08 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 115.878 -2.281 . . . . 0.0 113.345 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.1 156.76 37.85 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.2 tt -146.88 132.88 12.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.47 0.653 . . . . 0.0 111.517 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.1 119.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.6 136.36 53.12 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.09 -35.95 42.62 Favored Glycine 0 C--O 1.221 -0.669 0 N-CA-C 117.182 1.633 . . . . 0.0 117.182 -174.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -22.54 57.18 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -147.58 40.66 1.01 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.735 1.255 . . . . 0.0 108.631 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.2 tt -48.48 -54.17 15.24 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.0 ttt180 -57.32 -36.19 70.82 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.785 1.175 . . . . 0.0 113.931 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.06 -41.23 64.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.069 0.462 . . . . 0.0 110.425 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -66.04 -39.09 89.89 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.396 1.093 . . . . 0.0 109.362 178.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.77 -48.66 78.19 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.316 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -72.33 -16.07 61.88 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.432 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.1 -36.2 55.85 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.407 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.05 -44.08 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.435 0.635 . . . . 0.0 110.443 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -128.5 77.16 77.67 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.931 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -66.69 -16.04 49.25 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 118.195 -0.736 . . . . 0.0 112.896 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.5 m -74.8 -10.52 59.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 178.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -71.35 129.31 38.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.892 0.853 . . . . 0.0 110.868 -178.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -83.95 86.5 7.17 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.704 -177.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 21.6 p -67.24 -13.59 62.12 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.748 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -73.58 -29.43 62.41 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.404 0.621 . . . . 0.0 110.441 176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -88.47 -29.17 20.36 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.054 0.931 . . . . 0.0 109.412 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 88.5 m -129.17 66.63 1.44 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.224 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.6 m -65.03 144.23 57.41 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -67.24 -24.0 65.76 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.837 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -59.33 -22.38 61.19 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.666 0.746 . . . . 0.0 110.971 176.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -106.97 11.42 29.84 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.342 -177.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -77.87 117.89 19.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 15.2 m -144.02 153.11 41.88 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 34.2 p90 -66.23 -30.07 70.44 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -72.65 -44.95 61.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.617 0.723 . . . . 0.0 110.084 175.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -61.77 -24.3 66.75 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.99 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.36 -30.86 69.82 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -68.28 -39.54 82.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.4 mtt -68.16 -28.92 67.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.71 -35.21 79.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.342 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -65.27 -49.54 69.19 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 178.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -60.38 -42.15 95.24 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.492 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -61.46 -40.72 95.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.66 -43.46 93.55 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 70.4 mt -65.02 -37.94 89.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.164 0.507 . . . . 0.0 110.148 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 35.4 m -69.25 -34.67 75.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.409 0.623 . . . . 0.0 110.382 177.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.28 -45.88 78.93 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.353 -178.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.7 p -63.78 -34.04 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.068 0.849 . . . . 0.0 110.959 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -65.38 -46.97 78.01 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -66.33 -29.89 70.17 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.12 0.486 . . . . 0.0 111.431 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 39.2 tp60 -58.35 -28.37 65.04 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 121.185 -0.947 . . . . 0.0 109.463 177.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.26 -36.08 76.75 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.865 -0.522 . . . . 0.0 111.021 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -76.78 -33.6 58.03 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 178.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -66.59 -31.49 72.23 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.389 176.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . 0.405 ' HE ' ' CD ' ' A' ' 168' ' ' GLU . 0.0 OUTLIER -53.22 -28.72 28.53 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -177.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 15.1 mttm -67.27 -45.94 75.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.464 -179.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 36.5 p -77.28 -28.42 53.4 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 122.24 -0.288 . . . . 0.0 111.762 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.405 ' CD ' ' HE ' ' A' ' 165' ' ' ARG . 35.0 tt0 -60.32 -24.2 64.82 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.911 0.885 . . . . 0.0 112.54 -178.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.93 -14.22 59.31 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -75.2 125.13 28.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.061 0.457 . . . . 0.0 110.087 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 48.8 t -68.94 123.72 23.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.2 167.79 26.7 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -138.36 152.65 48.63 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 38.1 t-20 -140.26 80.07 1.74 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.186 0.517 . . . . 0.0 111.103 -178.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 77.15 -168.73 54.77 Favored Glycine 0 CA--C 1.518 0.225 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.513 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -153.62 174.26 14.7 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.88 136.89 52.95 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 104.464 -2.421 . . . . 0.0 104.464 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -145.52 143.83 30.19 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -142.98 134.79 26.75 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -117.31 148.91 41.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -154.43 134.79 13.33 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.601 0.223 . . . . 0.0 111.601 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -162.72 167.24 23.33 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 104.477 -2.416 . . . . 0.0 104.477 176.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -115.93 -33.54 5.06 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.57 150.8 0.07 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.068 1.347 . . . . 0.0 113.81 -177.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 . . . . . 0 C--O 1.253 1.242 0 N-CA-C 104.473 -2.417 . . . . 0.0 104.473 179.828 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpt? . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -150.83 167.36 27.73 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.1 tp -55.73 -46.38 77.78 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.62 -37.96 80.04 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.905 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -62.52 -35.9 80.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.545 -175.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -62.52 -48.28 80.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 21.0 m -69.35 -37.33 77.6 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.412 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -57.17 -51.3 69.86 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.518 0.727 . . . . 0.0 110.296 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -69.29 -29.75 67.69 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.625 -0.672 . . . . 0.0 111.098 178.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -68.48 -36.06 78.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.814 -0.554 . . . . 0.0 111.044 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.9 mm -72.34 -38.88 62.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 176.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.86 84.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.0 95.41 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.612 178.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -60.67 -45.6 93.52 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 122.708 0.403 . . . . 0.0 110.619 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.11 -46.32 78.03 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.711 0.291 . . . . 0.0 110.562 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.57 -37.91 80.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.951 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -63.98 -31.87 73.21 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.997 -0.439 . . . . 0.0 110.479 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.2 t -79.17 9.42 4.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 122.883 0.473 . . . . 0.0 111.52 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 92.17 1.05 70.07 Favored Glycine 0 N--CA 1.453 -0.189 0 N-CA-C 116.295 1.278 . . . . 0.0 116.295 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -64.74 126.08 26.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.278 1.039 . . . . 0.0 109.454 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.93 132.11 11.58 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.8 t -77.34 117.51 22.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 63.4 mt -87.02 -47.01 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -149.78 123.15 9.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.297 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.23 105.27 4.99 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 104.137 -2.542 . . . . 0.0 104.137 173.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -125.79 -79.54 0.35 Allowed Glycine 0 CA--C 1.504 -0.595 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -87.59 174.5 8.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.239 0.543 . . . . 0.0 110.641 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.7 m -83.65 12.03 6.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.685 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -95.14 -43.86 7.91 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -176.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -141.92 150.36 41.38 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -178.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.3 mt -138.19 127.65 33.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -103.6 130.0 50.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.51 138.13 54.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 123.626 0.77 . . . . 0.0 110.239 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -92.37 134.72 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 112.12 15.42 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 122.133 0.173 . . . . 0.0 110.74 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.81 -26.98 9.14 Favored 'Trans proline' 0 C--N 1.352 0.759 0 N-CA-C 114.932 1.089 . . . . 0.0 114.932 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -73.77 -5.02 38.22 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 57.62 42.19 24.38 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -176.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 p -70.0 -177.68 1.4 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 113.338 -1.755 . . . . 0.0 112.367 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.1 m -56.18 -30.36 62.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.091 176.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 84.3 m-70 -92.78 134.54 34.95 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -78.53 -45.45 21.88 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.6 mt -141.84 164.74 29.37 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.548 -174.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 85.6 t -133.59 138.88 50.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -121.91 128.15 51.23 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -98.17 131.97 44.09 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -136.19 141.31 44.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 118.134 0.425 . . . . 0.0 110.204 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.8 95.59 4.48 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -176.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -151.67 146.26 25.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 178.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -86.7 151.57 23.29 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.3 mt -138.73 129.12 25.86 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 122.251 0.22 . . . . 0.0 110.645 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -91.51 -37.3 13.22 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.974 0.416 . . . . 0.0 110.302 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -129.56 147.79 51.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 24.2 ptt-85 -65.38 -22.16 66.76 Favored 'General case' 0 CA--C 1.507 -0.708 0 O-C-N 121.645 -0.659 . . . . 0.0 111.945 -177.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -62.09 -31.04 71.43 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.01 -39.35 63.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.7 ttm -62.51 -50.48 71.24 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.489 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.9 m -60.36 -31.97 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.39 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -69.16 -34.0 74.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.664 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -63.99 -40.7 96.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.403 0.62 . . . . 0.0 109.669 177.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.1 mt -70.88 -33.3 51.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.777 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -62.61 -32.75 73.82 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 176.21 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -67.91 -49.88 59.35 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.42 -39.25 70.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.231 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.97 -37.28 81.88 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.06 -42.22 80.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.602 0.715 . . . . 0.0 109.186 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -62.43 -42.49 99.49 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.407 0.622 . . . . 0.0 109.738 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.73 -42.96 83.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.953 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -66.99 -33.47 75.64 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.101 -179.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -41.78 86.81 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 176.366 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 95.3 t -73.02 -38.76 56.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.49 -35.33 77.37 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.288 -0.882 . . . . 0.0 111.595 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 -58.33 -39.94 80.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 109.87 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -73.41 -20.67 60.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.0 mp -106.01 -15.73 14.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.09 4.43 42.46 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.778 1.071 . . . . 0.0 115.778 178.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -76.89 135.63 38.83 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.632 -0.922 . . . . 0.0 109.338 -178.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -66.84 -20.66 65.97 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 -175.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.427 HH21 ' CD ' ' A' ' 105' ' ' GLU . 40.6 ttt180 -152.06 154.08 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.6 151.39 50.25 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 177.038 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.7 mttt -126.11 117.46 23.21 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 170.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -116.81 126.75 53.53 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.69 123.92 34.68 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 176.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -119.26 109.64 16.07 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.83 112.84 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -176.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.16 133.03 35.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 122.87 0.468 . . . . 0.0 110.066 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -108.38 110.12 21.6 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 95.0 p -130.89 152.75 49.88 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 24.1 m -67.22 -46.51 73.6 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.864 0.84 . . . . 0.0 109.226 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -147.24 161.11 41.6 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.96 158.65 34.63 Favored Pre-proline 0 C--N 1.312 -1.058 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.797 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -54.02 150.84 29.54 Favored 'Trans proline' 0 C--N 1.349 0.563 0 N-CA-C 116.254 1.598 . . . . 0.0 116.254 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.5 m -76.5 -11.96 14.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.88 101.66 8.03 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 40.14 27.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 119.442 3.127 . . . . 0.0 119.442 172.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.4 p-90 -59.72 -20.97 59.86 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.47 -0.769 . . . . 0.0 112.88 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -60.08 -31.29 69.88 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -175.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -66.15 -34.63 78.48 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 11.7 mm -65.37 -43.89 94.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.502 -174.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.33 -1.27 20.08 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -111.98 -2.82 14.99 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -103.31 115.23 30.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.91 -175.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.1 m -68.24 126.59 30.03 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 172.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -88.32 128.05 35.49 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.427 ' CD ' HH21 ' A' ' 79' ' ' ARG . 8.0 mt-10 -126.91 140.65 52.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.453 0.644 . . . . 0.0 111.433 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -140.87 75.49 1.51 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.179 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.89 -111.97 4.14 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 119.897 -1.144 . . . . 0.0 111.609 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 41.1 p -80.23 13.21 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.83 137.97 55.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.0 m -133.58 133.6 42.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 84.2 t -123.59 138.58 52.93 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.875 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -102.46 99.64 13.62 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.84 120.01 2.99 Favored 'Trans proline' 0 C--N 1.349 0.597 0 CA-C-O 121.395 0.498 . . . . 0.0 113.035 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -127.22 145.4 50.78 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.5 tt -138.72 139.16 41.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.3 m -116.83 133.71 62.68 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-O 122.109 0.957 . . . . 0.0 108.484 174.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.46 152.64 27.27 Favored 'General case' 0 C--O 1.207 -1.152 0 CA-C-N 114.363 -1.289 . . . . 0.0 108.456 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.4 -41.21 8.55 Favored Glycine 0 C--N 1.317 -0.509 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.8 t -61.74 -26.19 67.91 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 27.0 ptm -131.41 32.87 4.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.201 1.001 . . . . 0.0 110.573 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 28.1 tp -51.3 -41.49 60.53 Favored 'General case' 0 C--O 1.211 -0.959 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -174.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.744 -176.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -78.37 -40.14 37.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.618 0.723 . . . . 0.0 111.936 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.49 -39.06 85.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.5 0.667 . . . . 0.0 112.508 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -63.47 -43.32 97.66 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.061 -0.399 . . . . 0.0 111.268 -177.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -72.58 -14.7 61.68 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.678 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.2 -32.09 62.91 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.3 t -92.08 -43.65 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-O 121.245 0.545 . . . . 0.0 110.264 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -124.66 78.05 63.73 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.187 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.11 -11.17 31.03 Favored 'Trans proline' 0 C--N 1.346 0.446 0 N-CA-C 114.197 0.807 . . . . 0.0 114.197 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 19.3 t -78.0 -14.85 59.37 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.278 0.561 . . . . 0.0 110.426 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -80.88 124.93 29.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.314 0.578 . . . . 0.0 110.254 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 38.3 mtp-105 -78.31 130.41 36.16 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 26.2 p -66.5 -20.14 65.96 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.019 0.438 . . . . 0.0 111.607 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -58.76 -30.26 67.4 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 123.408 0.683 . . . . 0.0 111.203 178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.79 -16.96 64.62 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 96.7 m -128.0 70.49 1.35 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -178.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.2 m -75.15 144.44 42.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.1 -31.62 72.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.124 0.488 . . . . 0.0 111.635 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -62.45 -28.46 69.83 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.687 0.756 . . . . 0.0 111.103 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -86.01 -11.69 52.25 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.936 -179.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -76.28 91.56 3.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.643 0.735 . . . . 0.0 112.334 -176.019 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.8 t -131.2 152.08 50.84 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -58.5 -38.96 78.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.007 0.432 . . . . 0.0 111.155 -177.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -72.58 -41.06 66.09 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 122.312 -0.243 . . . . 0.0 110.981 179.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 52.7 m-20 -62.59 -30.83 71.62 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.791 0.329 . . . . 0.0 110.667 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.19 90.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.81 0.338 . . . . 0.0 110.608 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.37 -43.46 70.08 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 74.4 mtp -61.35 -27.61 68.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.265 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.859 -0.526 . . . . 0.0 110.683 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -64.41 -45.95 85.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.08 -42.54 94.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.42 0.628 . . . . 0.0 110.184 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 70.5 mmt-85 -66.5 -40.16 89.1 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.814 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -62.68 -42.52 99.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.229 0.468 . . . . 0.0 111.262 176.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.34 -39.42 94.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 84.8 p -71.58 -27.84 63.42 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.744 -0.598 . . . . 0.0 110.804 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.1 tt -72.33 -43.29 64.33 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.838 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 8.8 p -63.62 -36.19 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 118.935 0.789 . . . . 0.0 108.883 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.18 -40.91 90.83 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm -66.98 -36.5 82.32 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.698 -0.627 . . . . 0.0 111.487 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.14 -28.64 69.9 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -35.66 80.68 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -76.87 -42.99 37.8 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.794 -0.566 . . . . 0.0 110.431 176.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -60.73 -40.39 92.17 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . 0.415 ' HA ' ' HB2' ' A' ' 168' ' ' GLU . 8.6 ptm180 -62.98 -17.81 62.53 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -68.6 -43.53 76.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 38.9 p -76.01 -33.6 59.69 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.84 0.352 . . . . 0.0 110.618 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . 0.415 ' HB2' ' HA ' ' A' ' 165' ' ' ARG . 0.7 OUTLIER -61.92 -24.08 66.74 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 179.376 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.34 -14.06 35.64 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.62 150.8 48.51 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.622 0.725 . . . . 0.0 109.704 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 23.1 t -87.4 88.97 2.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 O-C-N 121.683 -0.636 . . . . 0.0 110.724 -178.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -129.73 -25.21 2.62 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 64.3 -56.09 0.25 Allowed 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 50.2 t30 56.88 36.45 27.76 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 113.496 0.925 . . . . 0.0 113.496 -177.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 89.54 -172.69 39.55 Favored Glycine 0 C--O 1.221 -0.698 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.096 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -152.57 142.71 22.35 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 122.056 -0.673 . . . . 0.0 110.697 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 65.6 tp -104.04 129.52 51.67 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 103.596 -2.742 . . . . 0.0 103.596 172.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -147.39 146.44 29.62 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.046 0.384 . . . . 0.0 111.092 -176.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.32 133.38 24.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 177.334 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -122.68 167.91 12.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 60.61 119.86 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 117.786 2.513 . . . . 0.0 117.786 176.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 63.2 tp -135.72 144.17 45.74 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 103.971 -2.604 . . . . 0.0 103.971 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 35.8 p90 -83.57 156.94 22.51 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 -178.298 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -145.26 64.42 1.27 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 . . . . . 0 C--O 1.241 0.632 0 N-CA-C 104.652 -2.351 . . . . 0.0 104.652 -176.249 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.496 1.847 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -64.07 -27.74 69.31 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 -175.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.89 -31.03 68.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.129 0.49 . . . . 0.0 111.041 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.62 -46.94 80.47 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.55 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 8.2 pt-20 -73.81 -29.14 61.99 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.698 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -56.93 -45.46 82.72 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.211 -1.404 . . . . 0.0 107.211 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.9 m -71.66 -44.52 64.15 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.292 0.568 . . . . 0.0 111.519 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.431 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 73.0 t80 -55.51 -51.25 67.65 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 123.873 0.869 . . . . 0.0 113.15 -178.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -68.64 -31.28 70.31 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.98 -0.45 . . . . 0.0 110.341 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.439 ' HZ2' ' CG ' ' A' ' 136' ' ' ASP . 58.7 mttt -70.84 -35.14 72.32 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.902 -0.499 . . . . 0.0 111.259 177.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 mm -69.06 -40.75 81.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 176.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.7 90.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.17 84.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.002 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -57.06 -47.28 81.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -68.69 -46.18 69.72 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.544 0.202 . . . . 0.0 111.544 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.11 -44.49 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-O 121.319 0.58 . . . . 0.0 110.153 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -72.44 -7.62 50.78 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -97.97 9.05 43.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.49 -6.17 45.16 Favored Glycine 0 CA--C 1.517 0.202 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 175.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -66.6 133.74 50.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 118.091 0.945 . . . . 0.0 109.598 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.5 115.65 4.36 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 107.47 -2.252 . . . . 0.0 107.47 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.5 p -71.08 130.13 34.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.9 mt -94.34 -42.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 -178.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -147.57 138.48 23.47 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.2 105.1 9.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.92 53.64 5.22 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.385 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.16 -36.76 73.48 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.6 m -166.67 -73.24 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 103.72 -2.696 . . . . 0.0 103.72 173.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -127.33 16.7 7.13 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.84 -1.073 . . . . 0.0 108.536 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -125.64 139.31 53.67 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.857 -1.065 . . . . 0.0 112.919 -172.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 80.8 mt -135.03 133.81 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -112.14 135.61 52.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -131.14 129.95 42.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -83.92 132.73 34.75 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.26 118.85 71.02 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -76.81 -23.99 10.44 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 117.408 -1.261 . . . . 0.0 115.089 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -75.49 -17.95 59.97 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -177.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt 61.03 37.77 17.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.484 1.135 . . . . 0.0 110.266 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -173.34 0.07 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 112.754 -2.021 . . . . 0.0 110.653 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.8 p -49.88 -42.61 48.21 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -78.8 138.25 38.11 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.068 0.461 . . . . 0.0 111.168 174.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -101.71 -37.2 8.43 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.058 176.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.4 mt -139.78 163.79 31.67 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -172.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -131.52 134.95 60.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 174.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -119.57 113.72 21.15 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 84.9 mt -95.61 125.0 39.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -136.35 130.47 32.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.624 0.193 . . . . 0.0 110.598 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -107.95 114.18 27.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.072 0.463 . . . . 0.0 109.959 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -151.64 142.71 23.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.105 -176.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -93.05 98.72 11.51 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -87.06 103.31 15.25 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.946 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -68.49 -42.6 78.42 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.784 0.802 . . . . 0.0 111.958 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -121.71 156.4 33.17 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.859 -0.525 . . . . 0.0 111.478 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -66.73 -16.06 63.98 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.147 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -63.74 -40.16 96.06 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -69.96 -36.73 75.48 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 55.7 ttm -61.33 -50.24 73.74 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.86 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.7 m -70.09 -31.95 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.243 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 -66.9 -34.65 78.25 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.206 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -64.56 -33.97 77.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mm -71.84 -30.89 39.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 O-C-N 121.634 -0.666 . . . . 0.0 110.956 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -64.23 -40.34 95.85 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.38 -44.25 91.95 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 121.935 0.874 . . . . 0.0 109.21 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -62.68 -39.67 94.69 Favored 'General case' 0 C--O 1.206 -1.222 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.233 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.49 -40.44 82.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 118.998 0.817 . . . . 0.0 111.518 -177.124 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -66.8 -41.47 87.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.565 0.697 . . . . 0.0 109.832 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.78 -47.29 84.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.522 0.677 . . . . 0.0 110.141 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.86 -42.64 97.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.258 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.42 -31.7 72.07 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 119.97 1.259 . . . . 0.0 111.401 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -64.72 -44.1 91.31 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.2 t -68.99 -36.03 71.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.185 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ttp-105 -59.24 -35.2 73.24 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.801 -0.562 . . . . 0.0 110.687 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -62.11 -39.04 91.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -73.4 -39.86 64.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.378 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.28 -17.96 61.26 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.17 -2.98 32.82 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 116.163 1.225 . . . . 0.0 116.163 177.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -71.39 152.6 43.0 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.384 1.092 . . . . 0.0 108.681 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.62 -27.19 61.99 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.795 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -142.03 159.43 42.24 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -122.19 141.78 51.11 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 53.5 tttp -123.35 127.95 49.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.4 tp -129.3 123.71 32.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.397 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -86.46 109.43 19.06 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -98.84 127.54 44.79 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 22.7 t -124.21 113.5 36.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-O 121.169 0.509 . . . . 0.0 111.469 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -84.18 142.81 30.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.78 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.55 109.82 16.16 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 173.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.0 p -125.59 161.09 27.99 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -173.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.3 m -67.17 -49.28 65.29 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -148.72 156.88 42.97 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 101.798 -3.408 . . . . 0.0 101.798 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.29 159.19 86.05 Favored Pre-proline 0 C--N 1.313 -0.989 0 O-C-N 124.268 0.98 . . . . 0.0 109.294 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.16 154.12 29.82 Favored 'Trans proline' 0 C--N 1.353 0.765 0 N-CA-C 115.081 1.147 . . . . 0.0 115.081 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.1 m -63.26 -24.48 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 118.089 2.626 . . . . 0.0 118.089 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -155.44 145.03 21.2 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 t0 45.88 19.48 0.06 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 117.896 2.554 . . . . 0.0 117.896 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 29.9 p-90 -76.08 -23.54 55.01 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 120.864 -1.147 . . . . 0.0 111.967 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.65 -37.7 76.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -18.4 64.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 111.832 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.7 mm -72.93 -40.17 59.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.88 0.61 17.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.153 0.501 . . . . 0.0 111.566 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -111.85 3.13 17.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.426 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -122.17 155.87 34.89 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.293 0.568 . . . . 0.0 111.396 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -102.0 126.04 48.82 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -83.46 112.56 20.07 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -118.29 123.14 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.518 0.675 . . . . 0.0 112.337 -176.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -124.24 75.49 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.57 -112.32 4.89 Favored Glycine 0 C--O 1.226 -0.401 0 C-N-CA 119.912 -1.137 . . . . 0.0 111.504 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 50.9 p -72.85 11.92 0.6 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 87.5 t -127.83 140.51 48.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 -178.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.2 p -138.05 125.39 21.8 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 105.77 -1.937 . . . . 0.0 105.77 169.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -128.85 133.4 66.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -113.45 116.74 45.94 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.74 156.13 27.47 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 118.109 -0.794 . . . . 0.0 112.892 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -147.54 155.05 41.48 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 102.889 -3.004 . . . . 0.0 102.889 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 16.3 tt -145.98 138.58 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.262 0.553 . . . . 0.0 109.733 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 8.2 m -115.9 142.06 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.868 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 172.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.95 150.72 40.05 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.593 -2.373 . . . . 0.0 104.593 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.98 -22.68 64.99 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.339 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.0 p -72.83 -30.05 63.72 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -176.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 mtm -129.25 20.84 5.75 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.378 0.609 . . . . 0.0 110.593 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.4 tt -42.18 -42.49 3.02 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 116.817 2.154 . . . . 0.0 116.817 -173.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 52.4 ptt85 -62.82 -40.53 97.68 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.632 -0.667 . . . . 0.0 111.934 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -78.66 -40.11 35.0 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.705 0.764 . . . . 0.0 109.867 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -59.22 -42.72 91.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.484 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.3 mt -62.22 -43.5 98.68 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -75.35 -14.14 60.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.965 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.59 -39.74 62.03 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.7 p -95.8 -38.54 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -125.21 77.32 67.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 123.14 0.576 . . . . 0.0 110.393 179.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.49 -7.45 20.31 Favored 'Trans proline' 0 C--N 1.345 0.393 0 N-CA-C 114.211 0.812 . . . . 0.0 114.211 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.4 m -92.67 1.68 57.13 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -81.45 140.37 34.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.061 0.458 . . . . 0.0 110.237 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -84.06 94.81 8.4 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.3 p -62.93 -21.25 65.92 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -61.75 -27.18 68.55 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.075 0.465 . . . . 0.0 111.282 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.439 ' CG ' ' HZ2' ' A' ' 10' ' ' LYS . 27.7 t0 -68.66 -16.15 63.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.571 0.7 . . . . 0.0 110.222 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 72.4 m -113.87 25.77 10.91 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.003 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 59.7 m -62.74 155.99 25.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.62 -28.45 67.22 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -66.22 -15.95 63.6 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 177.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -119.1 -1.84 10.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.996 0.427 . . . . 0.0 110.981 -177.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -86.09 34.85 0.62 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -173.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 43.3 t -65.06 144.06 57.51 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 177.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -66.75 -28.93 68.81 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -68.97 -26.39 65.02 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.711 0.767 . . . . 0.0 109.983 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -65.53 -19.67 66.02 Favored 'General case' 0 C--O 1.216 -0.672 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.164 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.19 81.4 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 122.057 -0.402 . . . . 0.0 110.188 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.43 -43.99 84.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 38.0 mmt -62.63 -36.7 83.64 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.412 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.25 -41.98 85.42 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.101 -0.374 . . . . 0.0 110.288 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -65.2 -50.41 66.0 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.791 0.329 . . . . 0.0 110.311 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -61.18 -41.86 97.54 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.378 0.608 . . . . 0.0 111.669 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -67.49 -36.49 81.2 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.84 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -62.33 -44.67 95.96 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.253 0.933 . . . . 0.0 111.365 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.61 -38.51 87.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 19.5 m -69.98 -35.2 74.25 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.448 0.642 . . . . 0.0 111.428 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.92 -37.7 86.76 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 123.794 0.838 . . . . 0.0 110.514 -178.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.2 t -57.45 -47.29 85.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.51 -38.41 80.9 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.487 0.66 . . . . 0.0 109.914 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -63.27 -30.59 71.7 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.908 -0.495 . . . . 0.0 112.271 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -26.66 66.01 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 117.983 0.356 . . . . 0.0 111.768 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -61.81 -39.97 93.63 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.515 0.674 . . . . 0.0 110.221 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 -67.32 -35.32 79.18 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 57.3 mm-40 -70.88 -31.49 68.17 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -50.56 -40.16 51.31 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -175.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -63.09 -17.78 62.68 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 81.8 p -68.85 -16.54 63.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.13 -24.33 67.09 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.829 0.347 . . . . 0.0 111.082 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -59.25 -14.02 9.69 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -79.52 -1.34 37.21 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.8 t 50.93 57.17 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 173.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -144.81 151.23 38.48 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 121.61 -0.681 . . . . 0.0 110.217 176.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -164.31 167.88 19.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -108.7 8.43 26.88 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.811 0.339 . . . . 0.0 111.019 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 79.61 -169.28 53.35 Favored Glycine 0 N--CA 1.454 -0.142 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 -176.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 23.7 pttp -148.29 165.07 32.11 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -128.26 160.12 33.12 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 104.708 -2.33 . . . . 0.0 104.708 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -143.69 163.55 32.95 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -121.11 21.09 11.36 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -65.89 121.15 14.41 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -138.47 98.64 3.63 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.305 0.574 . . . . 0.0 110.301 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 61.97 -160.05 0.31 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -176.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -158.39 160.17 36.6 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -143.82 152.04 40.69 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 . . . . . 0 C--O 1.249 1.044 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -177.355 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 ptp . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 120.738 0.304 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -136.74 158.06 45.32 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.41 -40.63 89.7 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.57 -33.22 75.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.359 0.599 . . . . 0.0 111.82 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.28 -30.07 71.28 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -62.06 -41.07 97.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.448 ' HA ' ' HE3' ' A' ' 10' ' ' LYS . 44.6 m -69.41 -44.11 72.06 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.461 -0.149 . . . . 0.0 110.973 176.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -52.35 -47.4 66.11 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.588 0.355 . . . . 0.0 110.557 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -67.8 -43.47 79.58 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.448 ' HE3' ' HA ' ' A' ' 7' ' ' THR . 19.9 pttp -73.51 -25.31 60.37 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.029 -1.044 . . . . 0.0 112.243 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.0 mm -72.31 -38.6 61.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 174.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.23 -40.91 78.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.5 -42.67 99.14 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.504 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -34.18 75.92 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.745 -0.597 . . . . 0.0 112.45 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.8 -44.46 63.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.9 t -53.64 -42.73 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.149 171.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.51 -31.07 70.14 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.72 -0.613 . . . . 0.0 110.66 178.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.3 m -82.56 9.31 9.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.17 1.26 62.9 Favored Glycine 0 CA--C 1.517 0.173 0 N-CA-C 115.827 1.091 . . . . 0.0 115.827 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -71.04 126.6 30.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.773 0.787 . . . . 0.0 109.662 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.23 113.72 3.78 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 107.338 -2.305 . . . . 0.0 107.338 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.9 p -70.31 128.67 33.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 75.8 mt -86.78 -38.84 12.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -144.16 134.64 24.68 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.29 140.91 35.79 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.38 -30.08 6.4 Favored Glycine 0 CA--C 1.506 -0.516 0 N-CA-C 107.75 -2.14 . . . . 0.0 107.75 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.452 ' HG3' ' H ' ' A' ' 30' ' ' GLU . 10.9 tp10 -68.3 136.27 53.21 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 174.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.6 m -98.5 -18.26 18.3 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -87.37 -47.93 8.39 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.502 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.452 ' H ' ' HG3' ' A' ' 27' ' ' GLU . 15.5 pt-20 -135.11 137.18 42.56 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -178.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.4 mt -125.3 131.5 72.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -111.38 139.57 46.68 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.01 129.73 42.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.997 0.919 . . . . 0.0 108.742 -177.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -82.05 130.61 35.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.72 113.03 22.91 Favored Pre-proline 0 CA--C 1.549 0.904 0 CA-C-N 117.715 0.234 . . . . 0.0 110.486 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -74.7 -18.71 19.32 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 117.825 -0.983 . . . . 0.0 113.36 -176.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.84 -23.34 60.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.851 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.0 mttt 60.42 38.84 19.11 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.2 p -71.7 -177.63 1.98 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 112.963 -1.926 . . . . 0.0 112.103 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.9 m -61.26 -10.01 6.09 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.345 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.68 132.32 54.29 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.33 -40.56 10.85 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -174.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -139.16 162.12 35.73 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.59 135.47 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 35.0 ttt-85 -124.66 116.31 22.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.519 0.728 . . . . 0.0 109.828 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.31 132.15 36.35 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 103.39 -2.818 . . . . 0.0 103.39 175.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -136.53 136.03 39.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.826 0.285 . . . . 0.0 110.901 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.53 113.55 27.19 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.787 -0.571 . . . . 0.0 110.543 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -151.62 149.88 29.65 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -108.34 131.42 54.75 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.5 mt -124.1 120.62 32.9 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -171.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -88.49 -37.81 15.48 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.887 0.851 . . . . 0.0 111.585 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -129.67 144.71 51.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.727 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -64.33 -17.54 63.78 Favored 'General case' 0 C--O 1.215 -0.736 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -60.75 -33.33 72.77 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.518 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -77.65 -34.91 52.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.065 0.459 . . . . 0.0 110.209 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.0 ttt -60.81 -48.83 80.0 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.559 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.2 m -66.31 -31.84 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.433 0.635 . . . . 0.0 110.086 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -38.21 87.15 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.198 -177.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -62.36 -38.99 91.68 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.3 mm -68.66 -31.81 52.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.949 -0.47 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -61.66 -39.48 91.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -44.32 58.17 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.689 0.757 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -59.53 -39.74 84.92 Favored 'General case' 0 C--O 1.21 -0.989 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.097 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.86 90.65 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.576 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -70.92 -35.95 72.46 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 119.887 -0.725 . . . . 0.0 109.759 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.83 -44.77 96.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.2 t -66.9 -39.76 84.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -62.21 -33.53 74.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 119.654 1.116 . . . . 0.0 111.187 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.8 ttt-85 -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -69.03 -37.41 77.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.935 0.398 . . . . 0.0 110.014 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -41.35 88.13 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.855 -0.528 . . . . 0.0 111.052 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -66.79 -40.11 88.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -63.48 -40.19 96.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.022 0.439 . . . . 0.0 110.861 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -78.02 -13.96 59.68 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.65 1.47 38.06 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -68.36 156.28 38.1 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.008 -0.701 . . . . 0.0 110.082 -177.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -39.35 93.85 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -149.41 167.99 24.65 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 103.453 -2.795 . . . . 0.0 103.453 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 ttp -129.18 147.97 51.08 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 118.746 0.703 . . . . 0.0 109.979 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -116.33 123.7 48.27 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 123.521 0.513 . . . . 0.0 110.559 177.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.4 tp -116.87 128.12 54.94 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.253 0.346 . . . . 0.0 111.405 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -91.32 110.83 22.13 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -102.54 129.12 48.99 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 32.6 t -121.05 109.38 25.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -76.84 142.95 40.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -119.35 107.62 13.59 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 172.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 97.7 p -126.74 155.65 42.41 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.33 -171.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 18.2 m -67.09 -47.91 69.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -147.0 158.19 43.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.813 -2.662 . . . . 0.0 103.813 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.92 157.14 39.83 Favored Pre-proline 0 C--N 1.312 -1.025 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.087 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -55.08 143.73 72.53 Favored 'Trans proline' 0 C--N 1.347 0.46 0 N-CA-C 116.374 1.644 . . . . 0.0 116.374 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.47 -21.72 15.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.638 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -90.81 91.98 8.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.872 178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.9 t0 14.88 70.98 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 117.773 2.509 . . . . 0.0 117.773 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -74.01 -16.85 61.04 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.608 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.75 -35.22 79.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.224 -0.298 . . . . 0.0 110.553 -175.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -60.81 -23.54 65.14 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.825 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.1 mm -79.04 -44.46 24.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 -176.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.04 -1.58 23.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.256 0.55 . . . . 0.0 111.917 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -108.59 5.35 24.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.503 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -124.72 132.27 53.39 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.153 0.502 . . . . 0.0 110.872 178.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -77.68 125.2 28.98 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 173.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -82.71 120.6 25.79 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -126.23 127.64 45.97 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.793 0.806 . . . . 0.0 110.008 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -139.3 114.71 9.79 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 60.21 -126.45 41.49 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 119.968 -1.11 . . . . 0.0 111.439 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.0 p -96.3 29.05 2.98 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.11 -0.641 . . . . 0.0 111.065 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 48.5 t -124.61 145.52 31.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.852 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.9 m -132.6 134.95 45.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.66 138.95 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.786 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 109.06 60.48 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -87.94 63.95 3.55 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.151 2.567 . . . . 0.0 117.171 -175.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 156.68 38.98 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.819 -0.551 . . . . 0.0 110.589 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -147.91 142.36 19.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 O-C-N 121.887 -0.508 . . . . 0.0 110.116 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.4 t -117.69 120.84 65.93 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.29 136.22 40.52 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.303 0.573 . . . . 0.0 109.857 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.45 -34.93 91.23 Favored Glycine 0 CA--C 1.51 -0.232 0 N-CA-C 114.868 0.707 . . . . 0.0 114.868 -176.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.2 t -53.16 -26.8 18.31 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.9 ptm -140.56 32.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.634 0.73 . . . . 0.0 109.808 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -46.64 -36.55 7.13 Favored 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 mtm180 -58.36 -46.99 85.23 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 121.496 -0.752 . . . . 0.0 111.175 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -78.65 -38.66 38.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.103 0.954 . . . . 0.0 111.922 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.63 -35.43 72.93 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.37 -41.05 73.61 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.887 -0.508 . . . . 0.0 110.684 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -69.3 -16.14 63.5 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.629 -177.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.82 65.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.067 0.461 . . . . 0.0 109.836 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.8 t -97.57 -43.84 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.457 0.646 . . . . 0.0 110.643 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -129.47 78.14 76.15 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.113 -178.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.05 -12.67 34.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 CA-C-O 121.381 0.492 . . . . 0.0 112.998 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -11.59 59.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -94.92 124.93 39.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.215 0.531 . . . . 0.0 111.164 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 -86.39 117.96 25.52 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 24.2 p -66.97 -24.12 66.02 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.161 -0.337 . . . . 0.0 110.985 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -65.04 -31.63 72.94 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -59.69 -35.17 73.94 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.283 0.563 . . . . 0.0 109.987 -177.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -169.97 116.44 0.55 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 175.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.4 t -115.05 158.52 22.0 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -68.23 -19.72 64.76 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.302 0.572 . . . . 0.0 109.744 177.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -66.11 -12.13 53.55 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.242 177.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -119.22 24.42 10.75 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -133.52 175.93 8.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 122.065 0.936 . . . . 0.0 112.264 -176.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.3 t -144.75 173.28 11.98 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 102.259 -3.237 . . . . 0.0 102.259 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -62.38 -28.81 70.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 118.016 0.371 . . . . 0.0 111.566 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -68.41 -31.21 70.38 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.435 0.636 . . . . 0.0 111.89 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -63.01 -24.53 67.96 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.935 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.21 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.625 0.25 . . . . 0.0 110.567 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -66.38 -35.53 80.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.499 0.666 . . . . 0.0 109.348 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 77.0 mtp -71.04 -30.8 67.08 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.787 -0.571 . . . . 0.0 109.998 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -70.95 -30.41 66.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -61.19 -52.22 65.73 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.4 -37.2 86.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.536 0.684 . . . . 0.0 110.449 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -60.01 -46.87 88.06 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.036 176.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -65.88 -41.86 91.07 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.97 -36.88 82.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 29.3 m -76.12 -32.94 59.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.56 0.695 . . . . 0.0 112.21 176.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -62.31 -42.78 99.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -176.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.5 p -57.73 -39.18 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.829 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -74.02 -42.6 60.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 110.027 176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -59.96 -32.1 70.49 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -56.61 -28.2 59.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.32 -39.39 75.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.026 0.441 . . . . 0.0 110.497 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -76.85 -36.26 56.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.179 0.514 . . . . 0.0 110.924 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -66.04 -49.8 66.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.979 0.419 . . . . 0.0 111.224 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -17.72 63.74 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.492 -0.483 . . . . 0.0 111.144 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -69.17 -46.81 66.59 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 23.6 p -72.55 -33.06 66.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.966 -0.293 . . . . 0.0 111.539 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -67.27 -24.32 65.77 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.042 0.448 . . . . 0.0 111.752 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.92 -14.14 51.16 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.48 149.39 34.48 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 24.6 t -78.58 96.24 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.43 0.633 . . . . 0.0 112.059 -176.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -151.03 165.23 34.41 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 174.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -158.07 164.73 36.4 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -156.74 164.6 37.94 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 177.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -78.31 146.29 30.25 Favored Glycine 0 N--CA 1.452 -0.274 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -153.21 163.49 39.79 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 104.861 -2.274 . . . . 0.0 104.861 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 45.6 tp -130.68 -97.43 0.34 Allowed 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 174.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 51.05 34.57 11.08 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 177.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -136.07 135.64 39.52 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.084 -0.385 . . . . 0.0 110.104 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -142.8 156.19 44.93 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 175.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -154.48 103.09 2.46 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -179.009 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 27.3 tp -130.9 144.43 51.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.238 0.542 . . . . 0.0 110.11 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -106.03 84.91 2.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.193 -173.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -69.05 -37.67 78.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 31.0 mm100 . . . . . 0 C--O 1.246 0.873 0 CA-C-O 117.558 -1.211 . . . . 0.0 113.195 178.745 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 C--O 1.204 -1.29 0 CA-C-O 118.485 -0.769 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 69.67 141.31 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.633 1.173 . . . . 0.0 112.57 -176.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp -68.43 -35.0 76.99 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.86 -0.525 . . . . 0.0 110.537 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.29 -35.35 78.75 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.81 -27.44 68.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.073 0.464 . . . . 0.0 110.222 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -65.13 -50.67 65.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -64.47 -39.79 94.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.256 0.551 . . . . 0.0 110.309 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -55.42 -52.44 63.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.318 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -71.54 -27.1 62.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.346 -0.846 . . . . 0.0 111.964 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -64.97 -39.52 93.6 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 22.2 mm -71.85 -38.2 64.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 178.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.49 -44.89 81.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 176.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.73 93.23 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.674 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -59.32 -47.03 86.94 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 122.747 0.419 . . . . 0.0 111.585 -179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.7 mt -68.39 -47.31 67.66 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.698 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -57.84 -39.77 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.886 -0.509 . . . . 0.0 110.519 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.32 -25.56 67.95 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 121.871 -0.518 . . . . 0.0 111.276 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -84.77 4.89 30.75 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.796 0.438 . . . . 0.0 111.366 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.14 -1.68 47.38 Favored Glycine 0 CA--C 1.518 0.249 0 N-CA-C 115.939 1.135 . . . . 0.0 115.939 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.414 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.3 m-85 -65.78 129.17 38.84 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 117.736 0.768 . . . . 0.0 110.864 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.3 134.88 13.69 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.6 t -79.38 122.4 34.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 76.7 mt -90.73 -44.96 14.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 176.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -155.0 146.24 22.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 177.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.16 105.17 4.98 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 178.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.85 43.35 7.25 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.993 176.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -57.29 -40.24 77.41 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 p -154.37 -74.74 0.12 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.966 -2.235 . . . . 0.0 104.966 176.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -132.06 15.72 4.67 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.393 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -129.09 151.75 49.43 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.2 mt -134.54 134.78 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -115.1 131.58 56.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -127.62 132.93 49.7 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.655 0.782 . . . . 0.0 109.908 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -86.22 134.84 33.75 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.13 109.75 13.67 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.5 Cg_endo -74.38 -24.41 14.25 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 117.889 -0.941 . . . . 0.0 114.054 -174.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -74.88 -4.45 37.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.859 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt 44.02 40.4 3.35 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 122.948 1.356 . . . . 0.0 111.875 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.3 m -67.21 -172.96 0.24 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 112.621 -2.081 . . . . 0.0 110.613 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.9 t -50.35 -35.72 29.12 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -83.3 138.95 33.34 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 173.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -98.04 -37.84 9.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -142.39 161.59 37.65 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.853 -175.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.5 t -132.55 136.25 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -122.11 130.18 53.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 176.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.06 128.72 54.62 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -136.43 143.56 43.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.87 99.81 6.32 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -151.69 149.47 29.13 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.49 151.56 20.72 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -133.18 124.54 27.63 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.275 0.23 . . . . 0.0 111.468 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -75.96 -42.7 47.7 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -136.04 151.03 49.43 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.203 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -63.98 -18.72 64.57 Favored 'General case' 0 C--O 1.212 -0.881 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -60.61 -33.17 72.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -77.22 -40.92 43.26 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.65 -40.88 89.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.0 -31.85 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 O-C-N 121.79 -0.569 . . . . 0.0 111.256 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -70.65 -34.62 72.24 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.628 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -59.32 -38.66 80.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mm -71.63 -31.31 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 121.99 -0.444 . . . . 0.0 111.457 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -63.07 -39.61 95.22 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -68.19 -45.41 73.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.705 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -58.05 -45.11 87.55 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.189 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.79 -31.18 69.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.56 -45.43 68.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.339 0.59 . . . . 0.0 109.454 177.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -61.51 -44.06 97.74 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.83 0.824 . . . . 0.0 109.299 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 73.6 t -65.73 -32.81 59.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.427 -178.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 121.764 -0.585 . . . . 0.0 109.434 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -62.16 -46.03 90.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.96 0.41 . . . . 0.0 110.273 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 79.7 t -61.74 -40.43 86.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.888 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -66.48 -40.26 89.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.16 -0.963 . . . . 0.0 111.877 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -55.47 -46.07 76.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -73.41 -18.79 61.11 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.3 mt -99.27 -10.04 22.88 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -177.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.81 -1.53 5.71 Favored Glycine 0 CA--C 1.531 1.052 0 N-CA-C 120.935 3.134 . . . . 0.0 120.935 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -67.9 154.19 42.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.161 1.481 . . . . 0.0 108.107 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -65.44 -29.51 70.2 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 ttt85 -151.41 147.92 27.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.48 150.32 23.5 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -134.43 122.22 22.21 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 168.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -124.0 129.74 51.42 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.8 tp -92.29 121.84 34.19 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -115.81 108.57 16.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 5.4 t -108.45 117.34 53.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -84.68 150.58 25.03 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -129.05 116.77 19.81 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -139.59 158.24 44.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.97 0.414 . . . . 0.0 111.887 -174.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 55.0 m -69.23 -49.23 58.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -128.28 170.43 13.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.67 154.17 43.3 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.75 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.15 146.17 89.43 Favored 'Trans proline' 0 C--N 1.348 0.551 0 N-CA-C 114.579 0.953 . . . . 0.0 114.579 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.9 m -82.17 -6.01 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -113.14 100.43 8.59 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.438 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.4 t0 14.43 60.41 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 117.981 2.585 . . . . 0.0 117.981 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 p-90 -73.1 -17.45 61.4 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.99 -32.45 73.99 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.03 -28.38 67.7 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.178 0.514 . . . . 0.0 110.137 175.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.1 mm -75.37 -40.66 42.7 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 O-C-N 122.013 -0.429 . . . . 0.0 110.588 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.11 62.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 122.138 0.97 . . . . 0.0 109.306 177.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -88.6 -3.02 58.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.849 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -126.38 130.39 50.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.754 0.788 . . . . 0.0 112.296 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.3 m -76.41 125.62 29.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -83.3 123.08 29.27 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 176.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -127.65 139.19 52.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.774 0.797 . . . . 0.0 111.649 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -139.97 82.06 1.85 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.627 -1.17 . . . . 0.0 108.928 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.06 -112.66 5.02 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 119.698 -1.239 . . . . 0.0 111.726 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 p -86.2 8.69 20.13 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.76 0.424 . . . . 0.0 111.281 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -110.0 141.37 25.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 122.574 0.35 . . . . 0.0 110.637 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.0 t -135.46 137.4 42.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.104 -2.924 . . . . 0.0 103.104 171.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 99.8 t -133.77 136.5 53.99 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -105.03 104.18 45.51 Favored Pre-proline 0 N--CA 1.433 -1.321 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.467 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.99 147.71 24.2 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 117.387 -1.275 . . . . 0.0 112.191 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 155.91 39.9 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.9 tt -149.81 142.16 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.093 -1.817 . . . . 0.0 106.093 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.35 103.84 15.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.64 138.47 31.44 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.43 -22.92 66.14 Favored Glycine 0 C--N 1.321 -0.29 0 CA-C-N 116.072 -0.513 . . . . 0.0 113.977 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 22.0 p -59.21 -29.27 67.37 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.4 ptm -144.65 36.52 1.18 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 109.261 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -44.61 -40.35 5.72 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -173.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -58.24 -51.45 69.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 118.387 0.54 . . . . 0.0 111.411 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -76.99 -34.88 57.49 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.327 0.584 . . . . 0.0 112.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -67.43 -36.27 80.91 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.596 0.712 . . . . 0.0 111.707 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.85 -44.1 77.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.169 -179.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -71.88 -14.29 61.9 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.321 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.23 -26.42 62.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.442 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.1 p -108.73 -37.83 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 120.635 0.255 . . . . 0.0 111.465 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -125.19 75.29 67.92 Favored Pre-proline 0 CA--C 1.536 0.421 0 O-C-N 121.863 -0.523 . . . . 0.0 111.289 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.22 -7.42 21.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 N-CA-C 114.724 1.009 . . . . 0.0 114.724 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 20.3 t -85.85 -5.82 59.18 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.971 -0.456 . . . . 0.0 111.039 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -89.37 130.86 35.67 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 71.8 mtm-85 -86.67 143.31 27.66 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 20.5 p -66.53 -22.99 66.16 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -59.53 -37.27 77.92 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.128 175.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -66.4 -23.57 66.33 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.865 0.364 . . . . 0.0 110.359 -177.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 17.9 t -122.15 54.6 1.17 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.69 132.21 35.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.063 -178.173 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -66.28 -30.69 71.17 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.71 -26.16 66.88 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.662 0.744 . . . . 0.0 110.888 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -96.91 -10.23 26.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.019 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -74.06 121.57 21.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.287 0.565 . . . . 0.0 110.926 -177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 29.6 t -152.82 152.25 31.38 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -66.71 -29.31 69.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.878 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -74.89 -35.4 62.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.117 0.96 . . . . 0.0 110.168 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -61.39 -24.28 66.39 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.911 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.78 -35.86 64.28 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 111.905 176.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.61 -43.09 73.45 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 121.954 -0.466 . . . . 0.0 109.816 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 33.3 mmt -64.56 -33.24 75.44 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.87 79.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.222 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -68.06 -43.83 77.75 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -65.89 -39.43 90.63 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.5 0.667 . . . . 0.0 110.372 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -62.92 -38.8 92.43 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -64.71 -40.33 95.17 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 0.0 111.86 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 30.3 mt -64.54 -36.58 84.68 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 122.12 -0.363 . . . . 0.0 111.059 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 7.6 p -76.06 -32.17 59.17 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.585 -0.697 . . . . 0.0 111.281 174.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -42.62 98.09 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 p -58.99 -39.2 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.413 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.92 -40.37 63.18 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 121.473 -0.767 . . . . 0.0 110.192 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 47.8 tttp -59.95 -29.43 68.4 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.906 -0.496 . . . . 0.0 110.739 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -55.54 -29.84 59.66 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -64.73 -39.87 94.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.591 0.632 . . . . 0.0 110.905 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -67.98 -32.78 73.43 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 24.7 mm100 -69.13 -42.19 76.36 Favored 'General case' 0 C--O 1.214 -0.791 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.144 177.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 7.4 mtp85 -59.02 -39.8 83.01 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 36.7 tttm -66.64 -44.84 80.9 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.098 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 33.1 m -72.48 -49.77 30.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.69 -21.2 66.27 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.23 -17.72 8.31 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.41 100.6 3.26 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 175.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 32.5 t -56.64 132.65 20.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.012 -178.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.39 -176.2 4.94 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -174.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -146.72 171.74 14.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.247 -177.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 64.79 -119.92 0.42 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.235 1.014 . . . . 0.0 111.21 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 84.36 20.71 58.25 Favored Glycine 0 C--O 1.222 -0.628 0 CA-C-N 118.993 0.815 . . . . 0.0 114.156 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 49.1 tttp 56.4 46.95 19.92 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.875 0.845 . . . . 0.0 111.714 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 5.2 mp -84.48 50.13 1.82 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 122.686 1.231 . . . . 0.0 110.568 178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -83.82 159.05 21.47 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.247 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -159.17 141.23 13.62 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 -177.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -137.99 124.03 20.24 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -165.79 138.55 4.18 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 178.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 2.7 tp -156.47 138.46 14.46 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -161.29 165.0 29.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 -178.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -142.07 152.27 43.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 . . . . . 0 C--O 1.255 1.35 0 N-CA-C 103.544 -2.762 . . . . 0.0 103.544 -179.943 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.6 mtm . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 120.543 0.211 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -39.42 -51.31 2.12 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 118.925 2.935 . . . . 0.0 118.925 -172.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.5 tp -57.19 -45.76 83.44 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.677 0.751 . . . . 0.0 111.239 -177.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.9 mt -73.67 -37.06 65.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.39 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.69 -34.03 77.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.631 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -59.33 -50.58 73.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.404 ' HG1' HD11 ' A' ' 121' ' ' LEU . 11.6 m -66.0 -41.9 90.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.89 0.376 . . . . 0.0 111.283 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -57.21 -52.13 66.57 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.113 0.565 . . . . 0.0 111.95 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 92.6 m95 -70.8 -30.98 67.58 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.807 -0.558 . . . . 0.0 110.656 -179.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -69.59 -38.15 77.21 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.874 -0.516 . . . . 0.0 111.693 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.0 mm -70.39 -36.51 67.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.33 -43.03 83.02 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.83 -44.82 84.4 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -59.08 -45.05 91.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.228 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.6 mt -69.23 -47.61 64.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.0 p -62.4 -29.03 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.362 177.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.4 -24.94 61.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 177.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 t -87.84 8.83 24.15 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.501 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.74 2.41 61.37 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 116.79 1.476 . . . . 0.0 116.79 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -72.48 113.05 9.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 118.182 0.991 . . . . 0.0 109.458 178.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.54 126.0 24.15 Favored Glycine 0 C--O 1.226 -0.39 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.538 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 70.9 t -76.42 121.95 29.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.6 mt -91.39 -42.09 13.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -153.11 145.0 23.61 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.21 117.21 11.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 118.273 0.488 . . . . 0.0 112.31 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 78.3 40.75 18.81 Favored Glycine 0 C--O 1.223 -0.592 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.481 178.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.54 -40.52 91.84 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.228 1.013 . . . . 0.0 108.66 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 m -165.15 -75.12 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 103.842 -2.651 . . . . 0.0 103.842 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -121.31 7.94 10.22 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -113.43 147.07 38.5 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 96.6 mt -132.76 129.57 58.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 103.069 -2.938 . . . . 0.0 103.069 169.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -108.16 129.3 55.18 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -130.1 134.72 47.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -179.358 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -84.23 136.87 33.77 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -90.97 105.76 13.41 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 118.005 0.366 . . . . 0.0 111.194 -178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -72.06 -17.31 28.4 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 118.402 -0.599 . . . . 0.0 112.892 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.33 -15.85 62.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.0 mtmt 58.12 38.95 26.51 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -175.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -62.57 -177.43 0.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 112.945 -1.934 . . . . 0.0 112.377 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.9 m -57.21 -10.66 1.33 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.034 0.534 . . . . 0.0 111.828 175.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -127.93 151.26 49.32 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -96.9 -31.2 12.69 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.083 0.468 . . . . 0.0 109.952 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -135.33 161.91 34.07 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.5 t -123.17 133.58 68.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 ttt-85 -117.31 108.78 16.02 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 174.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.7 mt -85.89 130.53 34.52 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 103.777 -2.675 . . . . 0.0 103.777 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -134.65 123.09 23.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 117.993 0.361 . . . . 0.0 111.267 -176.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -102.69 94.55 5.68 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.04 0.447 . . . . 0.0 111.582 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -151.24 139.73 20.53 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -92.65 151.6 20.01 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -134.64 119.85 18.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.68 -173.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -86.48 -37.58 18.13 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.71 0.767 . . . . 0.0 110.52 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.5 145.79 51.41 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.135 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.0 ptt180 -66.1 -20.74 66.26 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.097 -179.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -64.09 -33.24 75.32 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.141 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -77.64 -35.25 52.73 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.475 -0.766 . . . . 0.0 109.21 175.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 18.5 ttt -58.26 -50.41 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.954 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 29.8 m -60.61 -31.87 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -69.11 -37.94 78.65 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -59.87 -41.71 92.11 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -71.78 -36.39 58.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 121.447 -0.783 . . . . 0.0 111.72 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -65.11 -30.72 71.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -76.53 -41.72 45.73 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.618 0.723 . . . . 0.0 109.564 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -58.06 -35.0 70.72 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.272 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.44 78.57 Favored 'General case' 0 C--N 1.319 -0.759 0 O-C-N 122.056 -0.403 . . . . 0.0 111.41 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -72.89 -36.02 67.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.609 0.719 . . . . 0.0 109.168 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -43.18 99.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.92 -38.42 81.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.49 -41.15 80.16 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.419 1.009 . . . . 0.0 110.243 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.55 -41.66 99.03 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.165 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 87.5 t -69.99 -46.43 73.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.454 0.645 . . . . 0.0 109.704 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.54 -40.1 78.1 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 111.131 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -63.33 -51.72 64.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.403 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -71.12 -22.26 62.1 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.08 -4.96 57.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.886 0.374 . . . . 0.0 110.51 175.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.82 13.71 64.24 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 114.289 0.475 . . . . 0.0 114.289 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -79.64 145.4 33.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.776 -0.838 . . . . 0.0 112.605 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.1 mtp85 -72.41 -32.89 66.74 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.882 177.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -153.13 150.8 29.45 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 177.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.3 ttp -131.59 150.58 52.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -117.74 139.25 51.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -135.16 131.62 37.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.378 0.535 . . . . 0.0 110.287 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.7 tp -93.55 122.28 35.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -110.57 108.45 18.41 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.6 t -105.23 105.6 18.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 120.897 0.38 . . . . 0.0 110.801 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -75.73 144.59 41.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 174.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -121.74 104.14 9.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 103.125 -2.916 . . . . 0.0 103.125 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -123.1 156.56 34.7 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.543 0.527 . . . . 0.0 110.149 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -67.06 -52.69 39.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 110.583 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.29 -179.41 4.73 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.99 141.8 23.23 Favored Pre-proline 0 C--N 1.317 -0.832 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -57.12 142.92 94.35 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 117.696 -1.069 . . . . 0.0 113.851 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.1 m -77.65 -10.25 12.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -173.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -110.04 56.21 0.63 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.3 t0 61.76 52.53 3.48 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 123.238 1.494 . . . . 0.0 114.882 174.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -65.45 -17.88 64.89 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.349 -0.844 . . . . 0.0 112.69 175.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -58.81 -37.4 76.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -173.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.9 -18.61 65.46 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.3 mm -73.02 -37.87 54.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.11 -25.08 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.427 0.632 . . . . 0.0 110.438 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -89.15 3.14 52.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.184 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -116.95 98.49 6.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.31 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 47.1 m -68.53 126.11 28.61 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 172.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -86.25 108.44 18.38 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -110.31 101.39 10.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.76 0.79 . . . . 0.0 113.013 -176.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.2 tttm -99.48 75.58 1.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.76 -108.35 2.08 Favored Glycine 0 C--O 1.228 -0.238 0 C-N-CA 119.529 -1.319 . . . . 0.0 112.568 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 52.0 p -72.4 9.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.535 1.134 . . . . 0.0 112.965 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 99.3 t -129.49 144.82 36.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 C-N-CA 122.796 0.438 . . . . 0.0 110.471 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.0 t -136.34 118.32 15.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -118.79 126.39 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.471 -2.075 0 CA-C-O 122.74 1.257 . . . . 0.0 110.379 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -99.42 104.53 27.63 Favored Pre-proline 0 N--CA 1.419 -2.001 0 CA-C-N 111.4 -2.636 . . . . 0.0 109.474 -176.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -80.27 149.47 19.45 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 117.843 -0.971 . . . . 0.0 113.973 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.32 149.84 31.55 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.0 tt -142.72 123.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.1 t -102.57 107.84 22.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 136.16 33.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -60.7 -33.58 83.08 Favored Glycine 0 CA--C 1.511 -0.182 0 N-CA-C 114.908 0.723 . . . . 0.0 114.908 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.5 t -56.05 -23.88 36.19 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.5 ptm -140.97 35.83 1.75 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.586 1.184 . . . . 0.0 109.44 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.404 HD11 ' HG1' ' A' ' 7' ' ' THR . 0.9 OUTLIER -48.81 -41.94 34.39 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 -171.554 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -61.52 -51.36 68.93 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.16 1.8 . . . . 0.0 111.387 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -73.69 -32.94 64.2 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.828 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -72.73 -39.92 66.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.889 0.852 . . . . 0.0 111.309 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -68.22 -43.47 77.93 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.751 -0.593 . . . . 0.0 110.491 -179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.424 -177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.41 -32.03 62.54 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.4 t -91.21 -43.64 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.367 0.603 . . . . 0.0 110.157 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -127.39 79.61 73.0 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.036 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.6 -13.85 38.19 Favored 'Trans proline' 0 C--N 1.347 0.456 0 N-CA-C 114.535 0.937 . . . . 0.0 114.535 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.6 m -84.47 -2.46 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -76.83 137.29 39.11 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.447 0.641 . . . . 0.0 111.183 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -73.18 103.0 3.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.76 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 58.8 p -68.51 -18.63 64.42 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.063 0.459 . . . . 0.0 110.042 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.407 ' CD ' ' H ' ' A' ' 135' ' ' GLU . 1.9 mp0 -72.43 -15.74 61.83 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.503 0.721 . . . . 0.0 111.514 178.135 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -77.05 7.2 5.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 122.034 0.921 . . . . 0.0 110.593 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 44.0 t -140.49 131.14 25.62 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 105.315 -2.105 . . . . 0.0 105.315 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.8 t -150.34 161.15 43.03 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -62.21 -36.79 83.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.2 -22.16 62.62 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 122.02 0.914 . . . . 0.0 111.254 178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -119.04 19.11 13.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.641 -175.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -78.72 13.89 1.51 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -177.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 89.2 p -69.03 149.18 49.05 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 121.506 -0.746 . . . . 0.0 111.398 -178.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -64.25 -28.85 70.01 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.476 0.655 . . . . 0.0 110.449 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.14 -38.03 89.57 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.264 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -63.19 -29.11 70.52 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.98 -0.45 . . . . 0.0 110.866 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.92 -38.06 72.93 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.286 -0.259 . . . . 0.0 110.705 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -64.03 -45.73 87.6 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtt -62.69 -28.95 70.3 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.675 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.08 -34.49 73.53 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 121.63 -0.669 . . . . 0.0 111.115 -178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -66.37 -45.64 79.42 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -67.1 -38.03 84.96 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.259 0.552 . . . . 0.0 110.375 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 60.3 mtt85 -61.86 -43.49 98.73 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -63.88 -42.17 97.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 118.515 0.598 . . . . 0.0 111.887 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.5 -36.36 83.95 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 122.092 -0.38 . . . . 0.0 111.648 -178.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 10.6 p -76.14 -35.66 59.14 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.321 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -41.24 95.38 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.69 0.796 . . . . 0.0 112.837 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -63.13 -38.25 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 118.753 0.706 . . . . 0.0 111.349 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.81 -40.52 63.31 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.9 ttpp -57.78 -25.46 60.54 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.132 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -54.97 -28.41 51.47 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -65.8 -34.31 77.87 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.498 0.666 . . . . 0.0 110.739 177.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -76.79 -40.9 46.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -59.79 -46.38 89.39 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -59.6 -24.5 63.85 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 118.19 0.45 . . . . 0.0 111.605 -177.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -77.62 -49.04 15.4 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.706 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 55.2 p -72.4 -23.44 61.1 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.07 -19.49 7.39 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -177.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -52.85 -18.41 1.89 Allowed 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 51.38 67.02 1.02 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 171.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 33.6 m -63.61 -15.45 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.755 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -151.81 150.97 30.74 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 173.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -162.71 142.56 9.32 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 178.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -165.66 151.09 9.0 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 117.744 0.247 . . . . 0.0 110.947 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 83.19 173.79 49.93 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 117.77 1.868 . . . . 0.0 117.77 174.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 41.2 tttp -153.31 149.95 28.42 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 104.727 -2.323 . . . . 0.0 104.727 177.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 48.3 tp -112.83 161.16 17.26 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -144.54 163.93 32.41 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -83.78 -34.04 24.85 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 106.808 -1.553 . . . . 0.0 106.808 174.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 44.65 42.36 5.72 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 56.6 t30 -138.59 151.95 47.72 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.887 -0.508 . . . . 0.0 110.167 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.491 ' HG ' ' H ' ' A' ' 184' ' ' PHE . 27.7 tp -87.94 149.81 23.84 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 123.307 0.643 . . . . 0.0 109.557 -178.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -71.71 -15.22 62.2 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . 0.491 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER 52.6 35.15 17.34 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 118.407 2.743 . . . . 0.0 118.407 171.664 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 . . . . . 0 C--O 1.25 1.111 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 175.311 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.5 mtp . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 119.484 -0.294 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -67.36 -15.22 63.56 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 27.2 tp -55.05 -32.22 61.73 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 122.722 0.409 . . . . 0.0 111.166 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 22.4 tp -60.65 -48.11 83.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.821 0.343 . . . . 0.0 110.491 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -73.75 -30.63 62.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.443 0.64 . . . . 0.0 110.804 -178.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -61.62 -43.0 99.67 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.9 m -66.34 -44.31 83.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.778 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -53.05 -55.43 23.82 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -68.59 -35.66 77.66 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.527 -0.733 . . . . 0.0 112.858 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -74.88 -25.24 58.81 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.113 -0.992 . . . . 0.0 112.515 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.4 mm -67.76 -40.78 84.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 175.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.96 -40.29 80.21 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -41.95 96.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.392 177.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -63.54 -42.33 98.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.585 0.231 . . . . 0.0 110.539 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -65.2 -45.74 83.56 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.4 t -60.48 -40.11 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.101 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -62.16 -30.63 71.19 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.664 -0.647 . . . . 0.0 110.623 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.8 m -80.39 11.41 3.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.926 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.14 3.19 63.71 Favored Glycine 0 C--O 1.229 -0.194 0 N-CA-C 115.296 0.879 . . . . 0.0 115.296 175.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.405 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 16.5 m-85 -68.8 126.4 29.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.024 0.912 . . . . 0.0 110.361 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 134.89 13.75 Favored Glycine 0 C--O 1.225 -0.445 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.57 119.18 24.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 O-C-N 122.013 -0.698 . . . . 0.0 110.142 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 77.2 mt -89.41 -46.03 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -149.76 120.37 7.49 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.285 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 126.08 19.52 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 151.05 -30.89 0.98 Allowed Glycine 0 CA--C 1.506 -0.526 0 N-CA-C 111.356 -0.697 . . . . 0.0 111.356 176.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -64.73 141.82 58.64 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 176.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -67.26 -27.03 66.87 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -114.94 -5.02 12.53 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -173.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -144.73 142.97 30.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.36 0.982 . . . . 0.0 113.445 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.8 mt -136.5 125.98 38.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -107.77 123.87 49.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.405 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.3 mm? -124.15 128.58 49.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -83.0 132.22 35.15 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.56 123.52 89.64 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.67 -19.51 24.21 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 116.955 -1.563 . . . . 0.0 112.943 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -66.07 -33.87 76.78 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 56.75 27.38 12.66 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.65 1.214 . . . . 0.0 110.638 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 t -79.46 -172.85 3.43 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 112.217 -2.265 . . . . 0.0 106.347 176.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.7 m -41.75 -25.45 0.06 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -110.38 127.27 55.0 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 169.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.423 ' HB2' ' HE3' ' A' ' 80' ' ' MET . 39.5 m-20 -91.01 -32.42 15.93 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.62 166.42 32.15 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.36 136.67 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.2 ttt180 -112.64 111.28 21.98 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -81.47 128.53 33.98 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 101.917 -3.364 . . . . 0.0 101.917 173.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -136.13 114.89 12.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.732 -176.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tttm -87.38 94.66 9.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -151.7 136.41 17.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.264 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -97.26 147.24 24.33 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 175.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.97 134.61 47.56 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -92.25 -39.93 11.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -120.39 147.84 44.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.634 0.73 . . . . 0.0 112.418 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -61.3 -21.26 63.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.48 -33.25 74.73 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.961 -0.462 . . . . 0.0 109.8 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -68.24 -37.59 80.95 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 54.1 ttm -61.94 -46.5 89.03 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.67 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.1 m -68.02 -36.62 76.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.745 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -26.43 62.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.862 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -65.15 -34.5 78.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -72.08 -30.87 37.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.495 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.63 -40.17 93.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -67.91 -44.85 75.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.864 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -61.02 -38.76 87.21 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.465 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.71 76.03 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -68.87 -37.04 78.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.244 0.545 . . . . 0.0 109.917 177.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -64.21 -42.3 96.67 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.29 -40.41 87.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.066 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.521 -179.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -57.53 -36.1 71.15 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 119.108 0.867 . . . . 0.0 111.333 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -64.33 -45.95 85.59 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.531 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.72 -40.8 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.663 0.744 . . . . 0.0 110.248 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -39.83 78.56 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.348 0.659 . . . . 0.0 110.201 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -63.35 -47.57 81.59 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.487 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -73.36 -23.01 60.15 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.989 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.3 -11.88 57.25 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.668 0.271 . . . . 0.0 111.353 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.21 17.6 68.32 Favored Glycine 0 CA--C 1.52 0.401 0 CA-C-O 121.55 0.528 . . . . 0.0 112.482 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 mmt-85 -69.62 136.95 51.85 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.113 -0.64 . . . . 0.0 111.503 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -72.09 -32.04 66.63 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -152.32 145.34 24.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 N-CA-C 102.536 -3.135 . . . . 0.0 102.536 173.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.423 ' HE3' ' HB2' ' A' ' 42' ' ' ASP . 1.1 ttp -125.36 143.04 51.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -178.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -120.58 129.79 53.92 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -117.64 134.06 55.29 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.021 -176.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.87 124.9 38.18 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -112.06 128.27 56.14 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 121.905 -0.497 . . . . 0.0 109.793 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.65 105.85 17.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -75.14 136.58 41.07 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -111.99 108.36 17.66 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 173.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -126.39 158.52 35.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.71 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.9 t -80.01 -28.9 39.36 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.632 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -155.41 167.11 31.44 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.85 158.83 41.54 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 122.669 0.388 . . . . 0.0 111.174 -175.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.41 153.17 42.47 Favored 'Trans proline' 0 C--N 1.355 0.898 0 O-C-N 122.178 0.567 . . . . 0.0 112.871 175.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -62.72 -29.69 47.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -157.41 151.61 24.76 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.8 t0 49.8 15.89 0.18 Allowed 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 27.7 p-90 -76.81 -25.21 53.01 Favored 'General case' 0 C--O 1.216 -0.669 0 O-C-N 121.118 -0.989 . . . . 0.0 110.741 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.05 -31.93 72.39 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 121.989 -0.444 . . . . 0.0 111.783 -175.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.59 -17.71 62.9 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.128 0.49 . . . . 0.0 110.823 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.8 mm -75.87 -36.12 31.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.22 -17.51 63.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.074 0.464 . . . . 0.0 111.341 178.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -96.34 2.71 52.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -121.48 138.42 54.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.434 0.635 . . . . 0.0 111.013 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 62.4 m -80.59 125.88 30.55 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -82.66 130.49 35.13 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 105.084 -2.191 . . . . 0.0 105.084 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -129.6 137.11 50.52 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.557 0.694 . . . . 0.0 112.448 -178.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -132.6 75.59 1.64 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.15 -112.66 5.18 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.989 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.8 t -77.5 16.49 0.63 Allowed 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.68 0.752 . . . . 0.0 111.935 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 76.6 t -130.07 141.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 121.47 -0.769 . . . . 0.0 111.677 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 70.9 m -132.49 140.21 48.27 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -138.24 138.17 43.45 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.291 0 CA-C-O 121.566 0.698 . . . . 0.0 110.564 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.98 108.77 62.52 Favored Pre-proline 0 N--CA 1.435 -1.2 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.101 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -78.83 155.33 26.83 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 115.363 -2.625 . . . . 0.0 112.132 176.118 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -153.13 153.42 32.75 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 102.269 -3.234 . . . . 0.0 102.269 175.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.4 tt -146.88 130.08 8.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.0 m -105.92 133.53 50.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 N-CA-C 104.473 -2.417 . . . . 0.0 104.473 172.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.82 136.18 53.14 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -55.21 -34.13 58.57 Favored Glycine 0 C--O 1.227 -0.332 0 N-CA-C 115.65 1.02 . . . . 0.0 115.65 -174.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.4 t -61.7 -17.08 54.2 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -141.49 25.44 2.02 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.665 0.745 . . . . 0.0 109.815 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -48.0 -39.78 20.61 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -170.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -58.72 -51.33 70.41 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.456 1.026 . . . . 0.0 111.729 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -73.76 -34.71 64.82 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.333 0.587 . . . . 0.0 111.585 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.91 -40.59 91.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.065 0.936 . . . . 0.0 111.789 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.54 -44.76 77.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.433 -176.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -70.97 -13.75 62.12 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.164 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.82 -35.5 62.44 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 176.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.62 -36.8 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 120.632 0.253 . . . . 0.0 111.327 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -126.39 75.85 73.46 Favored Pre-proline 0 C--N 1.326 -0.422 0 O-C-N 122.079 -0.388 . . . . 0.0 110.755 177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.95 -14.99 39.69 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 118.53 -0.513 . . . . 0.0 112.766 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 m -76.03 0.78 17.42 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.821 0.449 . . . . 0.0 112.008 178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -117.27 139.07 51.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 -179.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -73.04 96.82 2.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 14.8 t -61.57 -20.65 63.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.627 0.727 . . . . 0.0 110.148 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -72.96 -16.3 61.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -72.27 -12.6 61.23 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 78.8 m -92.84 48.91 1.39 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.38 154.12 29.1 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.264 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -63.44 -23.0 67.21 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -174.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 60.5 mp0 -61.35 -24.69 66.64 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.421 0.629 . . . . 0.0 110.16 176.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -95.0 10.98 33.56 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -75.73 2.42 12.15 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 40.4 t -72.25 147.26 46.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.039 0.447 . . . . 0.0 110.813 178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -65.52 -28.71 69.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -64.3 -44.57 91.21 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.58 -37.33 86.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.916 -178.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.03 -45.48 92.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.96 0.409 . . . . 0.0 110.727 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -63.7 -46.08 87.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.218 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 84.1 mtp -64.33 -29.46 70.54 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.089 -0.382 . . . . 0.0 110.947 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -34.9 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.716 -0.615 . . . . 0.0 110.672 178.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -66.45 -47.18 73.96 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -67.09 -38.88 86.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.541 0.686 . . . . 0.0 110.401 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.4 ttt-85 -60.64 -44.19 96.69 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.35 99.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 111.995 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -33.77 76.55 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.856 0.36 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -75.97 -35.26 59.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.751 0.786 . . . . 0.0 111.523 175.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -62.13 -43.57 98.55 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 124.041 0.936 . . . . 0.0 113.341 -176.487 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 4.3 p -57.4 -43.43 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.86 -176.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -73.91 -39.87 63.55 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 121.657 -0.652 . . . . 0.0 110.117 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -62.81 -30.02 71.16 Favored 'General case' 0 C--O 1.219 -0.546 0 O-C-N 121.633 -0.667 . . . . 0.0 111.871 -179.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -58.63 -28.64 65.84 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 118.767 0.712 . . . . 0.0 111.203 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -63.36 -35.98 82.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 118.265 0.484 . . . . 0.0 110.19 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -76.97 -51.01 11.9 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.26 -38.43 71.14 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -175.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -57.11 -26.62 60.78 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -77.7 -44.67 27.17 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 121.453 -0.779 . . . . 0.0 110.214 173.78 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.34 -25.42 61.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 117.055 2.242 . . . . 0.0 117.055 -174.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -55.73 -24.33 34.28 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.68 -20.71 65.92 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 177.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -86.61 58.04 4.84 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.493 0.664 . . . . 0.0 111.285 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -64.97 133.76 30.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.86 -178.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -155.47 155.18 33.04 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -155.55 161.35 40.89 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -159.42 90.17 0.94 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 152.41 -178.01 29.84 Favored Glycine 0 C--O 1.229 -0.19 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.106 177.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -147.02 140.99 25.94 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.66 -165.12 1.25 Allowed 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 105.404 -2.073 . . . . 0.0 105.404 175.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 54.28 66.6 1.19 Allowed 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 173.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 49.4 ttt85 -77.31 -41.78 39.33 Favored 'General case' 0 C--O 1.214 -0.771 0 O-C-N 121.416 -0.802 . . . . 0.0 110.628 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 40.84 91.17 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -173.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -144.1 39.11 1.32 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.42 -175.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 33.1 tp -104.22 145.85 29.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.21 0.529 . . . . 0.0 111.523 -178.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -161.85 166.12 26.78 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -144.22 159.01 43.4 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.191 0 N-CA-C 103.986 -2.598 . . . . 0.0 103.986 178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.4 ttm . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 55.86 40.86 30.57 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.335 0.971 . . . . 0.0 113.597 176.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.1 tt -55.98 -41.58 75.01 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -176.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 53.6 tp -54.32 -35.25 62.47 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.609 0.718 . . . . 0.0 112.299 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 61.9 mt-10 -57.12 -25.03 58.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -178.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -51.81 -50.46 60.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.602 0.637 . . . . 0.0 110.714 177.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.0 m -68.56 -39.61 80.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.2 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -58.76 -57.29 13.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.113 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -70.34 -31.55 68.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -70.09 -35.12 73.94 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.644 -1.222 . . . . 0.0 109.183 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.2 mm -65.0 -44.78 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 176.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.16 -42.04 80.31 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.33 -41.28 98.89 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -62.73 -45.75 91.29 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -66.84 -51.89 50.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.194 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.7 t -56.28 -43.09 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.927 0.394 . . . . 0.0 110.306 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -71.28 -18.24 62.43 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.109 -0.994 . . . . 0.0 112.362 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.9 t -88.08 9.51 22.32 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.967 0.507 . . . . 0.0 110.734 177.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.28 0.24 57.03 Favored Glycine 0 CA--C 1.517 0.205 0 N-CA-C 116.135 1.214 . . . . 0.0 116.135 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -69.93 107.43 3.57 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.73 133.26 34.88 Favored Glycine 0 CA--C 1.511 -0.211 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.212 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.5 t -75.95 125.02 35.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 52.4 mt -93.91 -46.05 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -147.79 133.37 18.78 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.409 -178.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 149.41 42.92 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 101.203 -3.629 . . . . 0.0 101.203 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.25 20.23 33.41 Favored Glycine 0 C--O 1.225 -0.426 0 C-N-CA 120.416 -0.897 . . . . 0.0 110.957 -178.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -76.0 -174.07 2.55 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 105.037 -2.209 . . . . 0.0 105.037 174.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -54.28 41.79 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.198 0.523 . . . . 0.0 110.231 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -139.22 -11.12 1.25 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.263 173.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.19 164.71 14.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.1 mt -135.58 126.29 43.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 175.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 76.8 m95 -105.9 132.87 51.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 mp -133.72 145.16 49.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 -177.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -98.66 150.14 22.08 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 125.64 88.02 Favored Pre-proline 0 CA--C 1.544 0.75 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.63 -29.06 13.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 116.939 -1.574 . . . . 0.0 113.242 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -73.52 -19.42 60.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.847 0.356 . . . . 0.0 110.744 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.1 mttm 53.89 43.34 31.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.103 1.43 . . . . 0.0 110.045 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.2 p -69.73 -177.71 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 112.237 -2.256 . . . . 0.0 108.737 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -46.82 -33.07 4.14 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.09 113.47 21.06 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 172.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -78.48 -44.86 23.48 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.359 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 24.4 mt -137.35 166.17 24.46 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -173.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.2 t -134.55 139.74 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.791 0.837 . . . . 0.0 109.497 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 -120.34 124.27 45.14 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -91.77 130.17 37.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 104.264 -2.495 . . . . 0.0 104.264 174.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -136.49 139.79 42.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -125.72 103.12 7.65 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.775 0.716 . . . . 0.0 111.906 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -149.05 138.81 21.91 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.31 145.78 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 7.2 mt -129.02 126.24 39.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.46 0.171 . . . . 0.0 111.085 -173.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -90.17 -38.15 13.69 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.674 0.749 . . . . 0.0 110.637 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -133.42 151.27 51.79 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.787 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ptt-85 -65.34 -18.14 65.08 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -64.53 -33.33 75.65 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.787 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -69.29 -40.37 77.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 91.8 mtp -55.92 -47.95 76.57 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.149 179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -64.15 -31.21 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.682 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -71.13 -41.37 70.6 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -57.46 -43.65 84.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.164 0.507 . . . . 0.0 110.629 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -68.03 -30.65 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.423 -176.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.94 73.82 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.92 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -73.71 -43.75 58.36 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -54.38 -39.1 66.89 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 175.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.29 93.79 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.042 0.837 . . . . 0.0 110.791 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -67.97 -42.39 80.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.516 0.674 . . . . 0.0 109.379 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -59.18 -42.38 90.68 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.6 -36.9 77.65 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.975 0 CA-C-O 118.833 -0.603 . . . . 0.0 110.558 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.0 -42.59 85.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.951 1.25 . . . . 0.0 109.391 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -65.91 -48.41 71.51 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.328 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.0 t -66.17 -35.8 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.264 0.554 . . . . 0.0 110.346 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -43.91 96.9 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 121.558 -0.714 . . . . 0.0 110.037 178.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -67.61 -39.3 84.75 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.396 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.91 -40.36 88.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.825 0.345 . . . . 0.0 111.477 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -91.83 0.54 57.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.85 19.71 65.72 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 115.746 1.058 . . . . 0.0 115.746 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -77.93 142.58 38.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.684 -0.892 . . . . 0.0 110.698 -176.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -63.65 -40.48 96.96 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.13 -0.356 . . . . 0.0 111.182 -178.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.3 ptt-85 -144.91 160.37 41.41 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 102.09 -3.3 . . . . 0.0 102.09 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -135.09 145.9 48.37 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 119.568 1.076 . . . . 0.0 110.895 175.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 110' ' ' SER . 40.2 tttp -123.62 127.82 48.8 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.666 0.604 . . . . 0.0 109.671 174.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -122.5 132.64 54.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.814 -175.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.9 tp -92.79 123.66 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 174.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -115.6 108.5 16.49 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.3 t -105.08 112.92 40.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.107 0.254 . . . . 0.0 111.46 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.41 135.16 35.64 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 175.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -110.92 117.84 34.47 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.9 p -132.87 168.39 18.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -176.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.4 t -92.55 -28.95 16.44 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.64 161.73 39.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.36 149.88 39.13 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -177.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -64.35 151.14 86.67 Favored 'Trans proline' 0 C--N 1.346 0.418 0 O-C-N 122.34 0.652 . . . . 0.0 112.562 177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.0 m -77.76 -12.7 13.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 119.096 2.998 . . . . 0.0 119.096 -169.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.82 101.66 8.04 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 117.404 2.372 . . . . 0.0 117.404 -173.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 44.52 28.66 0.33 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 117.703 2.483 . . . . 0.0 117.703 172.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -63.11 -21.75 66.39 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -176.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -61.72 -31.27 71.42 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.746 -0.596 . . . . 0.0 110.774 -177.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.5 -28.09 69.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.082 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.4 mm -73.59 -35.81 45.7 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.75 71.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.444 0.64 . . . . 0.0 111.114 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.65 -24.42 59.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.293 0.568 . . . . 0.0 111.358 178.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -85.16 99.36 11.02 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -171.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 59.6 m -68.26 122.58 18.64 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 171.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.88 120.66 25.96 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -118.76 128.18 54.24 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.079 0.943 . . . . 0.0 110.474 -179.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -130.75 75.57 1.67 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.246 -1.343 . . . . 0.0 107.773 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.02 -112.63 5.0 Favored Glycine 0 C--O 1.219 -0.831 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.703 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.1 p -84.49 16.99 2.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -121.64 140.73 44.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.423 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 7.9 p -134.88 137.71 43.47 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -134.01 130.05 54.82 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.724 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -99.09 110.76 59.05 Favored Pre-proline 0 N--CA 1.432 -1.361 0 CA-C-N 114.424 -1.262 . . . . 0.0 107.979 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -79.64 149.95 21.32 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 117.417 -1.255 . . . . 0.0 111.597 179.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.84 150.69 29.59 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.9 tt -145.89 137.36 19.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 -178.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.0 m -119.83 133.79 65.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 103.559 -2.756 . . . . 0.0 103.559 175.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.38 136.21 53.9 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 -176.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -45.58 -43.35 10.95 Favored Glycine 0 N--CA 1.461 0.318 0 N-CA-C 116.915 1.526 . . . . 0.0 116.915 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -53.25 -29.93 35.48 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -178.565 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.9 ptm -140.6 30.84 1.88 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 122.664 1.221 . . . . 0.0 109.624 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.06 -37.81 47.81 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -58.39 -40.83 83.43 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.621 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -78.44 -43.37 27.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.808 0.813 . . . . 0.0 111.105 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.66 -43.37 93.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.991 0.901 . . . . 0.0 112.196 -177.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -65.01 -42.06 94.79 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.27 -175.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -74.78 -18.39 60.48 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.72 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.72 -36.26 65.18 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 59.5 t -85.59 -40.19 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.427 0.632 . . . . 0.0 110.117 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -124.91 82.26 61.17 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.122 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -68.92 -4.54 13.65 Favored 'Trans proline' 0 C--N 1.347 0.462 0 N-CA-C 114.919 1.084 . . . . 0.0 114.919 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 35.4 p -80.53 -8.18 59.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.367 0.603 . . . . 0.0 109.628 175.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -86.15 124.93 33.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.697 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -78.61 97.24 5.73 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.8 t -67.23 -19.53 65.55 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 176.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -62.01 -36.4 81.45 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.485 176.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.93 -23.36 33.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.34 1.067 . . . . 0.0 110.51 -176.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.1 t -93.68 68.16 3.96 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.076 -0.966 . . . . 0.0 112.121 -175.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 85.3 p -66.06 158.15 29.16 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -62.41 -33.35 74.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.381 0.61 . . . . 0.0 110.67 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -63.93 -24.9 67.91 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.549 0.69 . . . . 0.0 112.065 178.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 -79.4 -11.83 59.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.212 0.53 . . . . 0.0 110.392 -176.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -102.62 40.96 1.28 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -175.397 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 24.2 p -68.3 160.11 30.02 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.654 -0.818 . . . . 0.0 110.116 178.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 29.9 p90 -64.81 -28.86 69.86 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.631 -0.668 . . . . 0.0 111.324 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -69.33 -41.23 76.93 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -62.97 -33.7 75.94 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 177.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.68 95.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.19 0.519 . . . . 0.0 111.117 177.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -44.23 92.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 48.7 mtp -69.03 -28.89 66.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.02 92.49 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.901 -0.499 . . . . 0.0 110.222 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.99 -46.73 80.21 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -60.33 -45.6 92.86 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.241 1.019 . . . . 0.0 110.373 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 22.2 ttm180 -65.48 -33.86 76.92 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.3 -42.75 92.74 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 121.224 -0.19 . . . . 0.0 110.905 177.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.18 -41.0 91.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 28.0 m -67.09 -35.36 79.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.562 0.696 . . . . 0.0 111.019 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tt -70.18 -33.76 72.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 39.9 t -58.36 -44.44 88.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -68.81 -37.84 79.49 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.475 -0.49 . . . . 0.0 109.928 178.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -58.09 -29.96 65.87 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.381 176.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -54.86 -31.82 60.08 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.394 0.543 . . . . 0.0 111.005 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -59.73 -45.21 92.88 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.745 -0.597 . . . . 0.0 111.919 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -79.13 -32.65 44.51 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.625 0.726 . . . . 0.0 111.439 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.4 tm0? -61.38 -39.18 89.73 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 121.964 -0.46 . . . . 0.0 110.859 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -62.53 -17.75 60.5 Favored 'General case' 0 C--O 1.217 -0.641 0 N-CA-C 113.901 1.075 . . . . 0.0 113.901 -178.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -62.71 -17.84 61.44 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 120.973 0.416 . . . . 0.0 111.331 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 36.4 p -63.04 -13.68 38.67 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -53.2 -24.48 11.09 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -67.14 -14.15 62.63 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -78.73 139.61 38.42 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.28 121.41 17.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.11 -174.79 4.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.489 -176.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -146.73 160.83 41.74 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -133.66 169.64 16.72 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.065 0.546 . . . . 0.0 109.975 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 158.93 165.58 16.28 Favored Glycine 0 C--O 1.224 -0.492 0 C-N-CA 121.072 -0.585 . . . . 0.0 113.007 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.99 132.34 28.4 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 94.3 mt -85.39 153.48 22.49 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 103.617 -2.735 . . . . 0.0 103.617 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 70.2 148.57 0.08 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 124.385 1.053 . . . . 0.0 111.629 -178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -145.02 87.64 1.84 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -176.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 65.71 169.08 0.21 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 174.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -135.4 162.44 32.6 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.8 tp -142.01 141.55 32.85 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 178.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -68.56 -27.88 66.46 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -176.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 65.3 150.97 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -178.808 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 . . . . . 0 C--O 1.246 0.878 0 N-CA-C 105.616 -1.994 . . . . 0.0 105.616 -179.453 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 tpt . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 119.044 -0.503 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -72.78 36.88 0.08 Allowed 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 117.344 2.35 . . . . 0.0 117.344 -175.082 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.47 -41.39 80.25 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.107 -0.996 . . . . 0.0 110.276 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.35 -39.74 89.38 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.24 -38.15 90.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.712 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -62.24 -46.18 90.01 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 23.5 m -65.16 -43.23 92.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.047 0.451 . . . . 0.0 110.519 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.63 -53.94 51.76 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.384 0.673 . . . . 0.0 111.156 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -69.8 -27.41 64.87 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.956 -0.465 . . . . 0.0 111.679 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -71.13 -36.85 72.26 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.745 -0.597 . . . . 0.0 111.881 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.4 mm -67.84 -45.9 83.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.86 -45.86 74.61 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.9 91.96 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -34.74 76.58 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.684 -176.493 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -71.07 -52.18 20.92 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.531 178.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.0 m -60.1 -32.84 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.828 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -67.99 -23.96 65.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.417 . . . . 0.0 110.723 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 t -89.17 9.82 24.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.809 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.73 2.68 59.73 Favored Glycine 0 C--O 1.227 -0.293 0 N-CA-C 115.612 1.005 . . . . 0.0 115.612 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.402 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 15.5 m-85 -72.31 99.76 2.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.064 0.932 . . . . 0.0 109.402 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.76 134.36 40.99 Favored Glycine 0 CA--C 1.512 -0.125 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.819 -177.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.2 t -77.23 124.26 35.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 79.3 mt -90.09 -43.58 14.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -150.13 127.33 11.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.402 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.37 131.68 26.68 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 170.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.7 -88.54 0.07 OUTLIER Glycine 0 CA--C 1.507 -0.454 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 178.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -68.61 157.44 36.12 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.1 t -75.2 -3.48 33.27 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.81 0.338 . . . . 0.0 111.724 -176.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.1 -36.48 35.34 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -177.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -140.45 144.51 36.13 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -176.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 87.7 mt -139.31 132.24 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -105.22 134.33 48.51 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -129.72 139.75 51.26 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.927 0.491 . . . . 0.0 110.294 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -86.93 140.47 29.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -92.44 105.61 14.96 Favored Pre-proline 0 CA--C 1.553 1.068 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 91.9 Cg_endo -72.76 -17.29 25.99 Favored 'Trans proline' 0 C--N 1.352 0.729 0 CA-C-N 118.431 0.475 . . . . 0.0 112.991 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -67.47 -16.41 64.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.751 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.9 mttt 54.49 42.37 31.38 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 122.67 1.224 . . . . 0.0 108.823 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.4 p -72.78 -175.04 1.59 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 112.884 -1.962 . . . . 0.0 109.637 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.5 m -52.35 -31.71 34.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.769 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -98.66 136.25 38.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.043 0.537 . . . . 0.0 109.62 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -83.34 -33.75 25.8 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.9 mt -135.01 158.03 45.39 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.619 -176.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.21 141.7 43.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -138.5 150.71 46.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.247 0.546 . . . . 0.0 111.079 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.1 mt -113.98 135.96 53.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -136.47 129.92 31.81 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.261 0.35 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -106.11 114.84 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -151.76 150.4 30.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -118.85 139.56 51.41 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 103.601 -2.74 . . . . 0.0 103.601 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -152.22 144.45 23.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -82.03 -35.15 29.1 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -133.3 154.52 50.63 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.5 ptt-85 -62.9 -17.87 62.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -177.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -61.77 -33.34 73.92 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.622 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.53 -39.1 67.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 ttp -61.84 -45.81 92.17 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.586 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.41 -33.35 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.22 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -65.05 -39.87 93.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.758 -178.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -57.87 -43.49 86.01 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.172 0.295 . . . . 0.0 110.421 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mt -74.07 -35.59 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.761 -0.587 . . . . 0.0 111.341 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.3 -39.0 78.19 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -76.61 -40.76 48.44 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.571 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.56 93.34 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.21 -33.93 76.56 Favored 'General case' 0 C--O 1.209 -1.036 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.66 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.19 -41.73 96.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.584 0.707 . . . . 0.0 109.75 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -63.61 -46.21 86.78 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.304 0.574 . . . . 0.0 109.697 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.4 t -65.24 -38.23 82.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.908 -177.745 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -58.6 -43.03 89.41 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -64.47 -42.05 96.15 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.177 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.9 t -65.7 -39.47 84.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.602 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.3 OUTLIER -61.93 -44.95 95.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.561 -0.712 . . . . 0.0 111.95 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.3 m80 -64.44 -31.54 72.79 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.484 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -66.73 -24.21 66.2 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.914 0.387 . . . . 0.0 111.325 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.7 mp -100.68 -17.64 16.9 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.202 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.52 6.94 59.89 Favored Glycine 0 CA--C 1.523 0.594 0 CA-C-O 121.574 0.541 . . . . 0.0 113.93 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 -71.37 140.8 50.31 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -59.14 -47.01 86.84 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -170.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -153.97 153.72 32.49 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.675 0.671 . . . . 0.0 110.609 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.451 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -102.19 164.13 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.654 0.782 . . . . 0.0 112.716 -178.349 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.6 mptt -148.2 129.01 14.28 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 101.389 -3.56 . . . . 0.0 101.389 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -139.57 128.11 22.99 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -174.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.6 tp -91.43 121.16 32.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -115.16 108.62 16.86 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.184 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 12.4 t -101.69 113.06 36.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -82.14 143.51 31.4 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 175.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -123.25 117.35 25.09 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 173.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.1 m -135.59 158.31 44.7 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 123.447 0.467 . . . . 0.0 111.522 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 52.3 m -68.16 -49.16 62.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-O 121.885 0.85 . . . . 0.0 108.844 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -144.31 158.77 43.56 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 103.142 -2.91 . . . . 0.0 103.142 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.76 155.94 53.0 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.959 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -63.61 154.11 70.96 Favored 'Trans proline' 0 C--N 1.346 0.404 0 O-C-N 122.208 0.583 . . . . 0.0 112.789 177.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.6 m -88.26 10.52 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -121.83 83.49 2.1 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 114.449 1.278 . . . . 0.0 114.449 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 31.09 45.0 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 118.005 2.594 . . . . 0.0 118.005 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -70.01 -15.37 63.01 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.43 -0.794 . . . . 0.0 111.48 179.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -64.38 -29.67 70.74 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.664 -0.648 . . . . 0.0 109.687 -178.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.456 ' HA ' ' HE2' ' A' ' 101' ' ' LYS . 78.0 mm-40 -67.29 -18.32 65.14 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.635 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.1 mm -87.16 -38.4 12.11 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.667 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.04 -39.57 82.39 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.419 0.628 . . . . 0.0 112.477 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.456 ' HE2' ' HA ' ' A' ' 98' ' ' GLU . 48.0 pttt -89.63 3.79 51.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.763 -178.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -102.22 107.19 18.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.805 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.5 m -68.31 123.19 20.07 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 175.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -85.65 125.35 33.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 178.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -125.89 127.32 45.82 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 121.688 0.756 . . . . 0.0 109.496 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -143.72 113.12 6.92 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.249 -178.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 55.39 -126.28 38.8 Favored Glycine 0 C--O 1.24 0.502 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.294 178.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.2 p -84.55 15.2 3.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.527 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.4 t -119.29 148.77 22.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.309 0.576 . . . . 0.0 112.216 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 t -139.31 140.07 37.48 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 100.598 -3.853 . . . . 0.0 100.598 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.8 t -136.29 133.94 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -101.07 111.68 63.82 Favored Pre-proline 0 C--O 1.244 0.781 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 174.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -78.2 153.37 28.09 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 117.058 -1.495 . . . . 0.0 111.376 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.61 151.63 34.1 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.61 137.56 16.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.1 t -116.87 107.9 23.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 177.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.21 141.17 28.86 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.65 -19.9 61.04 Favored Glycine 0 C--O 1.228 -0.28 0 N-CA-C 114.435 0.534 . . . . 0.0 114.435 -177.265 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 38.8 p -62.69 -29.47 70.67 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.631 0.975 . . . . 0.0 113.631 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.8 ptm -144.42 40.55 1.33 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.05 -43.63 30.57 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -173.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -43.8 97.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 119.069 0.849 . . . . 0.0 111.844 -176.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -73.68 -39.13 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.911 0.386 . . . . 0.0 111.232 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.47 -39.76 92.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.492 0.663 . . . . 0.0 110.445 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -63.71 -49.41 73.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.019 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -70.49 -15.45 62.8 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.881 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.61 64.61 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 31.7 t -91.86 -44.64 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 121.458 0.647 . . . . 0.0 110.689 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -124.97 77.98 66.21 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.123 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.2 -6.64 19.3 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 118.611 -0.459 . . . . 0.0 112.476 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 49.2 p -88.11 -5.72 58.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.677 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -79.2 124.15 28.08 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -85.23 99.94 11.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.649 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 23.2 p -68.41 -23.82 64.68 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 176.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -68.27 -38.19 81.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.415 178.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.32 -31.53 70.06 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 5.8 p -169.1 127.2 0.99 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.501 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 90.8 p -126.48 163.04 24.23 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -25.17 62.5 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -63.6 -32.21 73.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.083 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -98.67 24.52 7.42 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.494 0.664 . . . . 0.0 109.979 179.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -127.27 -163.51 1.26 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.795 0.807 . . . . 0.0 110.477 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 99.4 p -154.16 168.07 27.76 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -66.71 -28.96 68.85 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.475 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -67.78 -33.5 74.95 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.985 0.898 . . . . 0.0 109.89 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -60.77 -24.39 65.74 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.488 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.84 95.29 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.731 0.241 . . . . 0.0 110.629 178.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -64.25 -44.82 90.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.7 mtm -62.76 -29.97 71.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.862 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.3 83.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 177.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -64.8 -45.72 85.08 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.623 0.249 . . . . 0.0 110.426 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -60.03 -44.32 94.7 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.317 0.579 . . . . 0.0 110.556 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -69.78 -28.53 65.82 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.083 -0.385 . . . . 0.0 111.071 178.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -66.45 -37.48 85.24 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.13 -34.68 78.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.83 0.347 . . . . 0.0 110.127 178.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 m -74.23 -38.02 63.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.678 0.751 . . . . 0.0 110.551 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.65 -39.92 88.46 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.6 p -60.61 -34.84 60.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 CA-C-N 118.934 0.788 . . . . 0.0 110.278 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -71.49 -41.09 69.73 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 108.914 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -64.17 -26.04 68.35 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.628 -0.67 . . . . 0.0 110.948 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.88 -28.61 51.58 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.848 -0.532 . . . . 0.0 111.368 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -62.81 -34.31 77.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.252 0.549 . . . . 0.0 110.294 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -76.06 -43.44 43.73 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -60.83 -32.76 72.14 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -57.36 -17.73 13.98 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -58.75 -16.82 18.47 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 177.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 21.5 p -62.66 -17.76 61.09 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 177.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.48 -22.76 63.88 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.231 0.468 . . . . 0.0 111.68 178.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -72.87 -14.21 61.44 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -104.85 137.68 42.26 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 21.9 t -88.67 93.3 4.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.059 0.457 . . . . 0.0 112.056 -176.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -156.95 162.12 39.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 174.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -164.02 -62.59 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 177.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 3.4 m120 58.66 19.26 6.59 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 174.12 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -94.67 166.81 26.66 Favored Glycine 0 N--CA 1.454 -0.161 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 178.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -141.38 134.05 28.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.5 mp -130.84 161.27 32.16 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -152.93 157.56 40.8 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 177.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 43.0 ttt-85 -155.9 146.24 21.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -70.88 160.05 33.51 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -154.74 153.57 31.46 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.47 ' HG ' ' H ' ' A' ' 184' ' ' PHE . 28.5 tp -151.29 146.36 25.98 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 -178.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -72.19 -18.71 61.83 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . 0.47 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 1.3 t80 66.22 167.15 0.21 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.061 1.344 . . . . 0.0 114.217 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.9 0 CA-C-O 116.141 -1.885 . . . . 0.0 106.402 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 mtt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.87 0.366 . . . . 25.0 110.866 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.04 150.66 32.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 50.0 110.882 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.54 -42.85 71.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 50.0 110.979 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.4 mt -61.38 -35.91 78.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 50.0 110.884 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -51.96 -39.9 60.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 50.0 110.799 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -52.08 -39.54 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.137 -0.483 . . . . 50.0 110.87 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.44 -54.31 12.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.092 -0.503 . . . . 25.0 111.118 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -51.9 -43.98 63.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 50.0 110.914 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -71.98 -34.65 69.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.111 -0.495 . . . . 50.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -55.34 28.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.908 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 42.1 mm -59.72 -37.4 70.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.251 -0.431 . . . . 50.0 111.093 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.26 -53.74 32.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 25.0 111.107 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.01 -35.63 75.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 25.0 111.089 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -61.27 -54.97 37.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.865 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -56.07 -55.31 34.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.232 -0.44 . . . . 50.0 110.932 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.1 t -53.27 -51.88 36.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 50.0 111.117 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -58.47 -33.72 70.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 50.0 110.923 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.69 -16.57 64.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.821 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 117.95 -24.91 8.65 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 25.0 112.445 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -51.2 103.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 25.0 110.833 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.34 149.79 34.94 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.705 -0.76 . . . . 25.0 112.516 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.8 t -90.29 106.71 17.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.814 0.34 . . . . 50.0 111.099 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.9 mt -69.53 -35.69 67.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 25.0 111.137 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -161.03 118.98 2.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.31 110.77 6.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 25.0 111.086 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 133.2 49.9 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.843 -0.694 . . . . 50.0 112.573 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.31 -57.64 2.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.887 0.375 . . . . 50.0 110.873 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -179.35 -73.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 50.0 110.913 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -139.25 35.19 2.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 50.0 110.801 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.13 128.83 18.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 50.0 110.871 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 78.1 mt -141.49 131.93 26.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.101 -0.5 . . . . 25.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.7 m95 -101.33 149.66 23.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 50.0 110.864 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.8 mt -140.74 116.74 10.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 50.0 110.913 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.48 146.35 42.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 50.0 110.894 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.401 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . . . -103.42 104.11 39.49 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.677 0.751 . . . . 25.0 111.085 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.401 ' HD2' ' HA ' ' A' ' 35' ' ' ALA . 54.0 Cg_endo -69.84 -32.22 18.65 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.636 2.224 . . . . 50.0 112.279 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -57.57 -27.02 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.306 -0.407 . . . . 50.0 110.858 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.9 mttt 66.07 44.65 2.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.907 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 p -83.91 -176.71 6.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.43 . . . . 25.0 110.806 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.42 -35.0 17.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 50.0 110.851 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.55 132.13 35.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 50.0 110.934 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.36 -65.26 0.95 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 50.0 110.937 179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 18.8 mt -138.37 166.66 23.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 50.0 110.949 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.37 129.23 73.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 50.0 111.093 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 42.4 ttt180 -115.95 146.67 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 25.0 110.859 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.3 tp -123.83 110.33 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 50.0 110.974 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -116.72 140.61 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.287 -0.415 . . . . 25.0 110.966 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -125.65 101.52 6.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.52 . . . . 50.0 110.889 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -144.08 148.76 35.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 50.0 110.898 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -78.82 146.05 33.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 25.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.0 129.62 36.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.194 -0.457 . . . . 50.0 110.927 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.63 -52.2 2.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.108 -0.496 . . . . 50.0 110.804 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -99.83 168.41 9.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 25.0 110.956 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -34.48 36.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 50.0 110.828 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -54.68 -34.92 62.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 50.0 110.957 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -65.78 -33.38 75.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 50.0 110.84 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.5 tpp -58.15 -52.91 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 50.0 110.839 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 24.8 m -68.86 -33.04 57.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.234 -0.439 . . . . 50.0 111.12 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -26.22 68.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 50.0 110.805 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -77.26 -29.98 54.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 50.0 110.884 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 8.1 mm -73.62 -43.26 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 50.0 111.142 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -29.12 16.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.271 -0.422 . . . . 50.0 110.887 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.76 -35.95 57.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 50.0 110.895 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -58.4 -51.43 69.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.468 . . . . 50.0 110.916 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.06 -35.9 48.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.154 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -61.74 -43.43 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.446 . . . . 50.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -35.52 58.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.277 -0.42 . . . . 25.0 110.866 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 81.1 t -52.79 -36.6 23.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 50.0 111.189 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -61.19 -36.1 78.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 50.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -48.41 81.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 50.0 110.898 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.7 t -74.82 -41.49 46.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 25.0 111.188 179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.83 -36.31 47.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 50.0 110.846 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -72.32 -35.94 68.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.825 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -47.28 53.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.43 . . . . 50.0 110.887 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.4 mp -70.88 -19.61 62.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 50.0 110.956 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.74 33.37 87.07 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.845 -0.693 . . . . 25.0 112.497 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -103.63 176.17 5.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 50.0 110.847 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.29 -52.96 5.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.935 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -127.03 144.77 50.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.116 -0.493 . . . . 50.0 110.805 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.83 111.57 19.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 50.0 110.854 179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -82.08 119.18 23.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 50.0 110.914 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 5.7 tt -130.7 135.18 47.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.45 . . . . 50.0 110.904 179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.4 tp -99.43 107.44 19.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 50.0 110.896 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -105.36 108.89 20.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 25.0 110.87 179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.8 t -106.41 146.43 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 50.0 111.174 179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -108.16 137.59 45.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 50.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -114.12 103.66 11.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 50.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 p -131.06 169.25 16.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 50.0 110.862 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.8 t -67.09 -35.29 79.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 25.0 111.126 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -162.78 176.03 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.434 . . . . 50.0 110.853 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.68 161.34 79.24 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.533 0.683 . . . . 25.0 111.099 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.92 176.86 6.32 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.651 2.234 . . . . 50.0 112.324 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 10.6 m -51.46 -47.36 35.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 50.0 111.109 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 171.92 -172.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 50.0 110.868 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 57.48 38.79 28.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 18.2 p-90 -120.57 -32.2 4.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 50.0 110.907 -179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -51.83 -35.28 43.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.254 -0.43 . . . . 50.0 110.861 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.87 -40.24 96.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 50.0 110.858 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 2.4 mp -65.02 -47.77 86.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 50.0 111.181 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -50.9 -30.35 14.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 25.0 111.087 179.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.55 -38.19 12.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 50.0 110.944 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.28 139.88 58.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 50.0 110.921 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.9 m -101.89 143.66 31.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.44 . . . . 25.0 111.183 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 7.9 t80 -97.14 104.28 16.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.242 -0.436 . . . . 50.0 110.858 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -112.92 100.97 9.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 50.0 110.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -101.74 86.81 3.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 50.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.43 -112.43 4.97 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.726 -0.749 . . . . 25.0 112.458 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -95.0 30.01 2.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.355 . . . . 25.0 111.252 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 18.3 t -119.39 151.82 21.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 50.0 111.043 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 36.2 p -137.05 112.55 9.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.044 -0.526 . . . . 50.0 110.794 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -142.81 139.1 28.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.041 -0.527 . . . . 50.0 111.101 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -116.32 136.0 22.97 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.691 0.758 . . . . 50.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 149.16 66.24 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.669 2.246 . . . . 50.0 112.317 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.72 136.56 16.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.279 -0.418 . . . . 25.0 111.119 179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.1 tt -138.83 144.21 30.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.159 -0.473 . . . . 50.0 111.093 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.8 t -124.57 124.91 69.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 50.0 111.196 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.65 140.06 51.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 50.0 110.834 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -75.04 -33.12 55.52 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.706 -0.759 . . . . 25.0 112.489 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 5.1 t -84.63 -34.05 23.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 25.0 111.149 -179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.08 33.04 4.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 50.0 110.835 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.68 -36.2 56.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.416 . . . . 50.0 110.94 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -58.55 -37.46 75.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.855 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.03 -35.82 64.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 50.0 110.927 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -72.61 -38.13 67.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 50.0 110.857 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.22 -42.79 63.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 50.0 110.925 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -79.83 -34.97 38.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 50.0 110.886 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.12 -33.81 76.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 25.0 111.112 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.55 -60.13 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 50.0 111.108 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -113.09 76.18 2.3 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.762 0.792 . . . . 50.0 110.944 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -30.71 22.04 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.727 2.285 . . . . 50.0 112.311 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 t -69.6 -16.32 63.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.265 -0.425 . . . . 25.0 110.863 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -70.45 139.69 51.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.067 -0.515 . . . . 50.0 110.828 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -67.54 91.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 50.0 110.934 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.76 16.14 24.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 25.0 111.148 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.76 -53.22 7.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.861 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -58.68 -35.79 73.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.489 . . . . 25.0 110.889 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -53.71 121.05 7.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 25.0 110.885 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -148.66 137.03 21.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 25.0 110.861 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.98 -37.95 67.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 25.0 110.915 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -60.45 -40.04 89.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 25.0 110.874 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -97.68 25.81 5.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.905 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -114.81 132.72 56.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 25.0 111.074 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 4.1 t -164.5 164.13 21.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 25.0 110.776 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 54.1 p90 -61.4 -36.2 79.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.495 . . . . 25.0 110.873 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -67.52 -36.13 80.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 50.0 110.896 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.43 -37.91 70.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.459 . . . . 50.0 110.861 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.57 -49.72 75.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 25.0 111.064 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -36.63 66.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 50.0 110.878 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.0 mtt -68.93 -41.44 78.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 50.0 110.932 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.64 -38.62 72.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 25.0 111.088 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -63.72 -53.68 47.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 50.0 110.871 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.08 -43.74 64.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.275 -0.42 . . . . 25.0 110.839 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -66.54 -38.96 88.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 50.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.32 -46.47 88.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.51 -36.32 55.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 50.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.93 -36.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 50.0 110.878 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -62.73 -54.6 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 50.0 110.925 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.0 -35.95 23.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 50.0 111.13 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -63.94 -60.56 3.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 50.0 110.999 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -56.39 -35.37 67.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 50.0 110.892 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -54.79 -35.06 63.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 50.0 110.857 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.92 -51.45 69.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.251 -0.431 . . . . 50.0 110.91 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -68.41 -36.04 78.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 50.0 110.919 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -67.83 -36.14 79.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.453 . . . . 50.0 110.907 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -37.58 55.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.127 -0.488 . . . . 50.0 110.862 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -38.89 58.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.159 -0.473 . . . . 50.0 110.891 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.42 -41.5 66.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 25.0 111.079 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -51.56 -34.51 37.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.222 -0.445 . . . . 25.0 110.913 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -69.08 -35.03 76.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.079 -0.51 . . . . 25.0 111.122 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -70.29 -66.21 0.63 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 25.0 111.097 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -40.97 -78.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 50.0 111.154 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 175.08 -67.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 25.0 110.898 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -148.28 177.89 9.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 50.0 110.959 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -168.02 142.01 3.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 25.0 110.906 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 106.89 163.01 22.19 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.691 -0.766 . . . . 25.0 112.435 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -156.87 176.39 12.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 50.0 110.884 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -171.16 169.23 6.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.252 -0.431 . . . . 50.0 110.917 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -171.9 -179.54 2.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.483 . . . . 25.0 110.939 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 62.18 98.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 25.0 110.847 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.27 92.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 25.0 110.939 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -179.08 -171.45 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 50.0 110.911 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 62.86 163.18 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.13 -0.486 . . . . 50.0 110.883 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 31.5 p90 -174.61 137.57 0.48 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 50.0 110.809 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.25 110.17 13.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.066 -0.516 . . . . 50.0 110.823 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 25.0 110.924 -180.0 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.3 mtp . . . . . 0 N--CA 1.498 1.935 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -67.12 30.85 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 117.808 2.522 . . . . 0.0 117.808 -175.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.9 tt -67.48 -48.64 66.57 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 120.786 -1.196 . . . . 0.0 108.965 -179.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.12 -35.06 79.03 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.335 0.588 . . . . 0.0 110.887 177.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -59.62 -27.17 66.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.107 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.49 -48.98 78.63 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.6 m -67.44 -38.76 85.02 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.968 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -55.17 -53.43 56.01 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -65.95 -30.87 71.51 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.953 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.68 -33.38 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.088 -0.382 . . . . 0.0 111.85 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 7.4 mm -68.04 -43.66 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.36 -43.61 88.48 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.32 96.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.36 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -59.03 -46.02 89.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.143 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.28 -53.2 39.59 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.29 -0.164 . . . . 0.0 111.025 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 73.1 t -53.99 -44.47 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.944 -0.473 . . . . 0.0 111.883 178.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.83 -16.28 64.02 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.462 -0.774 . . . . 0.0 112.722 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.2 m -89.79 1.24 56.38 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.423 0.289 . . . . 0.0 110.924 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.06 -1.0 28.45 Favored Glycine 0 C--O 1.228 -0.278 0 N-CA-C 115.887 1.115 . . . . 0.0 115.887 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.431 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 37.7 m-85 -68.63 118.51 11.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 117.974 0.887 . . . . 0.0 109.39 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.86 130.82 11.93 Favored Glycine 0 CA--C 1.508 -0.386 0 N-CA-C 111.051 -0.819 . . . . 0.0 111.051 -177.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.6 t -75.47 130.31 36.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.14 0.495 . . . . 0.0 110.164 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.9 mt -102.46 -44.54 10.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 175.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -150.62 138.63 20.08 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.21 105.41 5.03 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 -177.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.09 42.73 50.53 Favored Glycine 0 CA--C 1.503 -0.668 0 N-CA-C 116.655 1.422 . . . . 0.0 116.655 167.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -59.18 -44.26 92.16 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.2 p -156.75 -71.94 0.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.648 176.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -121.85 8.08 9.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.305 -0.862 . . . . 0.0 113.218 -176.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -131.48 138.61 49.06 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -171.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.9 mt -138.96 137.26 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -120.79 133.55 55.32 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.151 0.58 . . . . 0.0 109.967 177.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mp -131.07 137.28 49.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.908 0.883 . . . . 0.0 110.272 -178.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -86.17 137.04 32.95 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.78 118.25 70.9 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 84.8 Cg_endo -76.26 -25.45 9.95 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 117.192 -1.405 . . . . 0.0 112.035 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -72.94 -30.52 63.93 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.393 1.077 . . . . 0.0 112.012 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.2 mttp 55.99 39.24 30.54 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.722 1.249 . . . . 0.0 111.554 177.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.2 t -77.66 -172.99 2.81 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 104.48 -2.415 . . . . 0.0 104.48 170.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -41.4 -1.78 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.071 1 N-CA-C 121.945 4.054 . . . . 0.0 121.945 -178.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -132.95 125.37 29.66 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -74.58 -33.63 62.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.589 0.709 . . . . 0.0 109.54 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.06 161.03 37.81 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.711 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.7 t -130.79 139.06 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -123.87 136.38 54.32 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tp -113.21 124.97 53.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -136.45 135.56 38.76 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -118.5 100.09 7.23 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.063 0.459 . . . . 0.0 112.177 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.41 150.23 30.21 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -87.82 151.41 22.88 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.6 mt -138.22 120.28 15.59 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -88.14 -33.41 18.22 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.098 0.475 . . . . 0.0 110.755 -178.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -129.87 149.9 51.4 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.0 ptt180 -66.93 -22.42 65.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.673 -0.642 . . . . 0.0 111.147 -179.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -32.69 73.77 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -74.37 -39.5 62.7 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 46.3 ttm -58.54 -48.59 80.38 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.279 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 20.8 m -63.2 -31.9 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 122.037 -0.414 . . . . 0.0 111.59 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -70.07 -34.13 72.8 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.834 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.22 -42.56 91.3 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 175.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -66.17 -31.28 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -63.82 -39.54 94.47 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -76.64 -41.98 43.85 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -57.48 -36.58 71.67 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 113.034 0.754 . . . . 0.0 113.034 178.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.89 -37.28 84.0 Favored 'General case' 0 C--O 1.208 -1.124 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -37.28 77.39 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.815 0.341 . . . . 0.0 110.471 177.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -61.16 -47.69 85.04 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 75.4 t -65.12 -40.72 89.78 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.408 -179.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.31 -40.83 83.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -65.23 -44.74 87.25 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.733 -0.605 . . . . 0.0 110.884 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.7 t -67.01 -36.97 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-O 121.231 0.538 . . . . 0.0 110.176 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.07 -44.52 94.68 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.812 -0.555 . . . . 0.0 110.749 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -65.59 -41.08 93.22 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.2 -40.0 92.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.2 mp -94.57 -0.07 54.83 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.07 15.38 65.07 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 116.241 1.256 . . . . 0.0 116.241 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.8 mtt-85 -72.47 142.86 48.59 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.25 -32.99 67.17 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.35 -0.843 . . . . 0.0 112.979 -177.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.45 160.82 43.12 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 102.31 -3.218 . . . . 0.0 102.31 178.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.6 mtp -141.86 148.23 38.44 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.858 1.208 . . . . 0.0 113.004 178.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -117.6 141.27 48.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 174.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.2 tp -128.26 135.44 49.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 68.0 tp -94.14 119.5 33.06 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 170.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -115.04 108.73 17.06 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -177.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.4 t -107.68 118.44 55.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -176.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -88.01 146.21 25.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.226 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -121.47 116.86 25.5 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 172.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 78.2 p -136.45 160.32 39.11 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.226 0.329 . . . . 0.0 110.722 -174.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.2 t -76.87 -29.24 55.73 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.583 -0.698 . . . . 0.0 111.381 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -150.7 164.08 37.01 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 106.26 -1.755 . . . . 0.0 106.26 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.88 152.78 41.87 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -177.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -59.4 149.21 82.83 Favored 'Trans proline' 0 C--N 1.349 0.579 0 O-C-N 122.367 0.667 . . . . 0.0 113.42 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.8 m -77.79 -16.14 14.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 117.317 2.34 . . . . 0.0 117.317 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -120.73 100.26 7.01 Favored 'General case' 0 C--O 1.21 -0.991 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -175.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 44.6 31.46 0.63 Allowed 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 117.29 2.33 . . . . 0.0 117.29 172.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.7 p-90 -61.94 -22.23 65.44 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.461 -0.775 . . . . 0.0 112.642 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.88 -31.28 69.65 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.04 -0.413 . . . . 0.0 111.664 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -58.75 -39.85 82.14 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.768 -0.826 . . . . 0.0 108.768 177.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.8 mm -63.89 -39.35 85.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.04 -177.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.28 -10.33 57.33 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -112.0 3.81 17.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -109.88 105.85 15.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.852 -175.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.0 m -68.36 122.42 18.35 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 174.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -84.05 122.55 28.94 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -123.01 132.87 54.32 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.783 0.802 . . . . 0.0 109.643 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -147.61 125.48 11.97 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.23 -119.42 13.0 Favored Glycine 0 C--O 1.227 -0.343 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -176.797 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -119.23 19.34 12.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.167 0.984 . . . . 0.0 108.576 175.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 84.6 t -97.14 138.45 22.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.618 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -126.12 139.98 52.94 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 172.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.2 t -132.72 136.76 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.262 0 CA-C-O 121.813 0.816 . . . . 0.0 110.347 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.2 103.37 47.9 Favored Pre-proline 0 N--CA 1.433 -1.279 0 CA-C-N 113.422 -1.717 . . . . 0.0 109.347 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.18 152.61 27.62 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 115.636 -2.443 . . . . 0.0 112.483 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.69 154.69 38.96 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.63 -2.73 . . . . 0.0 103.63 175.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -150.76 135.89 10.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.5 m -111.99 138.03 42.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 172.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.44 142.57 47.43 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.76 -27.68 59.36 Favored Glycine 0 C--O 1.227 -0.283 0 CA-C-N 115.956 -0.565 . . . . 0.0 114.169 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.8 p -55.45 -30.03 59.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.84 26.27 2.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.352 0.596 . . . . 0.0 110.527 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 27.6 tp -43.51 -44.04 5.79 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -170.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -60.91 -43.27 98.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 119.118 0.872 . . . . 0.0 112.068 -177.613 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -74.95 -38.7 61.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 122.282 1.039 . . . . 0.0 110.564 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.82 -38.97 92.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.035 0.921 . . . . 0.0 111.686 -177.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.78 -50.04 73.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.102 -178.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -72.06 -15.7 62.02 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.404 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.21 -34.67 63.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 56.2 t -91.18 -41.51 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.113 0.482 . . . . 0.0 109.979 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -124.24 76.33 60.65 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 122.882 0.473 . . . . 0.0 111.532 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.13 -11.64 32.15 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 117.726 -1.049 . . . . 0.0 112.181 177.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 24.7 p -76.27 -8.74 57.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.556 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -93.21 131.41 38.33 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.195 0.521 . . . . 0.0 109.598 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 -75.12 113.9 12.99 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 22.9 p -62.19 -27.34 68.9 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.93 -23.76 66.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 178.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -65.35 -29.27 69.98 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 177.459 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 22.9 t -114.23 52.73 0.82 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.385 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.8 t -56.17 145.44 26.23 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 177.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -60.33 -29.56 68.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.444 0.64 . . . . 0.0 110.394 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -66.03 -29.78 70.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.654 0.74 . . . . 0.0 111.622 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -95.74 -14.69 23.15 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.435 -174.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -78.12 71.94 4.62 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -175.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 59.6 p -114.39 153.67 29.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.343 0.592 . . . . 0.0 111.005 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 35.3 p90 -63.8 -28.75 70.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.243 0.544 . . . . 0.0 110.471 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -66.57 -48.13 70.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.485 0.66 . . . . 0.0 109.397 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -68.45 -24.39 64.72 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.847 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.89 -36.79 70.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 177.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.83 -41.27 95.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.467 0.651 . . . . 0.0 109.382 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 45.9 mtt -68.36 -35.44 77.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.517 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.2 -30.73 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.315 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.97 -48.27 74.62 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.01 -40.58 91.23 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.568 0.699 . . . . 0.0 110.007 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -60.26 -38.92 84.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.394 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -68.18 -45.42 73.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.706 -0.224 . . . . 0.0 110.905 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.19 -39.02 91.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.307 0.575 . . . . 0.0 110.028 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 42.0 m -66.32 -34.59 78.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.04 0.448 . . . . 0.0 110.577 177.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.3 tt -67.33 -39.9 85.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.762 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 66.9 t -58.49 -50.02 80.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.29 -40.4 93.81 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.142 -0.623 . . . . 0.0 110.968 -178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 12.5 ttpp -56.38 -40.15 74.11 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.864 -0.523 . . . . 0.0 110.571 176.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -56.46 -31.38 63.93 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -175.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -65.11 -39.54 93.25 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.067 0.461 . . . . 0.0 110.426 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -76.91 -44.34 32.14 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.757 -0.589 . . . . 0.0 109.463 174.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -55.26 -38.54 68.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -174.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -62.08 -17.48 57.71 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -55.59 -17.83 6.39 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 18.9 p -62.52 -17.62 60.16 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.616 0.367 . . . . 0.0 111.703 176.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.35 -33.19 65.43 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.408 0.683 . . . . 0.0 110.282 176.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -65.06 -14.03 59.45 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -84.92 -1.01 56.13 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.8 t 44.94 70.29 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 173.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -143.86 168.09 20.78 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -126.15 145.38 50.38 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -162.12 174.51 12.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 104.27 177.74 25.26 Favored Glycine 0 C--O 1.23 -0.122 0 CA-C-O 121.189 0.327 . . . . 0.0 113.577 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -151.75 137.41 17.88 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 104.659 -2.348 . . . . 0.0 104.659 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.5 tt -158.24 124.05 4.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 118.061 0.391 . . . . 0.0 109.976 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 -132.65 151.27 52.0 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 104.327 -2.471 . . . . 0.0 104.327 175.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.37 -34.73 48.11 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.931 -0.708 . . . . 0.0 109.768 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 37.64 55.0 1.5 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 178.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -143.93 156.42 44.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.218 -178.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 26.9 tp -129.06 169.34 14.84 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 44.0 p90 -148.75 164.83 33.22 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -134.32 166.4 22.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.902 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.3 ptp . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -97.93 36.38 1.56 Allowed 'General case' 0 C--O 1.22 -0.484 0 CA-C-O 121.278 0.561 . . . . 0.0 112.062 -176.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.3 tt -61.16 -38.18 85.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.114 0.483 . . . . 0.0 109.905 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 69.7 mt -64.1 -42.71 96.8 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.402 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -67.17 -38.48 85.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.667 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -60.9 -50.7 72.37 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.6 m -59.77 -40.1 87.11 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 121.075 0.464 . . . . 0.0 111.008 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -59.7 -45.13 93.07 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -75.6 -34.23 60.6 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.791 1.281 . . . . 0.0 108.776 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tptt -64.63 -39.65 94.09 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.834 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.5 mm -72.1 -40.47 66.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 -42.31 84.24 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.26 98.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -62.07 -46.91 87.04 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.352 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -63.48 -48.04 79.29 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.051 -0.406 . . . . 0.0 110.718 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.6 -37.19 79.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.014 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -74.2 -10.5 59.67 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.077 -1.014 . . . . 0.0 111.765 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.0 m -94.77 12.69 27.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.0 2.63 66.33 Favored Glycine 0 CA--C 1.517 0.204 0 N-CA-C 116.496 1.359 . . . . 0.0 116.496 175.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -70.36 115.09 9.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 118.444 1.122 . . . . 0.0 109.237 178.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.34 133.86 20.44 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.0 t -78.6 118.69 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 40.6 mt -90.27 -44.92 14.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 177.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -149.65 124.65 9.99 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.451 -177.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.12 135.57 32.65 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 104.689 -2.337 . . . . 0.0 104.689 173.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.25 -82.75 0.05 OUTLIER Glycine 0 CA--C 1.507 -0.435 0 C-N-CA 120.257 -0.973 . . . . 0.0 112.539 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -70.56 158.2 36.55 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.94 -13.08 59.1 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -178.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -84.15 -41.69 16.79 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 115.667 1.728 . . . . 0.0 115.667 -174.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -136.93 147.09 46.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 116.511 2.041 . . . . 0.0 116.511 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.1 mt -136.36 130.05 47.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 174.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.9 m95 -103.23 127.25 50.6 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 177.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -123.02 142.37 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.039 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -92.26 133.84 35.45 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 175.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.22 114.0 29.07 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.22 -29.13 14.65 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 116.667 -1.756 . . . . 0.0 113.245 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -74.15 -11.76 60.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.006 0.523 . . . . 0.0 111.279 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 mttm 59.4 41.6 19.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 123.355 1.55 . . . . 0.0 107.896 -178.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -177.57 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 110.898 -2.864 . . . . 0.0 117.952 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 p -50.4 -26.78 5.35 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.537 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -117.12 139.09 51.16 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -81.98 -35.04 29.4 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 73.4 mt -133.62 158.84 42.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.831 -177.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.58 134.38 66.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -116.39 102.86 9.9 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.18 129.17 34.3 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.167 -2.16 . . . . 0.0 105.167 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -136.37 138.32 41.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -105.22 95.22 5.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.73 122.78 7.63 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.203 0.525 . . . . 0.0 111.065 -178.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -91.54 134.56 34.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -124.36 126.61 46.27 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -171.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -72.9 -41.18 64.9 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -129.18 152.07 49.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -63.41 -19.72 64.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -73.22 -33.01 65.1 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 121.982 -0.449 . . . . 0.0 109.938 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -67.25 -28.41 68.02 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.755 -0.591 . . . . 0.0 109.484 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 77.4 mtp -63.86 -51.73 63.26 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 9.1 m -65.8 -31.79 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.541 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -61.46 -43.91 98.03 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.543 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -64.52 -46.61 82.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.278 0.561 . . . . 0.0 110.187 -178.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mp -68.22 -33.25 59.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 121.272 -0.892 . . . . 0.0 110.618 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.188 -0.945 . . . . 0.0 110.08 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -76.56 -43.64 38.16 Favored 'General case' 0 C--O 1.243 0.729 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -56.93 -40.08 75.68 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.628 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -35.88 75.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.045 0.384 . . . . 0.0 111.276 -178.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -72.46 -40.05 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.502 0.667 . . . . 0.0 109.308 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.4 -38.57 84.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.554 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 89.3 t -70.43 -38.4 73.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 CA-C-O 118.628 -0.701 . . . . 0.0 110.802 179.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.84 -34.32 77.1 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.414 1.461 . . . . 0.0 110.123 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttt-85 -62.56 -44.8 95.43 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.611 -0.436 . . . . 0.0 109.926 175.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 84.4 t -66.62 -41.39 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.19 -42.87 77.82 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 123.271 0.628 . . . . 0.0 109.411 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -67.7 -40.9 84.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.623 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -58.53 -41.51 85.68 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -100.44 6.65 44.43 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.11 12.38 60.3 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 117.213 1.645 . . . . 0.0 117.213 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.8 ttt85 -62.07 145.1 54.18 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.854 0.827 . . . . 0.0 109.825 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -68.2 -34.91 77.14 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 122.039 -0.413 . . . . 0.0 110.755 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -149.05 160.66 43.13 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.0 mmm -127.92 136.08 50.86 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.48 138.06 50.66 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 tt -138.55 140.98 39.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 118.356 0.525 . . . . 0.0 112.251 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -104.44 118.43 36.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 173.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -107.99 127.38 53.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.3 t -121.79 111.91 32.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 121.363 -0.135 . . . . 0.0 111.171 -178.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -81.59 147.57 29.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -120.76 115.95 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 171.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 t -131.25 160.5 34.72 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.568 0.543 . . . . 0.0 111.128 -173.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.1 m -67.1 -46.75 73.25 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -149.29 170.87 17.51 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.45 152.95 70.87 Favored Pre-proline 0 C--N 1.314 -0.971 0 CA-C-N 115.385 -0.825 . . . . 0.0 108.92 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.75 151.42 47.92 Favored 'Trans proline' 0 C--N 1.35 0.618 0 O-C-N 122.358 0.662 . . . . 0.0 112.008 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -61.18 -20.03 21.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 117.761 2.504 . . . . 0.0 117.761 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -155.51 145.63 21.66 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.6 t0 39.9 30.15 0.06 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 174.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -73.47 -22.4 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.339 -0.85 . . . . 0.0 110.705 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -64.85 -32.02 73.53 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.922 -0.486 . . . . 0.0 111.525 -176.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -64.18 -25.11 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.713 -0.395 . . . . 0.0 109.996 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.6 mm -73.96 -43.43 52.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -178.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.83 -16.95 63.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.665 0.745 . . . . 0.0 110.105 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -95.1 4.03 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.61 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -126.64 118.76 25.46 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.7 m -68.28 126.83 30.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 173.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -85.72 111.77 20.43 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -110.67 125.23 53.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.933 0.397 . . . . 0.0 110.951 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.4 ttpp -138.58 101.9 4.46 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.01 -112.72 5.08 Favored Glycine 0 C--N 1.322 -0.231 0 C-N-CA 120.164 -1.017 . . . . 0.0 111.806 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.9 p -89.66 9.15 28.06 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 44.7 t -115.46 143.48 25.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.6 m -127.76 118.18 23.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 171.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.5 t -120.49 130.88 73.97 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.304 0 CA-C-O 121.624 0.726 . . . . 0.0 111.21 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.49 110.9 61.66 Favored Pre-proline 0 N--CA 1.433 -1.322 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.587 177.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -80.14 150.56 20.37 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.169 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.92 154.14 37.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 176.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.0 tt -147.4 125.8 3.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -177.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.7 t -102.37 120.96 52.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.05 136.24 47.24 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -179.387 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.67 -22.53 53.32 Favored Glycine 0 C--O 1.228 -0.257 0 N-CA-C 114.694 0.637 . . . . 0.0 114.694 -177.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 54.3 p -59.47 -32.08 69.91 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.1 ptm -139.89 29.5 2.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 122.051 0.929 . . . . 0.0 108.845 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 tt -46.1 -41.25 12.06 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -172.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -62.35 -45.0 95.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.006 0.821 . . . . 0.0 111.126 -176.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -74.44 -39.75 62.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.783 0.801 . . . . 0.0 111.287 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -66.58 -37.84 85.78 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.007 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 14.4 tp -62.1 -36.37 81.51 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.928 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.33 -15.93 61.88 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.71 -31.37 59.63 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.01 -40.28 10.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.258 -179.03 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -125.83 77.05 70.63 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.441 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -67.49 -19.82 48.42 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.427 0.895 . . . . 0.0 114.427 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.2 m -80.06 -9.46 59.7 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -64.82 140.01 58.82 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.286 0.565 . . . . 0.0 111.346 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -92.93 105.91 17.95 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.576 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 33.7 p -73.86 -20.62 60.37 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 176.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -62.81 -20.11 64.71 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 123.848 0.859 . . . . 0.0 111.838 178.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -77.23 6.64 6.3 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.455 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -157.46 -179.15 7.9 Favored 'General case' 0 C--O 1.221 -0.428 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 25.1 t -150.92 155.32 38.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 103.078 -2.934 . . . . 0.0 103.078 175.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -68.38 -22.73 64.63 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 118.396 0.543 . . . . 0.0 109.985 178.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -65.9 -24.72 66.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.955 0.883 . . . . 0.0 110.662 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 38.3 t60 -82.66 -4.31 57.59 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.774 -175.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -74.44 43.55 0.18 Allowed 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -175.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 73.3 m -66.04 147.21 53.7 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 177.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -64.04 -36.35 83.7 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -69.34 -27.88 65.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.858 0.837 . . . . 0.0 110.027 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -61.86 -26.09 67.93 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.46 -178.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.66 96.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.435 0.636 . . . . 0.0 110.054 177.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -68.92 -39.56 79.58 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 90.5 mtp -65.82 -36.7 84.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.98 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.95 78.78 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.263 . . . . 0.0 110.524 178.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -65.44 -44.85 85.99 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 177.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.02 -44.23 96.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.521 0.677 . . . . 0.0 109.73 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 -61.11 -41.12 96.11 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.645 179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.32 -41.38 98.51 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.66 -38.28 90.5 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.349 -0.844 . . . . 0.0 110.142 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 59.9 p -69.94 -30.02 67.31 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.854 175.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.49 -43.97 92.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.357 0.663 . . . . 0.0 109.898 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 76.7 t -57.95 -46.54 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.659 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -71.43 -37.56 71.43 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.107 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -59.68 -29.88 68.38 Favored 'General case' 0 C--O 1.216 -0.708 0 O-C-N 122.02 -0.425 . . . . 0.0 111.495 178.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -54.89 -31.1 59.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.378 0.535 . . . . 0.0 111.096 178.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -63.13 -36.53 83.92 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.955 0.883 . . . . 0.0 110.95 178.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -76.84 -41.95 42.1 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.16 175.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.5 tm0? -63.78 -40.87 97.72 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -174.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.72 -17.76 10.12 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -61.98 -47.49 84.58 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 122.22 -0.3 . . . . 0.0 110.414 177.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 33.9 p -74.51 -35.35 63.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.105 0.479 . . . . 0.0 110.579 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -60.99 -19.59 61.45 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -178.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -50.74 -13.95 0.17 Allowed 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 63.72 61.65 0.97 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 174.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 32.6 m -76.13 -0.49 2.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.087 175.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -143.01 159.11 42.85 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.063 -2.94 . . . . 0.0 103.063 178.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -160.27 177.72 10.35 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 64.12 21.53 12.6 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.624 1.169 . . . . 0.0 113.388 177.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -95.8 10.8 68.39 Favored Glycine 0 C--O 1.224 -0.491 0 N-CA-C 114.376 0.51 . . . . 0.0 114.376 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -150.34 163.87 37.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.472 0.636 . . . . 0.0 109.75 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 60.3 tp -140.73 -51.97 0.47 Allowed 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.753 0.658 . . . . 0.0 109.41 178.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 53.36 -105.61 0.26 Allowed 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 175.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 62.96 74.78 0.42 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.482 1.113 . . . . 0.0 113.164 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -58.19 152.23 17.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.777 177.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -133.48 68.13 1.5 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.211 0.529 . . . . 0.0 111.272 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 62.2 tp -79.47 84.66 5.33 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -153.99 104.29 2.64 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -178.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -126.18 1.38 7.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.528 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.916 0 CA-C-O 116.366 -1.778 . . . . 0.0 110.217 -177.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.8 mtm . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -151.69 155.27 37.97 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.7 tt -54.53 -46.11 73.5 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -176.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -61.75 -30.56 70.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -62.84 -35.46 80.02 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.1 m -61.93 -42.78 99.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.53 0.681 . . . . 0.0 111.845 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -59.92 -51.03 71.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.511 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -69.75 -27.34 64.87 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 121.867 -0.521 . . . . 0.0 111.357 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.507 ' HZ1' ' CG ' ' A' ' 136' ' ' ASP . 62.5 mmtt -66.21 -43.56 86.36 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.811 -0.555 . . . . 0.0 110.886 176.567 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.7 mm -70.62 -37.5 69.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.0 -45.35 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.49 -44.52 90.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.377 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -57.58 -46.74 83.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.37 -178.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.12 -50.91 59.79 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -66.0 -31.04 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.54 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -68.16 -14.34 62.9 Favored 'General case' 0 C--O 1.221 -0.425 0 O-C-N 121.855 -0.528 . . . . 0.0 110.719 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.7 m -95.91 8.9 42.35 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 122.767 0.427 . . . . 0.0 109.998 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.64 -2.88 58.94 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 115.435 0.934 . . . . 0.0 115.435 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -65.44 115.23 5.47 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 109.905 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.3 138.57 27.96 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.374 -176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.2 t -83.11 107.35 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.0 mt -71.91 -47.23 56.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.92 130.56 10.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.232 178.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.36 136.32 33.04 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 101.146 -3.65 . . . . 0.0 101.146 170.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.02 -59.96 0.06 OUTLIER Glycine 0 CA--C 1.5 -0.88 0 N-CA-C 106.504 -2.638 . . . . 0.0 106.504 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -65.85 145.28 56.14 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 172.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.9 m -77.81 -16.96 57.96 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.911 -176.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -92.37 -19.57 21.96 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 -173.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -142.32 149.72 39.84 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.1 mt -141.25 133.1 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -103.5 130.02 50.8 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.551 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -124.39 141.18 52.28 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -99.29 145.79 26.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.47 105.65 17.02 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.02 -16.47 32.28 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 118.012 -0.858 . . . . 0.0 111.49 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -61.62 -28.7 69.56 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.017 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 58.79 37.79 24.87 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.2 p -76.75 -176.28 3.78 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 112.495 -2.139 . . . . 0.0 109.593 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 p -54.87 -8.91 0.29 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -132.9 136.12 45.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -80.27 -35.94 35.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.305 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 40.4 mt -138.6 163.34 32.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.116 -177.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.2 p -138.63 139.41 41.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -119.34 132.87 55.94 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mp -106.24 122.46 46.27 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 177.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.53 121.28 18.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 118.118 0.417 . . . . 0.0 110.659 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -100.8 114.93 29.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.677 0.751 . . . . 0.0 109.188 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -151.64 150.37 30.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.456 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.0 147.72 44.87 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 174.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 73.6 mt -139.83 107.64 5.66 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -83.0 -40.55 19.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.64 0.734 . . . . 0.0 110.892 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -132.44 156.72 46.22 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.927 -0.578 . . . . 0.0 112.145 -178.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 95' ' ' ASP . 15.9 ptt180 -64.97 -15.33 62.1 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.098 0.475 . . . . 0.0 111.093 175.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -63.35 -37.44 87.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -75.46 -30.86 60.08 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.952 0.406 . . . . 0.0 110.057 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 97.1 mtp -63.58 -47.35 81.87 Favored 'General case' 0 C--O 1.211 -0.972 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.92 -30.74 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.682 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 mtm-85 -61.49 -43.41 98.91 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -59.13 -42.18 89.99 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.17 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -64.51 -30.79 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -61.03 -40.18 92.62 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 177.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -72.96 -37.22 67.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.207 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 68.2 mm-40 -56.2 -50.54 70.95 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.25 -36.57 82.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 122.161 -0.337 . . . . 0.0 111.841 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.47 -43.49 97.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.991 0.424 . . . . 0.0 109.871 178.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -67.33 -42.42 83.61 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.94 -37.55 79.59 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.168 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -58.42 -41.0 84.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.008 0.822 . . . . 0.0 110.137 178.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 87.4 mtt-85 -63.87 -41.66 97.7 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.3 t -69.81 -43.42 79.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.118 0.485 . . . . 0.0 110.167 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -57.53 -41.14 80.29 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -65.85 -37.67 86.81 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.357 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -68.94 -40.26 79.09 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.076 0.465 . . . . 0.0 110.463 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 mp -75.42 -13.21 60.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.136 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.69 6.41 55.19 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 114.084 0.394 . . . . 0.0 114.084 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -73.57 140.78 46.51 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.801 . . . . 0.0 110.352 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -66.45 -38.03 86.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.634 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -131.16 161.3 32.46 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mtp -144.87 148.63 34.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 118.708 0.685 . . . . 0.0 109.824 174.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -121.47 143.49 49.22 Favored 'General case' 0 CA--C 1.514 -0.41 0 O-C-N 123.594 0.559 . . . . 0.0 110.97 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -139.76 125.66 19.64 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.0 tp -93.53 121.75 35.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -111.98 112.61 24.38 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.126 -0.359 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.3 t -105.98 110.94 33.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-O 121.201 0.524 . . . . 0.0 111.834 -176.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -80.1 136.64 36.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -114.18 112.31 22.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 173.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.6 m -132.13 158.23 42.2 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.846 0.355 . . . . 0.0 111.108 -175.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.5 t -74.86 -28.93 60.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.826 -0.546 . . . . 0.0 110.393 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -154.99 166.12 34.6 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 -178.489 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.4 155.09 54.33 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.15 154.34 73.98 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 117.328 -1.315 . . . . 0.0 111.994 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.57 -12.54 13.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 120.402 3.482 . . . . 0.0 120.402 -168.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -151.54 140.45 21.0 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -175.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 54' ' ' ARG . 7.3 m-20 42.69 15.3 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 120.153 3.39 . . . . 0.0 120.153 173.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 25.3 p-90 -63.68 -21.41 66.37 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 120.837 -1.164 . . . . 0.0 113.598 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.66 -29.46 70.65 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -62.39 -33.5 74.88 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.616 0.722 . . . . 0.0 109.615 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 mm -69.19 -40.49 80.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.825 -174.069 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.73 -15.19 63.1 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.866 0.365 . . . . 0.0 111.793 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -102.2 3.27 38.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -177.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -117.42 130.32 56.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.483 0.659 . . . . 0.0 112.155 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -80.71 125.27 29.83 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 173.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -84.02 126.08 32.7 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -123.85 135.61 53.86 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.84 0.829 . . . . 0.0 110.502 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -135.49 91.73 2.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.75 -109.54 2.85 Favored Glycine 0 C--O 1.22 -0.76 0 N-CA-C 107.336 -2.305 . . . . 0.0 107.336 -177.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.0 p -110.85 7.26 21.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.777 0.323 . . . . 0.0 111.558 178.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -87.68 139.36 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 175.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.7 m -126.86 136.99 53.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.9 t -132.09 135.35 58.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -111.14 115.83 52.14 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -79.69 151.08 21.87 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 117.373 -1.284 . . . . 0.0 112.331 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.15 152.72 42.1 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 175.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.7 tt -146.81 131.31 10.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.2 m -113.68 128.45 70.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 103.598 -2.742 . . . . 0.0 103.598 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.33 136.32 54.88 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -47.16 -39.9 13.27 Favored Glycine 0 C--O 1.226 -0.382 0 N-CA-C 117.173 1.629 . . . . 0.0 117.173 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.58 -29.31 58.81 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -142.46 32.7 1.48 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.099 1.428 . . . . 0.0 108.934 -178.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 tp -52.04 -36.4 50.18 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -60.17 -49.86 75.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.562 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.68 -32.98 64.23 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.735 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -63.45 -45.33 91.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.829 0.347 . . . . 0.0 110.719 177.08 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.68 -44.08 96.94 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -75.37 -14.08 60.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.819 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.52 -41.82 37.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.945 0.402 . . . . 0.0 110.03 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.2 p -88.91 -33.98 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.244 0.545 . . . . 0.0 110.577 -179.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 61.1 m-85 -126.78 75.62 75.38 Favored Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 122.0 -0.438 . . . . 0.0 110.233 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -67.29 -10.75 29.71 Favored 'Trans proline' 0 C--N 1.349 0.593 0 CA-C-O 121.415 0.506 . . . . 0.0 113.006 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.4 p -80.26 -9.97 59.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.459 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.84 135.64 33.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.424 0.63 . . . . 0.0 110.5 -178.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 85.9 mtt-85 -86.37 116.11 24.32 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 33.3 p -64.21 -17.32 63.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.775 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.33 -36.01 76.97 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.306 0.574 . . . . 0.0 110.78 176.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.507 ' CG ' ' HZ1' ' A' ' 10' ' ' LYS . 25.1 t0 -75.1 -9.47 58.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.665 0.745 . . . . 0.0 110.58 -177.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.7 t -118.35 34.46 5.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.426 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 64.8 m -59.8 145.79 44.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.232 0.539 . . . . 0.0 109.816 178.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -56.55 -39.07 72.81 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -174.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -60.27 -39.59 87.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 122.005 0.907 . . . . 0.0 110.545 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -83.7 -9.59 58.74 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.682 -175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -82.06 22.21 0.81 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.418 0.627 . . . . 0.0 111.612 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.28 148.08 38.03 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.658 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -60.34 -32.71 71.51 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -72.68 -44.3 61.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.602 0.715 . . . . 0.0 109.869 176.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -61.15 -27.12 68.17 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.295 -178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.1 -39.98 76.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.839 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -78.7 -31.12 46.38 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.969 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 94.0 mmm -63.26 -34.48 77.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.319 176.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -67.86 -44.61 76.73 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.5 -40.88 96.47 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.669 0.747 . . . . 0.0 109.34 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -61.57 -42.26 98.59 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.647 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.42 -42.31 98.73 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 177.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 47.7 mt -64.27 -31.8 73.15 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.235 -0.291 . . . . 0.0 110.334 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.4 m -76.18 -36.36 58.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.771 0.796 . . . . 0.0 110.543 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.36 -34.72 77.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.813 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 2.1 p -52.97 -28.09 13.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.479 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.34 -41.43 89.17 Favored 'General case' 0 C--O 1.218 -0.59 0 O-C-N 121.066 -1.021 . . . . 0.0 109.26 178.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.54 -29.91 70.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.252 0.549 . . . . 0.0 111.774 -179.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -27.85 62.05 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 121.788 -0.57 . . . . 0.0 110.747 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -65.2 -40.84 94.74 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.533 1.061 . . . . 0.0 111.632 -177.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -76.9 -28.88 55.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.032 0.444 . . . . 0.0 110.222 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 89.0 mm-40 -70.95 -41.17 71.46 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.426 0.631 . . . . 0.0 111.402 175.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -67.62 -17.83 64.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.64 0.776 . . . . 0.0 111.609 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -56.97 -17.76 10.97 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 178.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 17.9 p -59.12 -23.96 62.57 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 176.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -61.07 -36.54 79.88 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.361 0.6 . . . . 0.0 110.291 176.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -70.12 -15.03 62.91 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 122.019 -0.426 . . . . 0.0 111.472 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -89.21 4.59 48.12 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.2 t 54.63 42.78 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 122.164 0.983 . . . . 0.0 110.897 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -106.78 168.39 9.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.883 -177.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -154.02 161.63 41.8 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -156.62 -175.38 5.4 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -149.35 163.85 29.27 Favored Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 177.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -126.27 157.17 39.01 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 117.452 0.626 . . . . 0.0 110.366 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 66.3 tp -108.58 121.31 44.73 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 177.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -90.75 -53.02 4.58 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 123.324 0.39 . . . . 0.0 110.723 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 13.3 ttp180 55.1 -151.19 0.4 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.39 0.676 . . . . 0.0 110.977 178.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 50.84 21.78 1.02 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 118.341 2.719 . . . . 0.0 118.341 176.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -74.99 91.93 2.55 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 174.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 33.4 tp -146.42 156.51 43.35 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -109.71 146.85 34.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -178.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -127.16 40.72 3.66 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -177.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 . . . . . 0 C--O 1.243 0.756 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 -178.839 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.922 0.392 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -141.92 162.11 36.3 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 121.935 -0.478 . . . . 0.0 111.546 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.0 mt -62.49 -46.26 89.25 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -176.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.66 -35.32 80.46 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -63.02 -31.76 72.97 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.021 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -63.02 -51.64 65.98 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -64.64 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.294 0.568 . . . . 0.0 111.271 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -56.58 -50.77 70.97 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.264 0.626 . . . . 0.0 111.04 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.385 -0.822 . . . . 0.0 111.71 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -66.3 -42.88 87.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.073 -0.392 . . . . 0.0 110.064 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 14.8 mm -69.2 -39.54 79.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.35 -44.21 79.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.53 99.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.093 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -46.47 90.41 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.913 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.2 mt -65.01 -46.24 82.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.156 0.503 . . . . 0.0 110.889 -179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.8 -38.34 82.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.702 -178.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -78.93 -3.5 45.18 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.242 -0.911 . . . . 0.0 112.374 178.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.9 t -96.46 17.44 16.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.058 0.456 . . . . 0.0 110.008 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.89 -0.77 64.87 Favored Glycine 0 CA--C 1.518 0.246 0 N-CA-C 116.257 1.263 . . . . 0.0 116.257 175.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -75.96 135.47 40.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.109 0.955 . . . . 0.0 110.043 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.77 146.48 20.64 Favored Glycine 0 CA--C 1.505 -0.589 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.1 t -90.19 121.25 40.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 117.794 0.797 . . . . 0.0 109.22 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.6 mt -87.98 -45.66 15.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -161.07 147.49 14.79 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 175.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 115.27 9.75 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -177.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 73.52 40.54 46.99 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.288 -1.125 . . . . 0.0 110.288 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -62.57 -41.81 99.16 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.0 m -146.08 -65.62 0.3 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 171.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -139.13 10.44 2.57 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.513 0.673 . . . . 0.0 112.581 178.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.66 158.99 38.54 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.6 mt -131.2 131.43 63.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -110.3 129.65 55.7 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -117.1 133.8 55.55 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.859 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -85.26 124.32 31.76 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.35 120.93 83.53 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.55 -22.87 37.75 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 117.164 -1.424 . . . . 0.0 113.599 -175.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.98 -18.49 55.9 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -176.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm 59.76 29.0 18.56 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-O 121.961 0.886 . . . . 0.0 109.509 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 t -65.91 -177.56 0.49 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 113.872 -1.513 . . . . 0.0 110.243 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.1 m -45.53 -44.64 12.82 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -81.68 106.14 13.38 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 170.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -84.86 -24.74 28.42 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -138.38 156.13 47.88 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.345 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 69.9 t -136.74 144.56 32.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 104.81 -2.293 . . . . 0.0 104.81 176.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.02 149.95 46.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 119.047 0.84 . . . . 0.0 111.755 174.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -115.4 132.54 56.59 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.663 -1.977 . . . . 0.0 105.663 179.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -136.5 126.81 26.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.206 0.457 . . . . 0.0 112.135 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.15 115.13 27.03 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -150.58 125.26 9.68 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -87.35 111.4 21.04 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 4.6 mt -106.5 121.05 43.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -171.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -91.03 -36.03 14.29 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.578 0.704 . . . . 0.0 111.773 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -128.14 147.38 50.55 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.869 -0.52 . . . . 0.0 111.391 -177.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -65.29 -20.37 66.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -63.54 -33.33 75.35 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.05 -30.57 63.82 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 121.659 -0.651 . . . . 0.0 109.263 179.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 84.5 mtp -66.32 -51.85 53.19 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.8 m -60.94 -36.42 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.186 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -66.12 -36.82 84.16 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -62.04 -40.21 94.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.977 0.418 . . . . 0.0 110.022 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.5 mp -73.25 -34.2 43.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 121.42 -0.8 . . . . 0.0 111.058 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -58.74 -37.94 77.32 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -74.87 -43.43 54.5 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.603 0.716 . . . . 0.0 109.881 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 44.9 mt-30 -58.79 -39.38 80.91 Favored 'General case' 0 C--O 1.212 -0.872 0 O-C-N 121.765 -0.584 . . . . 0.0 111.409 178.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.83 -34.41 74.51 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 118.114 0.416 . . . . 0.0 110.505 -178.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -71.62 -42.58 67.48 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -60.15 -42.86 95.8 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.276 0.56 . . . . 0.0 109.508 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -67.46 -39.17 82.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 123.111 0.564 . . . . 0.0 110.336 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.55 -41.87 81.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.107 0.479 . . . . 0.0 110.736 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -65.12 -41.18 95.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.827 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.7 t -68.88 -39.69 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.4 ttp85 -60.09 -40.74 90.66 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.819 -0.55 . . . . 0.0 109.846 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -63.39 -41.11 98.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.906 -0.134 . . . . 0.0 110.845 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.55 -41.38 98.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.061 0.458 . . . . 0.0 110.899 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.82 -15.87 55.24 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.82 15.58 71.51 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-O 121.546 0.526 . . . . 0.0 112.227 -177.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -70.2 140.08 52.43 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 122.153 -0.616 . . . . 0.0 110.617 -175.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -64.45 -39.41 93.78 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.438 HH22 ' CD ' ' A' ' 105' ' ' GLU . 11.2 mtp180 -148.35 156.37 42.42 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 177.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.0 mmm -131.97 124.34 29.18 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.145 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -105.35 135.73 46.19 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 175.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -130.61 132.84 45.72 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.9 tp -94.74 123.51 38.24 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.6 t30 -120.06 114.47 22.03 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 122.159 0.184 . . . . 0.0 111.389 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.06 116.86 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.989 0.424 . . . . 0.0 111.671 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -80.92 152.81 27.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.514 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -128.09 115.87 19.11 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.508 -2.404 . . . . 0.0 104.508 171.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -136.88 151.87 49.58 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.474 0.484 . . . . 0.0 110.621 -173.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 87.7 m -67.22 -49.85 63.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 168.53 11.12 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -176.707 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.32 140.61 22.13 Favored Pre-proline 0 C--N 1.313 -0.991 0 N-CA-C 104.818 -2.29 . . . . 0.0 104.818 176.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.1 145.88 83.92 Favored 'Trans proline' 0 C--N 1.345 0.386 0 N-CA-C 114.706 1.002 . . . . 0.0 114.706 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.2 m -76.63 -4.24 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -175.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -120.86 100.46 7.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 119.461 -0.304 . . . . 0.0 111.513 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 22.53 50.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 32.7 p-90 -66.84 -22.84 65.98 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.488 -0.758 . . . . 0.0 112.276 -178.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -63.06 -31.25 72.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 121.914 -0.491 . . . . 0.0 110.742 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -63.78 -34.82 78.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.2 mm -63.99 -38.53 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 122.486 0.314 . . . . 0.0 110.283 -177.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.13 -25.78 68.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 111.181 -179.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -90.81 -2.33 57.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -96.0 102.34 14.12 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.957 -0.465 . . . . 0.0 111.749 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -68.4 118.76 11.88 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 103.039 -2.948 . . . . 0.0 103.039 169.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -82.93 110.77 18.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.438 ' CD ' HH22 ' A' ' 79' ' ' ARG . 5.1 mt-10 -107.81 121.12 44.08 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 122.094 0.949 . . . . 0.0 110.257 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -119.62 78.52 1.33 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.62 5.04 Favored Glycine 0 C--O 1.221 -0.694 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.448 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.7 p -76.81 -19.93 56.98 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 122.248 -0.56 . . . . 0.0 112.342 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.5 t -89.12 146.66 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.091 -0.38 . . . . 0.0 110.997 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 57.8 p -137.88 139.91 40.11 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 171.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.8 t -132.48 136.85 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.638 0 CA-C-O 122.021 0.915 . . . . 0.0 109.799 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -106.13 103.09 43.42 Favored Pre-proline 0 N--CA 1.428 -1.56 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.434 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -82.25 152.73 16.11 Favored 'Trans proline' 0 C--N 1.347 0.47 0 N-CA-C 114.129 0.78 . . . . 0.0 114.129 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.57 158.05 39.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 175.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.4 tt -149.66 128.48 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 118.369 0.531 . . . . 0.0 109.873 -178.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.3 t -100.08 116.97 44.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.82 139.96 38.82 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.54 -27.8 68.62 Favored Glycine 0 C--N 1.322 -0.2 0 CA-C-N 116.056 -0.52 . . . . 0.0 114.153 -177.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 27.0 p -54.01 -33.82 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -177.278 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.59 30.89 1.88 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.529 0.68 . . . . 0.0 110.107 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.9 tt -44.85 -36.96 3.54 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -175.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 18.3 ptp180 -55.61 -51.38 67.37 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.78 -38.56 38.2 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.976 0.893 . . . . 0.0 111.114 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.58 -38.09 86.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.975 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.24 -49.43 74.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 -178.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -72.72 -16.12 61.67 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.391 -177.301 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.05 -34.97 64.25 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 46.6 t -91.35 -42.19 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.245 0.545 . . . . 0.0 110.285 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.9 76.53 66.2 Favored Pre-proline 0 C--N 1.324 -0.512 0 C-N-CA 122.93 0.492 . . . . 0.0 111.734 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.67 -11.92 33.23 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 118.325 -0.65 . . . . 0.0 113.123 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -75.84 -12.82 60.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.905 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -90.85 131.19 36.64 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -79.04 105.18 10.2 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 5.9 t -58.12 -17.22 16.81 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -176.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -57.76 -35.17 70.39 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.906 0.882 . . . . 0.0 110.722 174.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -71.74 -5.61 35.24 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.415 0.626 . . . . 0.0 111.022 -179.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 12.8 t -130.23 34.83 4.16 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 177.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.8 t -56.94 151.34 14.91 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.116 -179.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -60.15 -26.77 66.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.958 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -62.16 -23.92 66.87 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.238 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 70.3 m80 -119.17 14.99 13.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.88 -177.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.41 67.92 5.28 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.283 0.563 . . . . 0.0 111.301 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 31.2 t -109.42 143.06 39.51 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -66.69 -28.93 68.84 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.992 0.425 . . . . 0.0 110.364 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -70.49 -35.36 73.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.663 0.744 . . . . 0.0 110.532 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 44.8 m-20 -59.34 -24.38 63.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.433 -178.3 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -37.26 69.3 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -64.97 -43.49 92.46 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 37.3 mtt -64.09 -36.59 84.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.369 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.27 -38.28 89.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.271 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -65.47 -43.04 91.52 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.007 0.432 . . . . 0.0 109.921 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -64.43 -41.98 96.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.472 0.653 . . . . 0.0 109.772 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -42.39 99.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.714 177.562 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -62.74 -43.02 99.88 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 122.82 0.448 . . . . 0.0 112.15 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.35 -37.31 86.79 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.585 -0.697 . . . . 0.0 109.948 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 21.5 m -67.64 -33.39 74.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.688 0.756 . . . . 0.0 110.673 176.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.81 -38.56 73.31 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.669 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.2 t -56.14 -42.48 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.93 -38.54 88.83 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.317 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 48.7 tttt -63.81 -37.5 87.62 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.733 -0.604 . . . . 0.0 110.405 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -31.95 61.8 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -176.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -57.5 -46.0 84.26 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 122.043 0.925 . . . . 0.0 110.81 177.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -76.94 -40.18 48.03 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.758 0.789 . . . . 0.0 110.359 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -61.41 -51.47 68.63 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -174.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -60.41 -37.32 80.48 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.371 0.987 . . . . 0.0 110.374 -177.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -61.75 -50.09 73.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.561 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 14.5 m -72.35 -43.66 63.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.632 -179.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.07 -42.44 99.68 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 123.847 0.859 . . . . 0.0 112.74 -176.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.3 -44.22 84.09 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.356 178.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 50.86 25.37 2.14 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.986 0.803 . . . . 0.0 110.014 -174.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 16.6 t 67.42 -59.2 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.402 1.881 . . . . 0.0 113.036 -176.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 55.4 -143.21 0.75 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 123.87 0.868 . . . . 0.0 109.009 176.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -142.78 166.55 24.34 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 177.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -58.5 139.17 56.07 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -175.15 -141.89 3.88 Favored Glycine 0 C--O 1.221 -0.683 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -177.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 68.8 tttt 57.87 85.7 0.09 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 66.6 tp -69.4 129.56 40.09 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 173.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -129.06 172.67 11.17 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 36.1 ptt85 -146.34 166.31 26.71 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -113.59 171.6 7.48 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 175.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -83.42 153.9 24.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.048 0.451 . . . . 0.0 110.763 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -84.04 167.16 17.11 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 175.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 7.0 p90 -74.63 135.85 41.97 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -99.24 4.31 46.6 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 . . . . . 0 C--O 1.246 0.891 0 CA-C-N 114.526 -1.216 . . . . 0.0 109.557 -177.726 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 ptt? . . . . . 0 N--CA 1.497 1.878 0 N-CA-C 110.213 -0.292 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 37.7 m-85 -54.57 -36.55 64.48 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 -169.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -42.43 99.3 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.988 0.899 . . . . 0.0 109.516 179.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -73.68 -36.51 65.31 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.946 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -39.18 84.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.059 0.39 . . . . 0.0 109.961 177.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -60.03 -53.14 61.27 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.9 m -63.05 -42.92 99.82 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.241 0.544 . . . . 0.0 111.114 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -56.91 -51.28 69.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.496 0.718 . . . . 0.0 112.14 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -71.31 -28.75 64.32 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.605 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -68.74 -36.48 78.45 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.664 -0.647 . . . . 0.0 109.511 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 22.2 mm -72.88 -36.01 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.62 85.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.02 -41.89 97.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.887 177.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -57.51 -49.87 74.91 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.549 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.24 -49.87 57.8 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.299 -178.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -39.45 82.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.722 -175.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -11.67 61.09 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.263 -0.898 . . . . 0.0 111.855 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.0 m -95.92 11.53 33.51 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 122.559 0.344 . . . . 0.0 110.32 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.25 -3.57 56.78 Favored Glycine 0 C--O 1.228 -0.26 0 N-CA-C 116.176 1.23 . . . . 0.0 116.176 175.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -66.79 126.14 28.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.065 0.932 . . . . 0.0 108.886 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.89 135.71 14.06 Favored Glycine 0 C--O 1.227 -0.318 0 N-CA-C 110.524 -1.031 . . . . 0.0 110.524 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.1 t -79.45 124.08 37.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 117.496 0.648 . . . . 0.0 109.258 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.6 mt -96.08 -45.5 13.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -148.56 141.96 25.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.41 105.37 4.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.941 0.337 . . . . 0.0 111.088 178.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.04 45.21 6.74 Favored Glycine 0 C--O 1.226 -0.4 0 C-N-CA 120.597 -0.811 . . . . 0.0 114.937 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.25 -37.85 88.96 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 104.04 -2.578 . . . . 0.0 104.04 174.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.1 t -151.36 -64.49 0.18 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 113.934 -1.485 . . . . 0.0 108.777 169.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -139.36 14.33 2.58 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -173.608 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.2 159.46 37.68 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 72.2 mt -132.59 125.89 53.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 105.46 -2.052 . . . . 0.0 105.46 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -99.14 129.63 45.41 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.86 138.27 54.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.914 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -81.59 129.78 34.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.23 118.07 68.68 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -74.37 -21.13 17.74 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 116.862 -1.625 . . . . 0.0 113.894 -175.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -77.44 -22.14 51.89 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 56.54 34.36 24.25 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 123.075 1.417 . . . . 0.0 111.092 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.5 p -74.48 -172.91 1.6 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.438 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.8 m -42.23 -28.24 0.18 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 112.675 0.621 . . . . 0.0 112.675 172.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -91.22 129.25 37.23 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 173.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -105.71 -41.46 5.44 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 31.4 mt -132.15 154.67 49.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.13 0.491 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -129.93 139.23 52.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -125.19 120.09 30.35 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.2 mt -96.02 120.54 36.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 104.035 -2.58 . . . . 0.0 104.035 175.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -135.09 127.93 31.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.937 0.789 . . . . 0.0 111.403 -175.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -103.18 105.78 16.16 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.018 0.913 . . . . 0.0 112.208 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -151.56 131.53 13.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.313 178.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -82.24 151.29 26.89 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 176.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -134.54 141.97 46.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.827 0.285 . . . . 0.0 110.432 -174.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -94.9 -45.64 7.2 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -128.4 154.62 45.82 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -178.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -64.3 -15.32 60.0 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.989 176.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -64.45 -34.93 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.26 178.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -75.81 -41.63 52.21 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -47.75 83.54 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.358 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.08 -34.73 72.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.993 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 83.5 mtt85 -71.14 -32.43 68.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -177.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.85 -42.62 89.75 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.8 mp -71.49 -37.16 63.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.975 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.07 -33.39 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 119.067 0.849 . . . . 0.0 109.688 -179.032 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -74.29 -44.94 50.65 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -36.21 73.86 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 121.833 -0.542 . . . . 0.0 111.308 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.28 -43.93 72.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.79 -42.68 93.9 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -63.78 -56.93 11.81 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.707 0.765 . . . . 0.0 113.044 178.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.9 p -64.14 -30.41 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.86 -173.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.17 -37.48 64.52 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -64.43 -42.82 95.81 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.837 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 17.7 t -68.28 -37.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.419 0.628 . . . . 0.0 109.734 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -42.73 98.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.703 -178.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.6 m80 -67.53 -35.96 80.1 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.648 178.61 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -30.49 71.42 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.78 -9.6 58.68 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 177.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.22 18.29 71.06 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -76.55 121.96 23.91 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 122.011 -0.7 . . . . 0.0 110.407 -175.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.3 mtp180 -66.53 -35.39 80.12 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -157.58 149.72 22.45 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 172.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -147.34 126.15 12.68 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.958 -173.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -88.24 117.39 27.12 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.502 1.047 . . . . 0.0 111.309 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.05 121.91 34.06 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.2 tp -87.39 100.27 12.61 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -100.28 113.27 25.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -178.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.2 t -114.4 111.19 34.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -79.73 144.66 33.44 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.39 116.76 25.39 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 172.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.7 p -136.12 152.16 50.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -172.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.9 m -67.18 -48.62 67.4 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -138.55 157.92 45.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 -176.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.59 152.64 63.96 Favored Pre-proline 0 C--N 1.312 -1.048 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.14 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -64.53 149.74 89.41 Favored 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 117.632 -1.112 . . . . 0.0 112.059 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.02 -6.9 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 119.021 2.971 . . . . 0.0 119.021 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -126.91 112.89 15.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.479 1.288 . . . . 0.0 114.479 -173.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 21.07 45.71 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 118.977 2.954 . . . . 0.0 118.977 175.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.1 p-90 -72.11 -15.52 61.99 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.133 -0.979 . . . . 0.0 110.796 -179.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.38 -31.3 72.45 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.539 -0.726 . . . . 0.0 111.202 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.89 -37.23 76.11 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 174.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.4 mm -67.45 -40.97 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.42 -32.82 73.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.264 0.554 . . . . 0.0 111.881 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -88.48 2.49 52.75 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.251 0.548 . . . . 0.0 110.289 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.8 ttpp -114.51 103.06 10.66 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 123.169 0.587 . . . . 0.0 111.849 -176.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 81.9 m -68.35 126.92 31.12 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 174.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -83.78 117.73 23.45 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -116.74 135.62 53.62 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.703 0.763 . . . . 0.0 111.072 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -144.41 85.82 1.8 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.66 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.69 5.21 Favored Glycine 0 C--O 1.225 -0.456 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.436 178.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.7 p -82.75 10.21 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.7 t -122.29 144.53 31.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -176.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.56 144.01 43.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 100.826 -3.768 . . . . 0.0 100.826 169.813 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.8 t -138.54 134.44 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.953 0 CA-C-N 119.449 1.022 . . . . 0.0 109.01 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -99.45 114.56 65.67 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -82.16 62.85 8.16 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 121.839 1.692 . . . . 0.0 113.76 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.01 147.2 48.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.7 tt -148.15 138.11 16.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 59.4 t -110.62 114.09 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.8 137.24 35.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -21.14 65.03 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.343 -0.456 . . . . 0.0 114.141 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.6 p -59.65 -31.56 69.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -177.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptm -140.43 34.2 1.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 tt -42.13 -42.86 3.1 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 117.187 2.292 . . . . 0.0 117.187 -172.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -61.04 -51.31 69.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 118.631 0.65 . . . . 0.0 112.255 -176.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -74.08 -35.54 64.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.528 0.68 . . . . 0.0 111.798 -179.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -67.84 -36.41 80.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.842 0.83 . . . . 0.0 111.512 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -68.51 -43.38 76.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 -179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -70.75 -14.73 62.55 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.133 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.68 -34.04 66.92 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 176.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -94.38 -36.77 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -126.07 77.65 71.12 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 122.232 -0.292 . . . . 0.0 110.924 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -69.45 -9.33 25.93 Favored 'Trans proline' 0 C--N 1.347 0.483 0 N-CA-C 113.704 0.617 . . . . 0.0 113.704 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.0 p -83.5 -9.72 58.79 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 122.73 0.412 . . . . 0.0 111.852 178.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -80.98 141.64 34.24 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.191 0.52 . . . . 0.0 111.434 -177.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -86.47 127.2 34.83 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.55 -21.16 66.58 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.455 0.645 . . . . 0.0 110.386 177.168 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -70.52 -21.1 62.77 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.947 179.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -92.5 7.32 43.68 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.771 0.795 . . . . 0.0 108.933 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.9 40.11 1.38 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 176.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.4 m -61.5 145.22 52.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.491 179.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -60.93 -35.35 76.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.557 0.694 . . . . 0.0 112.142 -177.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -59.1 -33.75 71.2 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.836 178.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -97.94 11.29 37.95 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.594 -175.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -77.58 10.29 2.75 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.6 t -60.44 151.01 29.31 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.568 0.699 . . . . 0.0 112.788 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -61.68 -28.72 69.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.341 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -64.4 -44.79 90.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.136 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -70.28 -24.5 63.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.955 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.4 -37.02 84.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.298 0.57 . . . . 0.0 109.483 175.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -73.88 -40.82 62.93 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.1 mtt -65.14 -30.79 71.74 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 120.693 0.282 . . . . 0.0 110.742 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.48 91.29 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -67.63 -44.75 77.23 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.34 -42.85 99.36 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.648 0.737 . . . . 0.0 109.869 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -58.86 -44.83 91.12 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.15 176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.81 -32.27 73.88 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.819 -0.55 . . . . 0.0 109.832 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.94 -35.16 59.82 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.155 0.979 . . . . 0.0 110.538 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.67 -37.55 87.98 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -176.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -60.03 -37.17 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 118.838 0.744 . . . . 0.0 110.946 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -72.87 -38.71 66.9 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.196 -0.94 . . . . 0.0 108.64 177.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -59.12 -29.74 67.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.176 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.9 -28.58 51.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.292 -0.255 . . . . 0.0 110.947 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -68.45 -39.33 81.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.596 0.712 . . . . 0.0 110.48 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -67.27 -39.68 86.09 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.513 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -70.89 -44.22 66.72 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -65.78 -22.44 66.57 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.5 pttt -69.51 -17.93 63.63 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.714 -0.616 . . . . 0.0 112.226 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 81.8 p -67.1 -14.06 62.54 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -175.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -55.55 -24.49 32.57 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -58.4 -22.37 53.79 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 177.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -108.8 104.47 13.74 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 176.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 33.1 m -61.95 142.52 16.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.867 0.841 . . . . 0.0 113.203 -176.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -150.11 170.12 19.67 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 179.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -144.89 138.91 27.28 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -158.33 161.1 37.61 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 149.02 -174.34 28.66 Favored Glycine 0 N--CA 1.454 -0.128 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 178.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 38.3 pttt -155.96 167.76 29.37 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 103.945 -2.613 . . . . 0.0 103.945 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -135.02 141.37 46.15 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 179.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -147.81 171.37 15.81 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 105.757 -1.942 . . . . 0.0 105.757 177.202 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -157.6 150.99 23.64 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.669 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -129.99 168.58 16.47 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -153.49 157.26 39.57 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 175.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 33.5 tp -140.55 152.8 45.82 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -155.18 164.43 38.84 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -129.12 -11.19 4.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.262 0.553 . . . . 0.0 110.127 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 . . . . . 0 C--O 1.244 0.769 0 N-CA-C 101.256 -3.609 . . . . 0.0 101.256 177.902 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.546 ' H2 ' ' CD ' ' A' ' 5' ' ' GLU . 66.7 ttp . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 119.416 -0.326 . . . . 0.0 111.09 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -68.69 147.35 51.97 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.48 -38.99 60.65 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 -174.43 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 71.4 mt -54.94 -35.23 64.01 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.546 ' CD ' ' H2 ' ' A' ' 1' ' ' MET . 47.7 mt-10 -56.81 -26.01 57.02 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -58.37 -49.4 77.37 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 m -71.82 -41.77 67.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.0 0.428 . . . . 0.0 110.934 178.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.435 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 64.1 t80 -56.05 -56.22 23.43 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -67.61 -29.73 69.13 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.853 -0.529 . . . . 0.0 110.766 -178.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.426 ' HZ1' ' CG ' ' A' ' 136' ' ' ASP . 62.6 mttt -69.12 -39.42 78.92 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.352 177.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 8.2 mm -62.24 -46.22 96.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -42.18 79.48 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.37 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -60.83 -46.33 90.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 mt -66.53 -51.44 56.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.936 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.9 t -56.04 -46.74 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.81 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.424 ' HA ' ' HG2' ' A' ' 161' ' ' GLN . 0.0 OUTLIER -63.37 -22.03 66.64 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.756 -0.59 . . . . 0.0 112.431 -178.313 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.3 m -87.19 1.08 54.21 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.02 -0.94 27.06 Favored Glycine 0 C--O 1.228 -0.277 0 N-CA-C 115.898 1.119 . . . . 0.0 115.898 176.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -68.0 122.66 18.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.377 1.088 . . . . 0.0 108.438 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.79 116.3 4.25 Favored Glycine 0 CA--C 1.507 -0.424 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -178.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -71.81 111.98 6.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.1 mt -75.6 -42.9 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -143.01 116.45 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.904 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -139.91 112.96 8.19 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.49 -50.85 0.06 OUTLIER Glycine 0 CA--C 1.506 -0.493 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -67.06 161.04 25.35 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 176.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.1 m -100.26 -7.03 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 176.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -88.99 -44.94 10.04 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 113.376 -1.738 . . . . 0.0 111.004 -175.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.42 ' CD ' HH21 ' A' ' 45' ' ' ARG . 11.2 pt-20 -139.56 148.52 42.69 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 86.0 mt -140.1 132.26 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -108.3 136.02 48.64 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.059 0.39 . . . . 0.0 109.968 176.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mp -131.16 129.98 42.45 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.346 0.658 . . . . 0.0 109.749 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -79.58 136.41 36.85 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.34 115.29 41.85 Favored Pre-proline 0 CA--C 1.546 0.795 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.48 -25.56 9.51 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 117.334 -1.311 . . . . 0.0 112.668 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.85 59.31 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.883 0.873 . . . . 0.0 111.482 -179.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt 57.34 45.49 20.0 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 t -60.13 -177.69 0.07 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 112.433 -2.167 . . . . 0.0 112.955 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 p -55.88 -29.02 59.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.239 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -109.36 136.96 47.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -80.18 -30.54 38.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.725 -175.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.0 mt -137.57 162.45 33.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.186 -176.412 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.3 t -129.59 135.39 61.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.42 HH21 ' CD ' ' A' ' 30' ' ' GLU . 59.1 ttt180 -125.01 134.59 52.52 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 175.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.2 129.56 54.23 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 104.427 -2.434 . . . . 0.0 104.427 177.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -136.43 132.56 35.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 117.891 0.314 . . . . 0.0 110.736 -177.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 tmtm? -106.76 110.8 23.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.832 -0.542 . . . . 0.0 109.673 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -151.52 144.91 24.8 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -106.77 101.22 10.67 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.65 135.57 35.53 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -92.29 -37.27 12.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 175.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -126.27 150.86 48.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.009 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -65.02 -15.54 62.44 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.854 -0.529 . . . . 0.0 110.998 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -63.38 -36.33 83.37 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -73.47 -40.52 64.07 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.8 ttm -57.39 -48.75 78.26 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.934 -0.306 . . . . 0.0 111.0 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.33 -31.84 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.832 0.742 . . . . 0.0 112.108 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.0 mtt180 -66.82 -41.21 87.86 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -179.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.28 -36.29 77.49 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.85 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.5 mm -64.38 -30.81 51.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 121.626 -0.671 . . . . 0.0 112.243 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -63.39 -36.87 85.15 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.808 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -72.38 -38.69 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -56.58 -49.89 73.54 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.66 -27.94 68.73 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.349 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.97 -46.06 83.09 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -66.48 -42.59 87.25 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.93 -40.83 88.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 119.034 -0.507 . . . . 0.0 112.116 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.31 -33.34 74.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.014 1.279 . . . . 0.0 109.999 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.3 ttm-85 -64.05 -42.12 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.6 t -68.66 -41.68 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -57.03 -41.37 78.48 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.795 0.438 . . . . 0.0 111.35 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.5 t-80 -62.23 -40.54 96.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.758 0.314 . . . . 0.0 110.883 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -73.27 -41.86 63.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.739 0.304 . . . . 0.0 111.791 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.69 -17.94 59.78 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.47 7.18 63.71 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.444 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -65.42 140.45 58.63 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 122.068 -0.666 . . . . 0.0 109.356 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.02 -32.45 73.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.613 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.401 HH21 ' CD ' ' A' ' 105' ' ' GLU . 19.7 ttt85 -150.73 154.04 36.64 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 177.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 29.7 mmm -124.38 150.36 45.66 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -127.33 142.43 51.45 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.554 0.534 . . . . 0.0 109.651 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -142.35 124.81 15.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.922 0.391 . . . . 0.0 111.198 -176.339 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.6 tp -90.87 108.08 19.61 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -102.09 111.52 23.82 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 10.8 t -100.98 106.87 20.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.061 0.458 . . . . 0.0 112.002 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -75.69 139.68 42.08 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -118.22 113.23 21.2 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 172.161 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.2 m -128.28 155.0 45.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.6 m -67.16 -48.39 68.15 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.818 0.818 . . . . 0.0 108.908 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.27 170.87 15.17 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 -177.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.93 151.16 43.11 Favored Pre-proline 0 C--N 1.314 -0.966 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -62.16 151.51 81.56 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 122.194 0.576 . . . . 0.0 112.307 176.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -63.62 -18.39 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 N-CA-C 121.176 3.769 . . . . 0.0 121.176 -167.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -150.21 137.93 19.96 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 116.241 1.941 . . . . 0.0 116.241 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 t0 37.87 24.1 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 119.179 3.029 . . . . 0.0 119.179 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 30.6 p-90 -67.59 -22.32 65.37 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 120.742 -1.224 . . . . 0.0 110.376 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.25 -31.26 71.06 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.4 . . . . 0.0 111.944 -178.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -59.77 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.8 mm -66.04 -39.58 84.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.911 -175.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.26 -14.7 60.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.35 0.595 . . . . 0.0 111.658 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -100.16 3.28 43.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.789 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -124.2 144.6 49.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.598 0.714 . . . . 0.0 110.979 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.7 m -79.89 147.16 31.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 104.468 -2.419 . . . . 0.0 104.468 172.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -107.61 123.67 48.81 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . 0.401 ' CD ' HH21 ' A' ' 79' ' ' ARG . 8.6 mt-10 -125.95 130.94 52.25 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.455 0.645 . . . . 0.0 109.645 179.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.05 75.52 1.3 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 178.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.36 -112.65 3.7 Favored Glycine 0 C--O 1.224 -0.528 0 C-N-CA 119.722 -1.228 . . . . 0.0 111.15 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.2 p -93.19 22.15 5.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.532 0.682 . . . . 0.0 110.975 -178.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 54.2 t -123.86 141.03 45.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.7 t -127.68 140.92 51.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 104.286 -2.487 . . . . 0.0 104.286 170.498 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.2 t -135.86 138.5 47.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -114.33 114.44 45.45 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.08 157.73 30.4 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 115.955 -2.23 . . . . 0.0 111.122 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.09 149.78 31.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 103.023 -2.954 . . . . 0.0 103.023 175.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -147.88 137.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 118.776 0.716 . . . . 0.0 109.602 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 83.1 t -114.18 117.27 55.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.2 140.42 36.5 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.52 -22.68 61.78 Favored Glycine 0 C--N 1.322 -0.222 0 C-N-CA 121.06 -0.591 . . . . 0.0 113.823 -176.288 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 37.2 p -61.05 -32.06 71.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 18.0 ptp -142.66 40.69 1.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.5 tt -43.29 -45.98 6.12 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.79 -1.55 . . . . 0.0 114.906 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -61.16 -37.29 82.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -43.73 61.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.354 0.597 . . . . 0.0 110.68 -176.119 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -64.49 -41.16 96.63 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.919 0.866 . . . . 0.0 109.45 179.202 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.49 -43.29 97.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.035 -176.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -73.7 -18.68 60.98 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.298 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.26 -34.85 61.42 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.2 t -90.03 -41.65 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 121.319 0.581 . . . . 0.0 110.283 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.29 79.48 70.17 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.154 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -66.78 -14.19 42.86 Favored 'Trans proline' 0 N--CA 1.474 0.376 0 N-CA-C 114.233 0.82 . . . . 0.0 114.233 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 7.2 m -83.16 2.62 34.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -68.54 132.02 46.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.51 0.672 . . . . 0.0 111.101 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -78.11 106.0 9.7 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 176.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 17.3 p -61.57 -23.8 66.22 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -22.45 66.89 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 176.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . 0.426 ' CG ' ' HZ1' ' A' ' 10' ' ' LYS . 14.4 t0 -82.28 7.33 14.13 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.757 0.789 . . . . 0.0 110.447 -177.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 52.3 t -129.98 115.07 16.62 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 77.0 p -140.6 158.62 43.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -178.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -67.87 -19.85 65.07 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.54 0.686 . . . . 0.0 110.449 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -58.18 -27.43 63.84 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.292 1.037 . . . . 0.0 110.479 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -117.31 15.94 14.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.815 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -82.71 52.26 2.07 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 11.6 p -132.23 163.0 29.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 122.019 0.914 . . . . 0.0 112.801 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -66.47 -28.73 68.82 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.794 -1.094 . . . . 0.0 110.201 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -71.15 -41.88 69.86 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 121.893 -0.505 . . . . 0.0 110.218 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -64.55 -33.97 77.16 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.8 71.85 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.941 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -69.06 -45.05 71.34 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 36.3 mmt -62.75 -28.92 70.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.131 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -61.98 -35.53 78.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.172 -0.33 . . . . 0.0 111.742 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -67.32 -44.48 79.05 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.14 0.495 . . . . 0.0 109.713 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -65.21 -38.58 90.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.732 0.777 . . . . 0.0 109.458 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -58.85 -46.68 87.17 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.377 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -66.98 -45.31 78.05 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.0 -40.5 93.79 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.595 -176.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 33.9 p -71.81 -34.74 69.61 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.203 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.28 -34.64 76.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.726 0.41 . . . . 0.0 111.712 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 71.2 t -56.94 -46.94 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 118.47 0.577 . . . . 0.0 110.675 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -73.83 -37.51 64.82 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -56.71 -25.34 54.1 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.811 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . 0.424 ' HG2' ' HA ' ' A' ' 17' ' ' ASN . 4.0 tm0? -54.92 -32.03 60.74 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -62.17 -36.41 81.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.859 0.361 . . . . 0.0 110.282 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -76.89 -45.43 28.19 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.243 0.617 . . . . 0.0 110.331 174.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -55.95 -41.46 74.71 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -65.51 -20.72 66.46 Favored 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 33.0 mttm -77.57 -41.15 39.88 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 176.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.39 -23.56 61.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.589 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -56.37 -35.32 67.58 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 123.307 0.643 . . . . 0.0 111.362 -179.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -60.3 -14.14 16.63 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.261 0.838 . . . . 0.0 113.261 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -120.99 10.31 10.77 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 22.0 m -85.04 141.89 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 119.495 1.043 . . . . 0.0 110.101 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -137.33 -26.35 1.0 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 179.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 64.62 -42.88 0.3 Allowed 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 116.631 2.086 . . . . 0.0 116.631 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 58.21 25.19 12.3 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 177.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -178.7 174.64 46.78 Favored Glycine 0 CA--C 1.507 -0.406 0 N-CA-C 108.697 -1.761 . . . . 0.0 108.697 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -159.77 165.6 32.11 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 64.2 tp -149.59 132.52 16.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 101.63 -3.471 . . . . 0.0 101.63 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -157.82 157.51 33.43 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -176.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 47.36 90.39 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 178.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -150.94 114.97 5.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.494 0.664 . . . . 0.0 110.12 168.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -165.46 162.69 19.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.968 -1.015 . . . . 0.0 108.426 -175.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 32.6 tp -152.8 147.11 25.65 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 175.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 22.3 p90 -142.1 164.47 30.07 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 -177.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -157.21 172.95 17.72 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 -177.588 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 . . . . . 0 C--O 1.244 0.807 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 179.049 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.4 mtp . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 118.824 -0.608 . . . . 0.0 109.899 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 62.48 163.85 0.1 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.948 0.899 . . . . 0.0 113.416 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.3 tt -72.41 -42.8 64.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.558 0.694 . . . . 0.0 111.063 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.03 -35.25 78.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -60.82 -29.73 69.66 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.5 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -61.2 -51.07 70.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -179.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 m -63.76 -42.0 97.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.489 0.661 . . . . 0.0 110.837 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -59.09 -51.75 68.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.97 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -72.37 -28.66 63.17 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.746 -0.596 . . . . 0.0 111.547 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -64.68 -44.42 90.39 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.1 mm -70.84 -37.67 69.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.23 81.64 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.52 -46.12 89.86 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 116.894 -0.139 . . . . 0.0 111.305 178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -54.73 -47.18 74.1 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.228 0.611 . . . . 0.0 112.037 -177.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.07 -45.82 55.14 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.409 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.6 t -56.97 -41.92 77.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 O-C-N 122.032 -0.417 . . . . 0.0 111.4 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.451 HD22 ' C ' ' A' ' 17' ' ' ASN . 0.2 OUTLIER -72.08 -4.78 30.89 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.141 -0.974 . . . . 0.0 112.734 -179.862 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.4 m -98.31 13.56 31.03 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.68 -3.92 53.4 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.394 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.423 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.0 m-85 -69.67 121.69 17.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.627 0.727 . . . . 0.0 109.694 -178.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.62 129.94 9.59 Favored Glycine 0 N--CA 1.449 -0.495 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.5 t -74.01 126.9 35.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.0 mt -96.2 -44.04 12.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -150.17 133.23 16.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.13 127.31 21.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 118.936 0.789 . . . . 0.0 112.404 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.37 28.37 52.85 Favored Glycine 0 C--O 1.221 -0.666 0 C-N-CA 120.476 -0.869 . . . . 0.0 114.28 173.018 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -58.74 -34.31 71.23 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.574 1.178 . . . . 0.0 108.729 178.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.4 m -159.54 -72.21 0.08 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 175.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.93 20.17 2.65 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.382 0.611 . . . . 0.0 111.541 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -129.89 159.08 37.7 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 115.1 1.519 . . . . 0.0 115.1 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.6 mt -139.25 131.19 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.86 0.864 . . . . 0.0 109.036 176.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -100.92 135.9 41.62 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 mp -129.46 138.1 51.22 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 122.975 0.51 . . . . 0.0 110.095 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.05 137.78 32.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.92 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -88.45 107.47 16.96 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 117.905 0.32 . . . . 0.0 111.513 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 81.9 Cg_endo -70.06 -17.01 36.48 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 120.58 0.854 . . . . 0.0 112.474 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -66.62 -25.26 66.52 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.884 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 60.7 42.96 12.94 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 -174.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.2 t -66.47 -177.52 0.57 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 112.577 -2.102 . . . . 0.0 112.943 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.9 p -55.07 -33.98 63.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 178.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.467 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 7.8 p80 -107.29 143.24 35.83 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -89.73 -29.72 18.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.721 -173.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.69 164.43 28.85 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.479 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.1 t -130.54 138.07 54.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -123.85 113.65 18.81 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tp -94.57 128.56 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -136.46 118.4 15.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.426 0.557 . . . . 0.0 111.607 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -86.47 94.68 9.47 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.383 -0.823 . . . . 0.0 109.084 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -147.25 135.81 21.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.164 0.506 . . . . 0.0 111.314 -176.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -89.99 151.54 21.63 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 124.951 1.3 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.7 mt -138.32 140.06 39.36 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -176.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -92.86 -44.71 8.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -129.64 160.57 32.92 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.712 -0.618 . . . . 0.0 109.634 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -64.65 -22.42 66.97 Favored 'General case' 0 C--O 1.219 -0.513 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -66.28 -33.36 75.57 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.252 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -69.16 -35.06 75.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 177.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.27 -50.53 67.55 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.327 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.3 m -63.72 -32.79 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 O-C-N 121.452 -0.78 . . . . 0.0 110.297 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.55 -36.92 83.85 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.663 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.78 -46.71 86.72 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.2 mp -69.22 -33.94 60.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.418 -0.801 . . . . 0.0 110.744 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -57.91 -40.81 81.27 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -69.29 -44.74 71.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.477 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.53 -42.92 97.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.1 -31.28 66.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -41.49 98.15 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.214 1.007 . . . . 0.0 109.474 177.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -73.6 -33.93 64.82 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -65.32 -43.34 95.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.92 -33.68 75.16 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.395 0.998 . . . . 0.0 110.556 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.18 -45.36 93.75 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.095 -0.378 . . . . 0.0 110.184 175.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.51 -40.43 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -37.56 69.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.126 -0.359 . . . . 0.0 110.739 178.019 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -63.08 -40.52 97.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.519 0.2 . . . . 0.0 110.787 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -65.91 -39.62 90.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.192 0.52 . . . . 0.0 110.307 179.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -77.28 -9.66 58.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.868 -0.606 . . . . 0.0 112.6 -179.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.69 14.67 60.86 Favored Glycine 0 CA--C 1.52 0.396 0 CA-C-O 121.43 0.461 . . . . 0.0 113.837 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.5 mtp85 -73.51 148.65 42.9 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.955 -0.733 . . . . 0.0 112.665 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.48 -33.75 71.61 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.539 176.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -154.4 151.67 29.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.5 mmm -118.43 141.84 48.15 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.467 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 43.4 tttp -120.82 130.75 54.1 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -132.68 125.92 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.901 0.382 . . . . 0.0 111.857 -171.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.3 tp -88.23 123.32 32.73 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 175.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -116.41 127.97 55.09 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.18 116.36 47.57 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 120.991 0.424 . . . . 0.0 110.734 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -83.56 145.4 28.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -121.45 112.0 17.99 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 173.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.5 m -130.28 154.03 48.03 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -170.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.2 m -67.21 -48.28 68.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -141.41 159.59 41.9 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 -177.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.86 157.84 45.59 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.616 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -61.45 146.86 96.7 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 117.715 -1.056 . . . . 0.0 111.168 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.0 m -70.66 -11.71 15.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 118.983 2.957 . . . . 0.0 118.983 -168.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.42 137.41 21.74 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t0 47.17 14.48 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 119.242 3.053 . . . . 0.0 119.242 171.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -69.02 -21.38 64.13 Favored 'General case' 0 C--N 1.318 -0.771 0 O-C-N 121.026 -1.046 . . . . 0.0 113.605 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -59.3 -31.15 68.88 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.019 -0.425 . . . . 0.0 111.473 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.34 -31.07 72.13 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.196 0.522 . . . . 0.0 109.821 177.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.7 mm -71.1 -40.73 75.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.028 0.442 . . . . 0.0 110.159 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.97 5.38 8.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.461 0.648 . . . . 0.0 110.569 178.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.34 -2.69 15.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.815 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -125.24 137.9 54.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.776 0.798 . . . . 0.0 112.512 -175.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 28.2 m -83.28 122.79 28.9 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.395 -2.446 . . . . 0.0 104.395 175.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -82.79 118.42 23.38 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -119.78 126.2 50.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.943 0.877 . . . . 0.0 111.287 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -127.46 75.45 1.59 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.228 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.76 -112.74 5.26 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 119.951 -1.119 . . . . 0.0 111.277 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 46.8 p -77.98 17.7 0.56 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 83.0 t -130.47 140.53 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 123.01 0.524 . . . . 0.0 110.663 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.8 m -131.51 132.54 44.28 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 169.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.3 t -132.01 133.43 60.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -114.13 109.04 49.73 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.18 159.57 20.37 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 117.247 -1.369 . . . . 0.0 113.644 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.93 159.17 44.73 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 102.973 -2.973 . . . . 0.0 102.973 176.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.0 tt -149.23 139.76 16.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.72 108.72 26.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.61 136.29 33.35 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.11 -23.43 67.88 Favored Glycine 0 C--O 1.225 -0.45 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.404 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 26.7 p -59.0 -28.62 66.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -143.43 35.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.244 1.021 . . . . 0.0 108.355 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.8 tt -46.03 -40.55 10.78 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 -173.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.6 -37.93 85.74 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 119.227 -0.989 . . . . 0.0 112.606 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -42.45 29.27 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.958 0.885 . . . . 0.0 110.573 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -39.42 92.09 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.404 -174.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -68.27 -44.01 76.51 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 122.082 -0.386 . . . . 0.0 110.35 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -73.62 -14.32 61.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.928 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.12 -31.58 62.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 177.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.61 -37.86 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 120.695 0.283 . . . . 0.0 110.964 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -130.16 77.07 77.02 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 122.101 -0.374 . . . . 0.0 111.5 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.64 -13.8 37.99 Favored 'Trans proline' 0 C--N 1.348 0.548 0 N-CA-C 113.819 0.661 . . . . 0.0 113.819 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.9 m -73.26 -10.51 59.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 178.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -102.53 125.64 49.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -71.58 110.41 6.14 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 13.3 t -63.15 -10.54 15.43 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -62.59 -32.43 73.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.36 0.6 . . . . 0.0 109.767 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -71.29 -7.62 48.23 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.859 0.838 . . . . 0.0 110.232 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 10.9 t -129.71 33.43 4.45 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.078 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.0 m -61.38 146.79 47.07 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -53.99 -41.75 68.27 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -175.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.53 -38.38 87.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.685 0.755 . . . . 0.0 111.274 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -85.07 -17.69 36.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.783 -177.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.92 40.07 0.45 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 67.5 m -63.09 149.93 43.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.184 0.516 . . . . 0.0 109.925 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -59.52 -30.81 68.85 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.012 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -72.53 -35.09 67.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.79 0.328 . . . . 0.0 111.213 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -69.04 -26.79 65.15 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -179.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.33 -36.5 78.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.07 0.462 . . . . 0.0 110.209 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -72.66 -40.92 65.94 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 54.2 mtt -62.09 -37.81 86.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.946 0.403 . . . . 0.0 109.988 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.85 97.47 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 122.178 -0.326 . . . . 0.0 110.247 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -64.58 -44.7 89.84 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.958 0.408 . . . . 0.0 110.121 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -63.38 -43.29 98.02 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.545 0.688 . . . . 0.0 109.953 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 37.6 ttt85 -64.02 -34.68 78.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.786 178.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -63.84 -39.56 94.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.215 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.96 -37.68 88.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.951 0.405 . . . . 0.0 109.995 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 14.5 m -69.74 -35.02 74.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.55 0.69 . . . . 0.0 110.904 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -42.93 74.3 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -62.57 -32.99 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 120.494 -0.483 . . . . 0.0 109.882 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.59 -46.02 91.62 Favored 'General case' 0 C--O 1.211 -0.968 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -64.84 -31.32 72.5 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.235 -0.915 . . . . 0.0 111.194 178.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -60.75 -28.47 68.73 Favored 'General case' 0 C--O 1.212 -0.89 0 O-C-N 121.538 -0.726 . . . . 0.0 111.351 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.42 -33.3 74.51 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.606 1.094 . . . . 0.0 110.665 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -65.29 -44.42 88.03 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 93.0 mm-40 -70.9 -31.73 68.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.585 -178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -69.61 -22.46 63.49 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 121.628 -0.67 . . . . 0.0 111.386 178.121 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -68.16 -37.36 80.92 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 176.39 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -32.23 66.12 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.329 175.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -61.68 -24.34 66.69 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.986 0.514 . . . . 0.0 111.248 178.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.12 56.6 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -67.18 151.81 46.89 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 22.1 t -77.06 94.54 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.052 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.1 168.24 20.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.163 -177.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -135.33 135.53 40.83 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -104.55 4.19 32.67 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.592 0.711 . . . . 0.0 110.243 -178.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 104.48 164.49 24.47 Favored Glycine 0 C--O 1.217 -0.961 0 N-CA-C 107.845 -2.102 . . . . 0.0 107.845 -176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.15 165.12 37.33 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.142 0.971 . . . . 0.0 109.428 -177.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 80.9 mt -111.02 164.3 12.95 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 121.206 0.527 . . . . 0.0 111.807 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -75.08 149.15 39.22 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.31 81.54 7.25 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 -177.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -76.04 154.55 35.61 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.971 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -149.32 143.77 26.02 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 40.1 tp -144.08 149.95 37.4 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 174.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -156.49 164.4 38.28 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -175.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -140.15 146.4 38.76 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 104.14 -2.541 . . . . 0.0 104.14 177.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 . . . . . 0 C--O 1.251 1.139 0 CA-C-O 115.962 -1.97 . . . . 0.0 105.863 -177.803 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.9 mtm . . . . . 0 N--CA 1.488 1.451 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 72.29 106.45 0.07 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.605 1.562 . . . . 0.0 112.897 -178.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp -61.74 -32.25 72.48 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.98 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.1 -36.79 82.8 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.193 -0.317 . . . . 0.0 111.138 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -32.36 73.93 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.412 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -62.95 -52.54 62.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.2 m -59.96 -42.09 93.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.766 0.317 . . . . 0.0 110.73 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -56.29 -55.37 34.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 123.063 0.545 . . . . 0.0 112.15 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -71.07 -28.98 64.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 121.725 -0.61 . . . . 0.0 111.94 -178.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -70.51 -35.58 73.28 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.834 -0.541 . . . . 0.0 110.153 176.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 4.0 mm -69.38 -42.05 81.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.27 81.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.31 92.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.522 178.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -59.47 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.728 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.7 mt -63.87 -50.01 70.5 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.464 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.95 -42.34 89.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.757 0.313 . . . . 0.0 110.569 -177.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -4.35 38.12 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.8 m -103.12 7.82 38.73 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.722 0.409 . . . . 0.0 110.655 176.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.98 0.33 35.95 Favored Glycine 0 C--O 1.228 -0.246 0 N-CA-C 116.527 1.371 . . . . 0.0 116.527 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.422 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.9 m-85 -72.89 117.96 15.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 118.312 1.056 . . . . 0.0 109.519 177.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.79 134.89 17.01 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -178.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.8 t -78.12 126.1 38.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 117.733 0.767 . . . . 0.0 109.481 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 51.9 mt -98.64 -47.98 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -149.64 138.68 21.18 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.12 121.98 15.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 118.847 0.749 . . . . 0.0 112.65 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.9 39.73 53.91 Favored Glycine 0 C--O 1.223 -0.568 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.61 175.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -58.51 -44.72 89.58 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.9 t -154.5 -68.06 0.13 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 175.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -139.36 19.39 2.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.837 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.63 154.94 47.36 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.126 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.2 mt -139.4 132.23 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 41.5 m95 -108.58 127.5 54.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.422 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.9 mm? -124.01 140.93 52.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.557 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -84.62 126.61 33.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 176.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.73 123.84 88.51 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.4 -29.22 14.0 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 115.56 -2.493 . . . . 0.0 113.12 -178.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -71.3 -31.97 68.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.186 0.517 . . . . 0.0 112.11 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 58.07 38.31 26.57 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.829 1.775 . . . . 0.0 108.68 -176.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.6 t -60.78 -172.63 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.725 171.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.0 m -41.52 -26.13 0.06 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -114.92 139.92 49.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 165.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -86.34 -31.58 21.47 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.843 -0.536 . . . . 0.0 109.786 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 68.9 mt -140.43 164.62 29.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 -177.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.2 p -135.29 137.36 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -111.83 125.17 53.73 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.13 124.66 39.29 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 104.009 -2.589 . . . . 0.0 104.009 174.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -136.44 125.55 24.51 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -175.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -107.34 99.16 8.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.878 0.847 . . . . 0.0 112.454 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.92 150.1 34.54 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.618 -179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.88 144.44 33.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.72 133.85 55.32 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -85.0 -39.88 17.53 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 122.37 1.081 . . . . 0.0 108.93 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -132.05 157.34 44.41 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -64.35 -19.55 65.54 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -178.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -62.34 -33.24 74.33 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -69.5 -33.04 72.27 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 4.8 ttm -72.65 -48.45 39.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.798 177.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 23.6 m -58.05 -36.75 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.16 -29.8 65.66 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.668 -178.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -64.52 -39.18 93.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mt -74.12 -38.32 48.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 122.004 -0.435 . . . . 0.0 111.857 179.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -66.59 -29.66 69.77 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.53 -37.76 56.17 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -56.71 -34.29 67.32 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.535 178.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.01 67.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.04 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -69.3 -46.17 67.8 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.908 0.776 . . . . 0.0 109.097 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 -56.74 -43.78 81.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.4 -34.2 57.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.076 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.84 -42.0 95.28 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.685 1.13 . . . . 0.0 109.636 176.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.43 -46.37 90.39 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.36 -38.95 82.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 178.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.57 -44.2 89.66 Favored 'General case' 0 CA--C 1.511 -0.54 0 O-C-N 121.842 -0.536 . . . . 0.0 110.22 179.443 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -66.06 -45.18 82.29 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -61.3 -41.43 96.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -90.0 -5.78 56.31 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.04 9.0 45.62 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 116.413 1.325 . . . . 0.0 116.413 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -67.22 146.62 54.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.912 -0.758 . . . . 0.0 110.477 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -62.41 -35.59 79.71 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.068 0.461 . . . . 0.0 110.338 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -149.49 148.37 29.33 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 175.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -113.75 139.04 49.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -116.06 132.06 56.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -134.56 125.57 27.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.514 0.597 . . . . 0.0 111.022 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.8 tp -89.13 124.44 34.33 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 174.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -113.89 108.64 17.33 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.53 111.55 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.807 0.337 . . . . 0.0 110.52 -176.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -82.78 133.06 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 176.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -111.27 109.47 19.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.0 m -127.31 155.59 43.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.057 0.456 . . . . 0.0 112.108 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.6 m -71.2 -46.92 60.2 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 175.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -138.85 158.76 43.63 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -175.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 146.13 39.61 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.862 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.68 150.3 88.41 Favored 'Trans proline' 0 C--N 1.345 0.363 0 O-C-N 121.895 0.418 . . . . 0.0 113.177 178.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -79.46 -7.49 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 116.728 2.121 . . . . 0.0 116.728 -173.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -108.49 97.0 6.73 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 14.96 55.62 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -73.12 -12.83 61.04 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.71 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.62 -31.16 70.36 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.828 -0.545 . . . . 0.0 111.735 -177.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.77 -33.2 74.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.219 0.533 . . . . 0.0 110.249 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.0 mm -67.25 -37.11 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -176.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.21 73.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.383 0.611 . . . . 0.0 110.824 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.76 -9.31 54.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.367 0.603 . . . . 0.0 111.078 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -88.14 95.74 10.27 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.157 -178.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 86.3 m -68.51 124.24 23.02 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 173.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -87.41 108.28 18.93 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -106.18 128.41 53.91 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.516 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -132.15 75.54 1.64 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.524 -1.288 . . . . 0.0 107.524 177.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.68 5.21 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.116 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.1 p -79.32 20.72 0.51 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.2 t -127.68 141.12 47.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.5 t -139.21 112.89 8.42 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.225 -1.769 . . . . 0.0 106.225 173.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.6 t -109.73 129.4 64.67 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 122.561 1.172 . . . . 0.0 110.311 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -102.07 99.73 13.2 Favored Pre-proline 0 N--CA 1.425 -1.699 0 CA-C-N 111.801 -2.454 . . . . 0.0 107.919 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.94 151.87 21.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 115.292 -2.672 . . . . 0.0 113.032 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.54 150.84 31.76 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 175.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -144.15 134.29 20.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.8 m -115.36 127.59 72.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 103.679 -2.711 . . . . 0.0 103.679 175.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.68 136.34 54.87 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -176.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -46.91 -39.03 10.82 Favored Glycine 0 N--CA 1.461 0.304 0 N-CA-C 117.268 1.667 . . . . 0.0 117.268 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -37.34 63.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.4 ptm -136.53 34.38 2.72 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.961 1.362 . . . . 0.0 108.673 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.3 tp -51.0 -38.52 51.76 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 116.966 2.21 . . . . 0.0 116.966 -172.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -64.97 -41.15 95.71 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.656 0.662 . . . . 0.0 111.255 -177.366 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.92 -37.57 70.02 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -65.91 -40.89 91.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.596 0.712 . . . . 0.0 110.811 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.36 -49.03 78.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.161 -177.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -71.76 -15.11 62.17 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.432 -177.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.99 -35.66 57.0 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.249 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.0 p -94.81 -37.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 120.853 0.359 . . . . 0.0 111.583 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -130.1 75.51 79.27 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 122.036 -0.415 . . . . 0.0 110.662 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.43 -13.83 40.51 Favored 'Trans proline' 0 C--N 1.349 0.598 0 CA-C-O 121.392 0.497 . . . . 0.0 112.813 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 11.9 p -75.62 -8.3 56.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.074 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -78.3 124.83 28.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.301 0.572 . . . . 0.0 110.704 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -76.13 100.03 4.86 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.004 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 5.2 p -62.55 -19.35 63.57 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -63.93 -25.5 68.17 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.857 0.361 . . . . 0.0 111.431 176.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -70.92 -27.25 63.65 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 7.5 t -100.56 46.06 0.96 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.365 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.73 151.89 32.68 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 178.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.6 mp0 -55.69 -40.32 72.19 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -173.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -65.48 -36.98 85.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.604 0.716 . . . . 0.0 110.928 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -79.38 -23.54 43.25 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.098 -178.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.76 12.38 2.67 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 68.2 m -54.54 141.18 32.28 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 177.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -49.27 -45.86 45.49 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 -172.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -72.28 -26.47 61.99 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -55.79 -24.46 36.03 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 120.992 0.425 . . . . 0.0 110.198 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.7 64.72 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.47 -45.91 85.32 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 75.4 mtm -69.6 -28.93 66.36 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.017 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.97 -31.22 69.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 122.159 -0.338 . . . . 0.0 111.575 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -65.81 -43.72 87.78 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -69.62 -36.63 76.32 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.434 0.635 . . . . 0.0 109.363 -179.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.28 92.55 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.657 177.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -66.78 -40.61 88.24 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.787 0.435 . . . . 0.0 111.86 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.7 mt -64.99 -37.78 88.8 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 121.68 -0.638 . . . . 0.0 110.039 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 38.7 m -69.06 -31.72 70.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.612 0.72 . . . . 0.0 110.282 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.88 -45.49 64.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.943 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.09 -33.06 60.99 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -66.54 -39.21 88.47 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.428 -0.795 . . . . 0.0 109.37 176.15 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -60.76 -34.43 74.44 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 175.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -60.02 -28.54 67.82 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -68.48 -36.31 78.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.156 0.503 . . . . 0.0 111.051 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -76.73 -34.42 58.1 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 176.321 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 8.9 tm0? -63.42 -51.6 65.04 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.202 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -66.01 -22.87 66.47 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.399 0.619 . . . . 0.0 111.14 -178.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 47.6 tttt -75.27 -47.95 25.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.611 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 21.6 p -72.4 -17.43 61.81 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -57.79 -24.31 56.62 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.81 0.844 . . . . 0.0 111.789 177.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.36 -18.63 11.52 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 176.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -74.03 105.94 5.49 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 174.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 10.2 t -58.62 104.63 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -175.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.66 172.7 15.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.522 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -128.92 116.25 19.09 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.412 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -143.04 168.56 19.43 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 105.151 -2.166 . . . . 0.0 105.151 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 72.55 -136.85 23.82 Favored Glycine 0 C--O 1.227 -0.298 0 N-CA-C 108.168 -1.973 . . . . 0.0 108.168 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt 51.88 51.76 15.87 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.562 0.696 . . . . 0.0 112.134 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.5 155.36 40.07 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.2 151.69 45.5 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -160.82 169.05 23.49 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.197 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 54.59 -153.53 0.3 Allowed 'General case' 0 N--CA 1.47 0.535 0 O-C-N 124.724 1.265 . . . . 0.0 111.092 174.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 62.06 -168.9 0.18 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.318 0.647 . . . . 0.0 110.724 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . 0.503 ' HG ' ' H ' ' A' ' 183' ' ' TYR . 7.5 tp 62.12 -174.42 0.14 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.967 0.907 . . . . 0.0 112.546 179.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . 0.503 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 51.8 p90 -163.35 165.56 23.93 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 103.806 -2.665 . . . . 0.0 103.806 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -133.39 149.78 51.82 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.032 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 -178.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttp . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 120.997 0.427 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -134.29 154.26 51.4 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 110.302 -0.259 . . . . 0.0 110.302 -176.545 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 pp -59.66 -32.31 70.34 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.024 0.44 . . . . 0.0 111.231 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.32 -36.54 82.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.897 0.379 . . . . 0.0 111.385 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -68.58 -29.58 68.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.332 -0.23 . . . . 0.0 110.679 -179.348 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.97 -50.0 73.84 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.157 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -64.79 -41.48 95.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.529 179.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -54.5 -52.34 62.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.986 0.422 . . . . 0.0 110.936 179.548 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -73.3 -29.27 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.005 -0.434 . . . . 0.0 111.977 -179.852 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -68.7 -36.09 78.01 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.546 -0.721 . . . . 0.0 111.304 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.6 mm -70.25 -39.08 76.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.843 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.27 -44.56 84.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.72 -42.32 95.33 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.968 178.347 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -62.2 -43.06 99.69 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.655 0.264 . . . . 0.0 111.371 -179.097 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 mt -69.84 -46.26 66.0 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.173 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 40.9 t -54.56 -42.55 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.956 -0.465 . . . . 0.0 110.857 173.171 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -61.35 -33.82 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 110.839 178.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -79.65 9.49 5.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 122.922 0.489 . . . . 0.0 112.271 177.886 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.19 -0.21 61.93 Favored Glycine 0 CA--C 1.517 0.212 0 N-CA-C 116.415 1.326 . . . . 0.0 116.415 175.507 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 16.8 m-85 -68.27 132.23 46.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.93 0.865 . . . . 0.0 110.075 179.891 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.33 133.4 11.77 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.217 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.9 t -75.38 121.45 27.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.3 mt -85.67 -46.07 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 177.102 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -160.52 132.3 5.94 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.39 141.99 35.53 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 174.731 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.58 -80.9 0.05 OUTLIER Glycine 0 CA--C 1.508 -0.391 0 C-N-CA 120.112 -1.042 . . . . 0.0 111.39 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -69.45 158.13 35.75 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.45 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.9 m -76.56 0.74 18.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.18 178.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.27 -46.19 14.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -177.41 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -147.68 143.89 27.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -136.69 133.08 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 177.039 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 57.5 m95 -112.25 133.12 54.55 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.142 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.59 131.59 48.16 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 123.426 0.69 . . . . 0.0 109.69 -178.716 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -80.92 132.91 35.46 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.686 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.74 109.59 12.53 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.338 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.72 -19.0 19.01 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 117.182 -1.412 . . . . 0.0 112.239 -178.044 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -68.83 -27.88 66.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.908 178.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 77.7 mttt 58.74 41.96 20.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 123.175 1.465 . . . . 0.0 107.106 -178.535 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -177.08 0.24 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 111.188 -2.733 . . . . 0.0 113.409 -179.47 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.7 p -51.9 -28.22 15.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.704 175.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.446 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 46.8 p-80 -107.36 143.82 35.11 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 173.916 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -85.94 -36.9 19.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.566 -172.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -141.66 163.26 33.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.13 -177.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.0 t -122.84 134.57 65.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 175.014 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.25 127.7 38.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.759 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.9 mt -97.51 129.81 44.64 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -136.56 150.37 48.58 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.718 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -115.08 131.5 56.91 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 173.575 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.69 140.43 20.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.588 0.233 . . . . 0.0 111.265 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -93.01 125.51 37.64 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 175.085 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -128.49 101.48 6.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.137 -0.352 . . . . 0.0 111.11 -174.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.0 -42.15 58.03 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.925 0.869 . . . . 0.0 111.251 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -129.19 156.89 43.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.316 -179.324 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.7 ptt180 -65.82 -20.58 66.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 122.05 -0.406 . . . . 0.0 111.249 -178.355 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -62.34 -33.31 74.45 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.59 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -72.47 -34.65 67.88 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 121.537 -0.727 . . . . 0.0 109.186 178.264 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -65.25 -47.43 76.8 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.005 178.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.2 m -64.78 -31.76 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.538 -0.726 . . . . 0.0 111.207 179.442 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -68.13 -36.17 79.29 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.619 179.417 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.39 -44.81 92.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.4 -30.74 51.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -176.924 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.15 -40.5 96.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -70.59 -41.07 72.83 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 83.2 mm-40 -57.08 -48.22 79.12 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.009 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.36 94.25 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.603 -177.891 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.55 -38.85 88.01 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 121.545 0.688 . . . . 0.0 110.281 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -61.19 -42.78 99.18 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.345 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 81.9 t -69.06 -38.71 78.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 119.131 -0.461 . . . . 0.0 112.111 -179.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -56.55 -41.16 76.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.038 0.835 . . . . 0.0 110.201 179.812 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.3 mtm-85 -63.55 -33.46 75.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.496 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.8 t -76.72 -44.38 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.902 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.4 mmt-85 -61.05 -34.82 75.48 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -58.04 -39.64 78.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.144 0.497 . . . . 0.0 109.884 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -73.41 -38.65 65.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.918 0.389 . . . . 0.0 111.087 179.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.28 -18.02 60.78 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -177.261 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.38 -3.08 1.95 Allowed Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.776 1.471 . . . . 0.0 116.776 179.311 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.27 143.39 43.05 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -62.18 -36.58 82.31 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -149.14 157.86 43.71 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.231 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.38 157.76 27.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.446 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 17.5 mmtt -143.41 132.01 22.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 174.509 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tt -142.47 127.41 18.35 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -175.198 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.4 tp -83.12 104.08 13.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 175.309 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -102.62 108.55 19.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.7 t -100.38 112.32 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.314 -176.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -91.41 106.78 18.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.417 0.627 . . . . 0.0 112.045 -179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -79.19 126.89 31.35 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.482 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 92.2 p -141.42 164.04 31.3 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 122.696 0.398 . . . . 0.0 110.669 -174.342 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 74.3 m -69.7 -49.07 56.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 176.231 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -153.54 177.85 10.48 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 -175.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -96.01 151.19 38.12 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.638 -174.873 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.58 149.74 80.42 Favored 'Trans proline' 0 C--N 1.351 0.661 0 O-C-N 122.475 0.724 . . . . 0.0 113.079 174.831 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.0 m -80.26 -10.71 12.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -175.45 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -117.57 74.87 0.95 Allowed 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -172.836 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 53.38 49.16 20.3 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 174.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 49.5 p-90 -68.16 -19.71 64.82 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 121.522 -0.736 . . . . 0.0 109.875 175.517 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -63.06 -34.56 77.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.725 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.59 -35.2 70.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 176.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.3 mm -71.12 -44.57 74.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.132 0.491 . . . . 0.0 111.095 -176.341 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . 0.434 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -67.96 -27.89 66.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.645 0.736 . . . . 0.0 111.79 -177.414 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -93.89 6.22 49.14 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.236 -177.049 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -119.89 144.41 47.42 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.407 0.622 . . . . 0.0 111.436 176.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.7 m -88.2 127.77 35.45 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.415 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -85.0 129.77 34.74 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 175.582 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -132.32 128.96 38.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.543 0.687 . . . . 0.0 110.091 178.475 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -149.54 114.78 5.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.251 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 58.01 -127.29 44.71 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.477 -0.868 . . . . 0.0 114.195 177.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.8 p -82.46 13.11 3.85 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 122.746 0.419 . . . . 0.0 111.155 -178.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 2.3 t -123.57 149.9 27.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -176.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.9 t -138.43 139.75 39.02 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 100.259 -3.978 . . . . 0.0 100.259 171.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.6 t -136.31 136.57 48.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 118.42 0.554 . . . . 0.0 109.806 -177.189 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -105.62 113.77 63.73 Favored Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 171.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . 0.434 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 69.6 Cg_endo -76.36 158.28 36.88 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 116.158 -2.094 . . . . 0.0 111.638 176.873 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 152.78 37.66 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.2 tt -145.13 138.01 21.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -177.811 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 96.5 t -118.16 119.97 63.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.016 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -85.91 156.55 20.46 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 179.687 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.69 -27.67 53.44 Favored Glycine 0 C--N 1.318 -0.456 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 168.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 p -67.66 -42.82 81.56 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -177.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptp -128.28 37.98 4.06 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.559 1.171 . . . . 0.0 109.281 -179.272 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -45.55 -43.27 11.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.59 -1.641 . . . . 0.0 115.07 -177.233 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.3 mtm180 -69.5 -31.49 69.78 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.495 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -72.31 -41.54 66.44 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.443 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -64.5 -41.5 96.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.495 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.38 -42.14 98.24 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.568 -0.73 . . . . 0.0 112.371 -179.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -76.38 -14.34 60.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 119.813 1.188 . . . . 0.0 112.105 -179.07 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -85.09 -40.01 17.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.27 0.557 . . . . 0.0 110.246 178.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 42.6 t -91.57 -40.87 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.417 0.627 . . . . 0.0 110.816 -177.523 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -128.44 70.57 79.73 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.876 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.04 -15.69 49.54 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 CA-C-N 118.39 0.461 . . . . 0.0 113.147 179.691 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.7 m -83.37 0.34 46.4 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -73.34 137.02 44.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.327 0.584 . . . . 0.0 109.683 179.376 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -83.56 119.08 24.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.592 0.71 . . . . 0.0 109.805 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.9 p -68.86 -12.68 61.81 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.303 -177.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -57.9 -38.98 76.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 122.036 0.922 . . . . 0.0 109.392 177.664 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.36 -9.25 58.26 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.466 -1.243 . . . . 0.0 112.675 -177.178 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.6 t -126.75 36.27 4.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.885 0.374 . . . . 0.0 111.809 -175.645 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 55.3 m -66.94 132.26 47.59 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 176.633 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -68.47 -25.26 64.89 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -175.561 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -64.01 -31.2 72.31 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.362 0.601 . . . . 0.0 110.484 178.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -96.98 10.27 39.68 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-O 121.298 0.57 . . . . 0.0 111.756 -178.441 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -75.25 109.11 8.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.275 0.56 . . . . 0.0 110.338 -178.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 68.1 m -139.1 147.33 41.82 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.064 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -66.76 -32.16 73.27 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -178.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -68.25 -30.75 69.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.486 0.66 . . . . 0.0 110.07 178.235 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -61.3 -27.31 68.39 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.699 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.15 90.2 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.854 -0.529 . . . . 0.0 111.496 177.822 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -65.86 -41.98 90.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 179.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 63.2 mtt -67.68 -29.01 68.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.397 178.299 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.06 -34.07 75.56 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.048 -0.407 . . . . 0.0 111.803 -179.298 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 76.7 ttt-85 -65.41 -46.68 79.06 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 178.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.65 -46.07 91.35 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.356 -0.537 . . . . 0.0 109.881 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -60.7 -35.52 76.49 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.328 -178.364 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -65.76 -41.36 92.18 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.538 0.208 . . . . 0.0 111.004 176.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.2 mt -66.07 -35.94 81.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.033 0.444 . . . . 0.0 110.109 -179.523 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.5 t -69.77 -42.94 73.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.483 0.659 . . . . 0.0 109.422 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.32 -46.0 90.7 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -177.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -58.68 -39.4 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 118.966 0.803 . . . . 0.0 111.986 -175.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -73.88 -41.08 62.68 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.165 178.305 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -61.37 -32.9 72.83 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.519 0.676 . . . . 0.0 110.295 178.258 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 46.5 tp60 -57.81 -25.77 61.06 Favored 'General case' 0 C--O 1.205 -1.238 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.273 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -61.54 -37.47 83.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 119.199 0.909 . . . . 0.0 110.607 -179.492 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -77.1 -50.45 13.02 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.731 0.777 . . . . 0.0 109.735 176.41 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -65.74 -36.18 82.85 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -174.614 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -61.3 -17.81 55.46 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -177.229 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 13.6 mmtm -66.08 -51.14 60.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 178.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 4.5 p -77.2 -34.33 56.2 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 177.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.98 -24.38 67.87 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-O 120.935 0.398 . . . . 0.0 111.578 -177.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.3 -14.02 45.03 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 177.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -100.02 5.5 45.08 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -179.147 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.28 146.39 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 179.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -144.39 168.15 20.79 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.233 0.54 . . . . 0.0 110.019 -178.435 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -151.19 173.5 14.35 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 104.035 -2.58 . . . . 0.0 104.035 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -125.75 45.73 2.55 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 141.64 173.02 13.64 Favored Glycine 0 N--CA 1.452 -0.247 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -179.13 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -137.89 147.61 44.59 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 -179.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 96.3 mt -117.54 137.25 52.7 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 104.543 -2.392 . . . . 0.0 104.543 176.167 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -148.72 140.15 23.39 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 105.518 -2.031 . . . . 0.0 105.518 -174.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -151.25 166.42 30.97 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.114 0.415 . . . . 0.0 111.078 -176.031 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -142.51 141.92 32.17 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 102.134 -3.284 . . . . 0.0 102.134 175.298 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -135.25 45.89 2.45 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.63 87.19 4.57 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.804 -178.761 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -165.33 129.73 2.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.103 0.477 . . . . 0.0 110.499 169.726 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -144.26 39.23 1.3 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.517 -173.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 115.482 -2.199 . . . . 0.0 105.121 -178.535 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ptt? . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.342 0.592 . . . . 0.0 110.761 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -86.39 157.05 19.94 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.619 -0.676 . . . . 0.0 110.074 -178.516 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 56.0 tp -57.21 -36.22 70.6 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.824 0.821 . . . . 0.0 110.027 177.666 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 36.2 mt -59.9 -35.32 74.6 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.986 -178.853 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -67.38 -26.0 66.24 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.17 -177.165 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.24 -52.74 63.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.65 -41.89 68.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.899 178.691 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -56.85 -52.16 66.18 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -73.8 -33.53 64.23 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.653 -0.654 . . . . 0.0 112.269 -179.506 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -69.16 -34.82 75.57 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.417 -0.802 . . . . 0.0 111.034 178.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 11.8 mm -72.72 -34.05 46.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 177.045 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.09 84.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 175.825 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.81 87.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.568 178.032 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -60.33 -46.06 91.24 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.23 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -64.99 -43.14 93.56 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.523 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.72 -43.01 94.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.28 179.775 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.5 p30 -75.38 -10.56 59.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.3 -0.875 . . . . 0.0 112.079 178.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.2 m -89.98 6.05 43.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 173.723 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.92 -0.51 67.1 Favored Glycine 0 CA--C 1.517 0.172 0 N-CA-C 116.353 1.301 . . . . 0.0 116.353 175.623 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -66.39 131.1 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 118.187 0.993 . . . . 0.0 110.0 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.94 131.65 10.56 Favored Glycine 0 N--CA 1.451 -0.357 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 -178.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.6 t -74.57 125.82 34.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 61.3 mt -93.65 -48.43 13.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.58 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -149.49 128.76 12.87 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.302 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.32 105.35 4.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 175.119 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.19 -25.89 0.05 OUTLIER Glycine 0 CA--C 1.508 -0.393 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.062 178.283 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.419 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 30.4 mp0 -62.9 -22.89 67.06 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.846 0.858 . . . . 0.0 111.08 -179.246 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.1 t 69.41 -23.52 0.15 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 176.426 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -93.68 -30.19 15.04 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 174.596 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -133.28 152.07 51.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.262 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 25.8 mt -140.55 134.61 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 175.063 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 m95 -109.04 132.25 54.29 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -125.72 135.38 52.02 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.802 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 25.0 tt0 -94.75 133.59 38.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 175.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.75 128.17 93.75 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -77.78 -28.54 5.1 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 116.657 -1.762 . . . . 0.0 114.378 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -77.67 -28.62 51.21 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 123.62 0.768 . . . . 0.0 112.033 -178.39 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 55.09 40.6 31.95 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.4 m -66.09 -173.12 0.17 Allowed 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 164.612 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.7 t -41.25 -39.45 1.36 Allowed 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -75.84 123.8 26.26 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -104.82 -26.32 12.28 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 176.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.4 mt -140.35 155.41 46.79 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -176.488 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.4 t -132.83 136.12 56.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 175.176 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -124.8 129.93 51.4 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.8 mt -102.55 131.43 49.28 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 174.448 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -136.4 103.03 5.14 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -174.912 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.9 96.38 7.02 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 178.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -151.69 122.73 7.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.125 -173.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.04 151.38 28.42 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.1 mt -138.59 110.46 7.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -173.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.26 -40.37 67.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -134.15 155.59 49.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.902 -175.206 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -63.87 -22.92 67.14 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 177.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.6 -39.51 88.42 Favored 'General case' 0 C--O 1.211 -0.945 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.424 -179.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.26 -37.02 80.32 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 18.1 ttt -60.45 -51.6 68.77 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.379 178.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.42 -32.53 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 118.895 0.771 . . . . 0.0 111.116 -179.138 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.1 mtm105 -66.53 -38.1 86.43 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.834 0.349 . . . . 0.0 110.439 -178.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -60.34 -39.72 88.12 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.013 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.7 mp -74.18 -34.36 37.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.305 -0.872 . . . . 0.0 111.364 179.432 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -63.06 -35.33 79.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -68.7 -43.44 76.03 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 175.66 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -58.42 -40.99 83.97 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 121.663 -0.648 . . . . 0.0 110.539 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.65 -43.4 84.72 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 122.233 -0.292 . . . . 0.0 110.777 -178.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -64.64 -47.5 78.3 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.338 0.59 . . . . 0.0 110.017 179.146 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -59.14 -49.41 77.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.955 179.353 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.1 p -72.91 -32.34 39.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.685 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.0 -40.16 94.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 118.984 0.811 . . . . 0.0 111.036 -178.074 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -61.16 -35.3 76.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.232 -178.632 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.08 -50.46 19.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 178.371 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -71.08 -30.35 66.45 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -172.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -56.87 -29.65 63.13 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.613 0.642 . . . . 0.0 110.5 177.24 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.63 -21.19 66.55 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 mp -82.73 -12.35 57.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.912 0.387 . . . . 0.0 110.255 178.592 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.18 11.04 66.74 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.224 -0.513 . . . . 0.0 113.459 -178.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -67.26 136.94 55.71 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.258 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -63.18 -35.69 81.15 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -174.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.1 ptt85 -153.25 156.55 38.69 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 174.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -115.85 154.31 29.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.982 0.513 . . . . 0.0 111.451 -177.823 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -136.51 125.37 24.1 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 167.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.59 145.02 42.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.662 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.4 tp -108.64 121.28 44.69 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 172.486 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -115.86 108.69 16.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.035 0.38 . . . . 0.0 110.254 -178.641 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -104.94 107.71 23.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 111.997 -176.433 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -77.17 147.94 36.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.176 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -127.14 114.95 18.38 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 171.038 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -133.55 160.15 38.31 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.34 0.656 . . . . 0.0 109.978 -173.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -75.97 -50.14 15.73 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.572 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -124.26 158.39 32.63 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 106.553 -1.647 . . . . 0.0 106.553 -176.231 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.36 150.11 56.63 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 177.229 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -58.2 146.61 87.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 118.152 -0.766 . . . . 0.0 113.353 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.56 -12.43 15.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 115.808 1.781 . . . . 0.0 115.808 -174.035 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -133.34 137.84 46.1 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 121.947 -0.471 . . . . 0.0 112.21 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.9 t0 14.57 59.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 119.087 2.995 . . . . 0.0 119.087 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 22.7 p-90 -87.43 -24.1 24.29 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 121.133 -0.98 . . . . 0.0 109.73 178.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -64.17 -35.4 80.67 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 121.392 -0.818 . . . . 0.0 112.905 -174.446 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.8 -20.84 61.08 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.223 178.504 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.7 mm -70.41 -39.09 76.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.557 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.542 0.687 . . . . 0.0 111.153 -179.591 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -89.1 1.17 55.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.174 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -103.31 101.15 11.07 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.8 m -70.19 123.25 21.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 173.967 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -84.22 123.3 29.97 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 178.001 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.82 127.96 48.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.795 0.807 . . . . 0.0 109.302 179.237 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -145.5 122.12 11.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.229 -178.746 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.21 -112.95 5.42 Favored Glycine 0 C--O 1.226 -0.405 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 75.7 p -105.01 -2.9 23.89 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 178.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.0 t -96.84 139.47 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 76.3 p -119.69 140.15 51.11 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.631 -2.359 . . . . 0.0 104.631 168.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.32 130.96 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.795 0 CA-C-O 121.984 0.897 . . . . 0.0 110.044 179.106 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -100.59 109.46 57.45 Favored Pre-proline 0 N--CA 1.427 -1.624 0 CA-C-N 113.632 -1.622 . . . . 0.0 109.384 -179.947 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.5 154.61 21.16 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 117.894 -0.937 . . . . 0.0 112.085 178.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.89 151.95 30.96 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 175.553 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.7 tt -145.69 132.71 15.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.777 0.799 . . . . 0.0 110.489 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 99.2 t -104.72 126.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 175.696 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.89 142.91 43.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 104.511 -2.403 . . . . 0.0 104.511 176.329 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.5 -20.64 59.27 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.531 -0.366 . . . . 0.0 113.926 -175.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 55.6 p -62.49 -27.82 69.4 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.261 0.838 . . . . 0.0 113.261 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 19.5 ptp -146.9 44.46 1.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.71 1.243 . . . . 0.0 107.714 178.231 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tp -42.79 -50.41 5.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.606 -1.634 . . . . 0.0 114.777 -175.473 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -66.99 -36.23 81.7 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.63 -38.77 64.93 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.876 0.47 . . . . 0.0 110.347 -175.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -68.77 -38.97 80.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 176.128 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -59.39 -50.18 74.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.439 -177.615 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -71.92 -14.54 61.96 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.58 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.64 -37.26 50.39 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 122.061 -0.399 . . . . 0.0 109.957 177.123 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.7 p -90.28 -36.99 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -128.67 76.13 79.04 Favored Pre-proline 0 C--N 1.326 -0.44 0 C-N-CA 122.613 0.365 . . . . 0.0 110.657 178.205 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.02 -14.68 41.7 Favored 'Trans proline' 0 C--N 1.349 0.596 0 CA-C-O 121.1 0.375 . . . . 0.0 112.904 178.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -76.47 -8.98 58.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.798 177.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -72.39 138.54 47.28 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.82 83.15 2.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.738 0.78 . . . . 0.0 112.254 -179.398 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.9 p -70.4 -23.12 62.7 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.436 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -63.57 -26.45 68.7 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.825 0.85 . . . . 0.0 111.176 177.666 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -86.96 7.43 27.52 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.384 0.611 . . . . 0.0 109.903 -179.499 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 65.0 m -128.12 164.13 23.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.028 0.918 . . . . 0.0 112.185 -175.56 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 75.3 m -149.99 162.62 40.01 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 102.85 -3.018 . . . . 0.0 102.85 175.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -60.01 -35.94 76.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 118.511 0.596 . . . . 0.0 111.079 -179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -66.71 -24.31 66.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.33 0.586 . . . . 0.0 111.896 179.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -79.34 -13.77 59.42 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 121.853 -0.529 . . . . 0.0 109.717 -177.529 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.05 16.83 2.17 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.803 0.335 . . . . 0.0 111.665 179.662 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 43.0 t -55.65 152.06 9.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.53 0.681 . . . . 0.0 111.612 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -57.72 -30.85 65.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.962 -178.776 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -72.38 -35.5 68.47 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -179.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -71.3 -38.23 71.77 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 179.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.06 88.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.03 0.443 . . . . 0.0 110.681 177.972 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.9 tm0? -68.53 -49.81 56.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.5 mtt -64.92 -29.74 70.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -178.308 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.92 -33.24 64.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.518 0.192 . . . . 0.0 111.518 -179.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -63.98 -47.43 80.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-O 120.959 0.409 . . . . 0.0 109.925 177.878 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -68.18 -38.95 82.57 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.213 0.53 . . . . 0.0 110.573 -177.496 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -66.11 -38.17 87.53 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.153 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -63.9 -44.04 94.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.872 0.368 . . . . 0.0 111.207 176.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.18 -33.29 75.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.991 0.425 . . . . 0.0 110.452 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -76.06 -35.77 59.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.576 0.703 . . . . 0.0 110.954 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.2 tt -65.63 -41.23 92.89 Favored 'General case' 0 C--O 1.218 -0.58 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.655 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.5 p -58.08 -39.5 72.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.149 -0.621 . . . . 0.0 111.248 -176.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -73.96 -40.15 63.23 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.15 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -61.53 -30.06 70.4 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.555 -0.716 . . . . 0.0 111.253 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -56.23 -28.37 58.22 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 121.834 -0.541 . . . . 0.0 110.566 178.474 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 75.5 mt-10 -65.96 -40.39 91.27 Favored 'General case' 0 C--O 1.241 0.638 0 O-C-N 121.587 -0.696 . . . . 0.0 111.497 -178.046 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -76.9 -38.24 53.89 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.245 179.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -69.56 -37.72 77.14 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -176.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 48.6 mtp180 -56.65 -18.06 10.91 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -177.225 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 23.8 mtmm -62.72 -60.56 3.33 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 175.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 3.6 p -72.44 -32.97 66.74 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 179.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -61.99 -27.77 69.09 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.17 -177.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.03 -16.14 40.05 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -179.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.91 -28.49 61.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.966 0.413 . . . . 0.0 111.796 178.6 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 31.4 m -118.68 150.62 20.91 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.818 0 CA-C-O 122.984 1.373 . . . . 0.0 111.208 -170.968 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -148.6 167.06 26.45 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.499 -1.682 . . . . 0.0 110.149 179.328 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -135.69 167.34 21.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 176.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -145.84 162.64 37.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 118.103 0.41 . . . . 0.0 110.537 -178.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 164.35 176.39 36.1 Favored Glycine 0 C--O 1.243 0.668 0 N-CA-C 105.779 -2.929 . . . . 0.0 105.779 -179.338 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -159.21 168.92 25.3 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 179.566 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -111.23 144.02 41.06 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 103.357 -2.831 . . . . 0.0 103.357 175.17 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -126.22 158.88 34.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 105.431 -2.062 . . . . 0.0 105.431 179.454 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -141.66 130.13 22.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.55 0.214 . . . . 0.0 110.928 -176.537 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -104.0 172.32 6.87 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 176.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -122.32 144.7 48.85 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 120.854 0.359 . . . . 0.0 111.889 -179.04 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 61.6 tp -83.07 -64.23 1.21 Allowed 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.789 178.149 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -161.72 -85.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 100.0 m-85 54.19 52.43 12.66 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.674 0.749 . . . . 0.0 111.191 -179.383 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 . . . . . 0 C--O 1.244 0.813 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 179.262 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 ttt . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.282 0.087 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -99.25 165.1 11.86 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -178.208 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt -57.02 -32.31 66.03 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -175.821 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.8 tp -57.61 -43.7 84.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.064 0.459 . . . . 0.0 110.886 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.99 -29.82 70.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.336 -179.61 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -59.56 -55.65 31.86 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 179.785 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.9 m -60.41 -40.68 91.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.164 0.507 . . . . 0.0 111.561 -178.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -56.85 -43.55 81.27 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 178.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -78.84 -35.15 44.44 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 123.086 1.422 . . . . 0.0 109.151 -177.236 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -64.91 -39.11 93.02 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 113.131 -1.85 . . . . 0.0 111.798 -176.912 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 26.0 mm -70.23 -37.68 72.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.17 -42.54 91.03 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.318 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.19 -41.89 94.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 177.939 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -58.27 -46.71 85.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -67.85 -49.42 62.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.92 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.21 -43.01 88.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.052 -177.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -11.28 60.86 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.73 -0.606 . . . . 0.0 112.478 -179.028 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.9 m -95.49 6.79 48.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.7 -1.2 52.51 Favored Glycine 0 C--O 1.228 -0.247 0 N-CA-C 115.989 1.156 . . . . 0.0 115.989 176.527 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.03 118.85 11.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 118.519 1.159 . . . . 0.0 109.103 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.66 127.52 16.31 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 108.772 -1.731 . . . . 0.0 108.772 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.48 130.51 35.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.539 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.39 -41.41 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.244 -176.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -140.71 140.24 34.86 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 103.881 -2.637 . . . . 0.0 103.881 178.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -136.84 105.32 5.77 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.206 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 47.26 50.4 17.18 Favored Glycine 0 N--CA 1.45 -0.405 0 N-CA-C 116.513 1.365 . . . . 0.0 116.513 171.736 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -64.1 -32.26 73.75 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.9 m -164.67 -57.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 176.512 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -128.62 -17.0 4.17 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 -174.433 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.97 158.63 28.67 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.2 mt -138.33 127.42 32.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.515 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.51 132.47 55.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -127.62 131.85 49.84 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 123.542 0.526 . . . . 0.0 109.684 -178.421 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -84.15 134.48 34.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 114.97 34.88 Favored Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.389 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -73.61 -28.07 12.21 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 117.239 -1.374 . . . . 0.0 114.157 -174.174 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -9.88 59.25 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 122.171 -0.331 . . . . 0.0 111.461 -179.502 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.7 mtmm 62.2 39.68 12.44 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 -175.176 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -177.71 0.63 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 111.519 -2.582 . . . . 0.0 115.726 -176.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -44.99 -28.09 0.63 Allowed 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 177.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -114.51 141.43 47.72 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 174.053 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.06 -36.85 55.62 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -178.739 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.7 mt -140.65 163.02 33.99 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 87.0 t -128.19 136.56 59.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 105.213 -2.144 . . . . 0.0 105.213 174.569 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -123.48 129.19 50.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.881 0.372 . . . . 0.0 110.23 179.289 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.4 mt -109.87 120.86 43.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 176.407 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -136.45 132.85 35.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 117.95 0.341 . . . . 0.0 110.289 -176.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -106.96 118.79 37.62 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.212 0.529 . . . . 0.0 110.41 179.518 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -151.55 150.18 30.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.966 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -86.05 143.27 28.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.023 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.9 mt -143.69 103.58 4.09 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.729 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -79.62 -38.41 33.89 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 121.769 0.795 . . . . 0.0 111.99 -178.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.1 152.77 48.33 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.952 -0.468 . . . . 0.0 110.116 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -64.02 -20.9 66.24 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.7 -33.49 76.08 Favored 'General case' 0 C--O 1.213 -0.863 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.875 179.301 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.07 -32.28 64.92 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' MET . . . . . 0.426 ' HE3' ' CE3' ' A' ' 96' ' ' TRP . 28.6 ttm -66.23 -51.02 61.64 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.448 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.4 m -61.91 -34.55 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 118.82 0.736 . . . . 0.0 111.291 178.894 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -64.71 -38.25 90.34 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 120.752 0.311 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.75 -44.07 94.0 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 1.3 mm -66.14 -31.15 52.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.54 -0.464 . . . . 0.0 112.13 -177.474 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.14 -39.77 94.72 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 177.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -68.52 -44.9 73.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.145 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -57.97 -44.17 86.91 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.87 -43.85 90.94 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 111.477 0.177 . . . . 0.0 111.477 -176.984 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.08 -36.26 77.41 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.88 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -64.21 -45.74 86.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.548 177.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.69 -37.87 81.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.648 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -61.6 -41.65 97.74 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 122.211 -0.306 . . . . 0.0 110.643 178.76 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.8 mtt85 -62.98 -44.72 95.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.426 179.139 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.24 -40.81 90.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.461 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.2 OUTLIER -68.0 -40.54 83.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.249 -0.907 . . . . 0.0 111.619 179.659 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -60.16 -35.96 76.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.926 0.393 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -60.75 -31.11 70.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -179.241 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.81 9.06 10.62 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -177.348 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.09 5.67 21.43 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 121.472 3.349 . . . . 0.0 121.472 171.274 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.44 146.61 53.83 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.877 1.839 . . . . 0.0 107.44 178.763 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.8 tpt85 -62.31 -42.67 99.56 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -174.596 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -147.39 152.31 37.95 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 118.918 0.781 . . . . 0.0 110.307 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' MET . . . . . 0.426 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -100.4 163.83 12.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.37 123.08 12.58 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.775 -3.787 . . . . 0.0 100.775 174.746 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.41 114.27 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.879 0.763 . . . . 0.0 111.803 -173.777 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 62.2 tp -81.46 117.26 21.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.011 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -111.47 109.52 19.51 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.28 112.18 35.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 120.866 0.365 . . . . 0.0 111.955 -176.483 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -85.76 117.78 24.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.11 177.744 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -94.23 111.44 23.18 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 174.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.2 p -122.16 155.19 36.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.83 0.348 . . . . 0.0 111.111 -176.038 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 16.4 m -67.24 -48.41 67.86 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 176.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -148.72 159.81 43.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 -177.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.09 159.12 40.45 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.717 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.34 147.84 65.0 Favored 'Trans proline' 0 C--N 1.351 0.699 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 179.151 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.2 m -84.44 -5.24 9.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.4 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -115.03 97.11 6.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.649 0.38 . . . . 0.0 111.316 -177.325 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 14.55 64.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 117.9 2.555 . . . . 0.0 117.9 176.506 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.426 ' CE3' ' HE3' ' A' ' 57' ' ' MET . 54.8 p-90 -83.57 -16.74 44.21 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 112.34 -178.821 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -37.06 71.54 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -173.957 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -66.06 -23.95 66.63 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.644 -0.66 . . . . 0.0 111.686 178.533 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.1 mm -67.07 -37.3 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -176.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.99 -22.9 64.95 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -92.04 3.27 55.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.217 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -102.72 98.45 8.47 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 122.033 -0.417 . . . . 0.0 111.63 -178.23 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.6 m -68.04 126.54 29.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 174.251 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 9.5 t80 -82.72 109.03 16.53 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -111.07 114.43 27.7 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.327 -176.226 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -134.57 80.48 1.85 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.609 -177.774 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.13 -108.48 2.49 Favored Glycine 0 CA--C 1.517 0.185 0 C-N-CA 118.902 -1.618 . . . . 0.0 112.747 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.0 p -86.92 11.59 13.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.221 0.608 . . . . 0.0 111.062 179.489 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 92.6 t -120.68 141.06 42.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -176.317 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.8 t -141.23 127.4 19.63 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 104.45 -2.426 . . . . 0.0 104.45 169.734 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.1 t -133.64 123.49 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -102.89 115.8 63.59 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.046 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -79.86 157.58 24.21 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 116.033 -2.178 . . . . 0.0 112.975 179.257 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.78 151.83 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.615 -2.735 . . . . 0.0 103.615 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.1 tt -146.18 142.68 21.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.1 m -124.34 138.19 54.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 104.478 -2.415 . . . . 0.0 104.478 174.373 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.38 142.35 43.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 178.569 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.86 -19.48 61.02 Favored Glycine 0 C--N 1.323 -0.194 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.806 -176.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.1 p -63.9 -33.38 75.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -178.012 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.4 ptm -138.33 36.63 2.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.738 1.256 . . . . 0.0 108.54 -178.74 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 20.4 tp -49.87 -36.53 27.39 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 -173.238 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.64 -48.2 78.2 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.706 -0.621 . . . . 0.0 110.862 -178.111 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.87 -34.17 66.54 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.294 -177.805 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.79 -42.64 81.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.961 178.264 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.7 -48.6 81.05 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.703 -177.941 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -68.85 -13.78 62.62 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.529 -177.201 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.05 -32.48 50.91 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.171 -0.33 . . . . 0.0 110.66 176.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 6.9 p -95.63 -38.19 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 120.887 0.375 . . . . 0.0 111.078 178.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -126.87 76.12 75.55 Favored Pre-proline 0 C--N 1.325 -0.495 0 C-N-CA 122.475 0.31 . . . . 0.0 110.534 178.53 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -13.98 39.59 Favored 'Trans proline' 0 C--N 1.347 0.493 0 CA-C-O 121.195 0.415 . . . . 0.0 112.412 178.443 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.4 m -69.87 -13.71 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.3 177.07 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -105.65 127.88 53.32 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.07 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -85.77 135.36 33.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.167 0.508 . . . . 0.0 112.242 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 28.4 p -67.15 -19.6 65.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.15 0.5 . . . . 0.0 110.073 177.754 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -64.65 -14.96 60.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 178.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.84 2.06 6.04 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -175.277 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 48.8 t -149.74 100.79 3.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 173.063 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.4 t -62.02 151.55 34.93 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.618 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -61.9 -34.12 75.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.33 0.586 . . . . 0.0 109.697 178.761 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.89 -32.58 72.96 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 122.117 0.96 . . . . 0.0 110.492 177.411 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -93.93 -4.16 50.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.65 -176.668 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.27 37.79 0.34 Allowed 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -176.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 75.7 m -68.8 150.51 47.75 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 178.179 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -60.86 -28.81 69.13 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -177.365 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.67 -26.78 68.82 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 121.908 -0.495 . . . . 0.0 110.714 177.913 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -67.64 -27.57 66.99 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.518 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.29 80.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.979 0.419 . . . . 0.0 110.293 178.535 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -74.26 -45.88 45.03 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.961 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 20.2 mmt -59.14 -31.4 68.93 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.339 179.642 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.2 81.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 122.244 -0.285 . . . . 0.0 111.147 179.453 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -67.85 -47.39 69.08 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.22 -42.86 99.68 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 -176.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.39 -34.44 74.53 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.635 178.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -66.35 -45.45 80.14 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.075 0.398 . . . . 0.0 110.13 176.963 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.18 -39.72 93.63 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 40.1 m -67.02 -37.47 84.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.675 177.223 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.14 -38.83 91.87 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.278 -179.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.3 t -57.75 -47.96 84.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.462 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -70.18 -39.07 75.48 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 121.808 -0.558 . . . . 0.0 110.342 179.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -63.11 -29.98 71.23 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 121.965 -0.459 . . . . 0.0 111.837 178.841 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -56.23 -30.72 62.74 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 177.463 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -70.19 -34.94 73.57 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.188 0.518 . . . . 0.0 110.755 -179.412 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -68.66 -40.9 79.99 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 176.647 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -70.48 -38.31 74.38 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -59.28 -17.61 30.24 Favored 'General case' 0 C--O 1.214 -0.806 0 N-CA-C 117.621 2.452 . . . . 0.0 117.621 -171.912 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.4 -22.59 43.95 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.347 -0.845 . . . . 0.0 110.347 173.563 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 1.9 m -72.39 -23.35 61.09 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 177.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -64.23 -24.29 67.62 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.992 0.517 . . . . 0.0 110.444 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.82 -14.21 62.42 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 178.808 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -69.01 142.79 54.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 24.5 t -76.73 94.22 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.421 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.84 173.99 14.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.498 -177.442 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -147.38 148.66 31.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.749 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -155.48 144.38 20.64 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 179.387 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.04 174.44 30.58 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.186 -179.204 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -164.3 127.88 2.54 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.2 mp -131.28 150.1 52.29 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 176.18 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 179.42 152.34 0.4 Allowed 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 177.491 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 47.1 mtt85 61.35 -121.95 0.81 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 -177.056 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 52.66 36.92 22.14 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.173 0.589 . . . . 0.0 111.152 177.342 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -144.03 157.43 44.33 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -175.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 11.8 tp 67.91 167.91 0.26 Allowed 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.871 1.357 . . . . 0.0 112.653 178.226 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -151.3 157.82 43.03 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 105.471 -2.048 . . . . 0.0 105.471 -178.856 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -152.54 5.67 0.39 Allowed 'General case' 0 C--N 1.323 -0.552 0 O-C-N 123.191 0.307 . . . . 0.0 110.922 179.362 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 117.03 -1.462 . . . . 0.0 111.11 -177.103 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.2 mtm . . . . . 0 N--CA 1.497 1.92 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -67.99 -2.54 7.8 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -177.484 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.01 -44.93 83.31 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.544 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.02 -35.28 78.02 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.332 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.64 -33.03 74.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -176.275 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -60.38 -48.59 81.09 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.577 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.0 m -68.84 -40.11 79.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.046 0.45 . . . . 0.0 111.198 179.362 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -54.44 -52.23 62.45 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -70.14 -27.01 64.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.604 -0.685 . . . . 0.0 111.339 -179.885 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -68.51 -36.75 79.32 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.796 -0.565 . . . . 0.0 110.23 176.452 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.488 ' HA ' ' HD1' ' A' ' 14' ' ' HIS . 21.8 mm -67.0 -45.09 87.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 177.421 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.34 77.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.221 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.5 99.28 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . 0.488 ' HD1' ' HA ' ' A' ' 11' ' ' ILE . 0.1 OUTLIER -68.79 -35.71 77.37 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.889 -178.308 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -69.72 -47.25 63.78 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.62 -41.59 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.168 177.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -75.05 -6.65 50.58 Favored 'General case' 0 C--O 1.217 -0.618 0 O-C-N 121.026 -1.046 . . . . 0.0 112.34 179.45 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.3 m -92.6 10.3 31.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 173.583 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.62 -3.55 56.25 Favored Glycine 0 C--N 1.329 0.167 0 N-CA-C 116.147 1.219 . . . . 0.0 116.147 175.716 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -67.53 125.23 25.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.649 0.724 . . . . 0.0 110.246 -179.902 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.71 131.24 10.29 Favored Glycine 0 C--O 1.225 -0.437 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.135 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.6 t -73.55 126.69 34.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 179.334 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.8 mt -92.72 -43.12 13.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 177.305 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -149.16 121.03 8.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.607 -176.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.24 122.86 16.26 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 171.501 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.28 -54.82 0.06 OUTLIER Glycine 0 CA--C 1.504 -0.6 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 178.438 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -68.97 139.88 55.04 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 105.072 -2.196 . . . . 0.0 105.072 176.143 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.6 m -74.74 -8.95 57.98 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -174.027 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -111.14 -9.8 14.34 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 -175.305 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.69 129.72 20.75 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -177.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 89.1 mt -135.89 131.78 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.077 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.8 m95 -109.17 138.74 45.06 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.046 0.45 . . . . 0.0 110.882 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mp -132.57 137.97 47.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.131 0.972 . . . . 0.0 109.963 -178.31 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -86.57 133.92 33.68 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.375 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 119.76 77.93 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 103.393 -2.818 . . . . 0.0 103.393 174.964 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.55 -23.32 27.32 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 116.356 -1.962 . . . . 0.0 112.807 -173.545 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -71.35 -34.82 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 179.632 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 58.05 41.08 24.66 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.818 1.771 . . . . 0.0 108.652 -169.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -75.12 -172.78 1.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 110.939 -2.846 . . . . 0.0 105.681 172.816 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.2 m -41.22 -27.79 0.08 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -108.58 133.84 52.16 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.085 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -87.69 -44.73 10.96 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.185 0.516 . . . . 0.0 111.152 -178.224 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 76.2 mt -137.07 160.64 38.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.674 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.1 t -130.7 135.61 59.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 177.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 135.66 52.54 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 174.588 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -106.04 130.21 54.0 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 -179.591 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -130.27 124.74 33.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.846 0.355 . . . . 0.0 111.54 -176.823 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -103.3 94.52 5.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -149.36 133.85 17.58 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -175.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -78.28 144.64 35.95 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.739 -1.119 . . . . 0.0 108.439 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -135.93 110.05 8.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -81.42 -39.66 24.58 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.661 0.743 . . . . 0.0 111.4 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -127.0 149.78 49.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.567 -178.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -66.29 -18.86 65.6 Favored 'General case' 0 CA--C 1.504 -0.803 0 O-C-N 122.341 -0.225 . . . . 0.0 111.378 -178.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -62.99 -33.42 75.37 Favored 'General case' 0 C--O 1.211 -0.97 0 C-N-CA 119.616 -0.834 . . . . 0.0 108.874 178.054 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.36 -38.26 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.964 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.5 ttm -59.8 -51.18 70.83 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.802 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 15.1 m -64.55 -31.83 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-O 121.166 0.508 . . . . 0.0 111.496 -178.112 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -70.06 -41.47 74.12 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.55 -177.64 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -58.57 -41.99 86.94 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.9 mm -70.07 -33.69 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 119.776 -0.769 . . . . 0.0 111.788 -178.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -31.05 69.98 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.763 -178.772 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -45.33 58.77 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 175.15 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -57.49 -35.05 69.7 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.176 179.525 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.72 -34.48 74.45 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 122.354 -0.216 . . . . 0.0 111.261 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -69.91 -38.97 76.42 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -61.59 -43.43 98.88 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.679 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 70.8 t -64.98 -44.24 96.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 179.41 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.41 -46.06 87.2 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.746 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm105 -61.33 -42.3 98.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -177.719 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.3 -38.54 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.695 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -30.21 70.1 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.151 -0.968 . . . . 0.0 111.533 -177.959 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -40.24 78.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.759 0.314 . . . . 0.0 110.415 179.354 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -67.18 -39.38 86.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.917 -178.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.11 -8.13 59.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.892 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.38 19.44 68.6 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 114.029 0.372 . . . . 0.0 114.029 179.787 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.2 mtp85 -67.39 141.23 57.13 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 121.761 -0.846 . . . . 0.0 111.936 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.35 -35.14 78.77 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 178.002 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -155.72 147.56 23.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -122.45 139.91 53.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 178.104 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -113.46 121.39 44.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.92 0.39 . . . . 0.0 111.033 177.703 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -110.95 130.54 55.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.363 -178.121 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -93.05 121.13 34.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.607 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -115.89 128.33 55.71 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.742 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.4 t -125.45 113.87 37.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.969 0.414 . . . . 0.0 110.676 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -80.05 146.21 32.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.056 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -123.85 111.85 16.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 173.209 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 46.3 t -135.41 161.08 36.44 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.465 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -75.17 -29.06 60.32 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.799 -0.563 . . . . 0.0 110.042 -177.615 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -152.76 167.35 29.3 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.73 160.76 27.09 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -55.24 149.77 43.64 Favored 'Trans proline' 0 C--N 1.35 0.626 0 N-CA-C 115.609 1.35 . . . . 0.0 115.609 -179.339 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -76.27 -15.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -176.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -119.2 98.44 6.16 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 116.118 1.896 . . . . 0.0 116.118 -175.087 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 45.42 29.1 0.55 Allowed 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 118.549 2.796 . . . . 0.0 118.549 170.967 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -61.73 -22.25 65.22 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 121.089 -1.007 . . . . 0.0 111.283 178.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.69 -31.42 72.31 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 121.839 -0.538 . . . . 0.0 111.01 -178.026 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.47 -35.56 76.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.8 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.58 -40.06 83.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -176.627 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.68 -15.85 63.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.56 0.56 50.24 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 122.054 -0.404 . . . . 0.0 110.912 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -123.8 116.01 22.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.791 0.805 . . . . 0.0 111.466 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.1 m -68.19 128.3 36.06 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 176.19 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -82.74 107.81 15.65 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -178.32 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -117.11 137.63 52.17 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.894 0.854 . . . . 0.0 111.926 -176.312 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -137.21 75.29 1.52 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 177.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.42 -111.09 3.9 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 119.491 -1.338 . . . . 0.0 112.221 178.767 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.5 p -73.43 8.9 1.53 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.547 1.139 . . . . 0.0 113.39 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 67.6 t -127.82 143.79 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 C-N-CA 122.793 0.437 . . . . 0.0 111.307 -177.687 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.8 p -143.62 131.32 21.33 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 171.56 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.0 t -136.77 138.9 45.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 122.178 -0.326 . . . . 0.0 110.284 -179.033 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.25 122.62 53.45 Favored Pre-proline 0 CA--C 1.535 0.381 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.672 175.557 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -83.31 65.28 7.73 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 121.829 1.686 . . . . 0.0 113.708 178.151 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -79.26 153.69 29.72 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 tt -149.37 143.23 18.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.5 t -116.41 112.31 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 173.222 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.414 ' HE ' ' CG ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -94.52 136.18 35.12 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.353 0.597 . . . . 0.0 109.7 178.995 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.94 -37.82 93.22 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -176.699 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.5 t -57.04 -17.77 11.44 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.298 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -146.48 31.97 0.98 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tt -46.71 -40.09 12.73 Favored 'General case' 0 C--O 1.209 -1.073 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -173.496 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -59.24 -50.23 74.81 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.985 -176.756 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -73.76 -39.45 64.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.1 0.953 . . . . 0.0 111.817 179.168 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . 0.414 ' CG ' ' HE ' ' A' ' 117' ' ' ARG . 1.8 t0 -67.11 -35.23 79.3 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.73 0.776 . . . . 0.0 112.136 -176.454 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.23 -43.34 74.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.105 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -69.92 -16.96 63.3 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.92 -175.954 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.25 -25.73 61.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.905 0.383 . . . . 0.0 110.294 177.356 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.06 -41.5 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.203 0.525 . . . . 0.0 110.545 179.735 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -127.05 75.91 76.37 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 123.113 0.565 . . . . 0.0 111.434 -178.635 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.91 -17.49 41.49 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.759 1.023 . . . . 0.0 114.759 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.1 m -85.61 0.99 51.02 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -179.911 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -72.48 134.72 45.46 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.646 0.736 . . . . 0.0 112.877 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -82.18 97.68 8.34 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.902 177.674 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 41.8 p -68.21 -18.62 64.63 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.954 178.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.0 -36.02 82.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.913 0.387 . . . . 0.0 111.049 177.566 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -75.75 -13.92 60.31 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.757 0.789 . . . . 0.0 109.854 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 24.6 t -131.1 50.58 2.22 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.369 -176.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 76.6 p -64.59 157.16 27.75 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.367 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.78 -34.52 74.61 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.121 0.486 . . . . 0.0 112.071 -176.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -70.34 -31.2 68.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.432 0.634 . . . . 0.0 111.132 -179.544 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -79.51 -11.82 59.88 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.82 -176.374 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -77.51 34.25 0.17 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -176.15 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 58.7 m -65.32 151.65 45.72 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -64.05 -37.53 87.77 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -174.109 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.47 -30.19 65.71 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.662 0.744 . . . . 0.0 109.287 178.47 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.92 -24.32 64.27 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.15 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.34 -38.22 90.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -42.8 95.07 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.656 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 80.9 mtp -64.2 -28.94 70.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 178.397 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.39 69.38 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.59 -0.694 . . . . 0.0 110.373 178.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -68.85 -46.43 68.55 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.06 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.81 -40.95 97.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.764 0.792 . . . . 0.0 109.579 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 58.9 ttt85 -59.14 -45.49 90.81 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.387 176.77 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.21 -41.44 85.79 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.583 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.65 -39.13 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.332 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.1 m -69.58 -38.44 77.37 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.445 176.983 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.69 -49.07 74.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.863 -178.355 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.1 p -62.43 -38.91 82.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 118.343 0.52 . . . . 0.0 110.809 -177.371 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.06 -40.48 68.29 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 119.857 -0.737 . . . . 0.0 110.028 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -65.18 -31.76 73.1 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.261 -0.899 . . . . 0.0 110.797 178.57 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.15 -28.47 62.78 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.257 -0.277 . . . . 0.0 110.749 179.094 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -62.02 -37.38 84.69 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.474 -179.726 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -76.92 -51.01 11.97 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.891 0.377 . . . . 0.0 110.031 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -60.12 -45.47 92.89 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -174.194 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -63.54 -17.77 63.15 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -177.084 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -68.84 -43.94 74.44 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.79 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 19.5 m -72.31 -45.82 58.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.611 178.636 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.71 -24.48 67.79 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.033 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -54.87 -29.24 55.05 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -179.197 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 40.16 57.62 2.37 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.817 0.817 . . . . 0.0 112.47 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.7 t -51.14 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -174.055 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -154.24 163.82 39.52 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.939 -1.875 . . . . 0.0 105.939 178.759 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -71.16 -25.16 62.43 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.565 179.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 58.63 -168.64 0.14 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.728 0.811 . . . . 0.0 113.007 177.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 173.28 102.88 0.16 Allowed Glycine 0 C--O 1.225 -0.421 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 179.472 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -143.99 131.28 20.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -177.723 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -148.67 114.56 5.73 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.551 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -160.98 167.86 25.7 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 -178.502 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -145.81 122.0 10.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.262 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -73.33 157.08 37.66 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 176.557 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -145.52 98.57 3.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 178.722 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -156.03 162.51 40.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.503 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -148.27 154.46 40.07 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 178.831 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -149.99 39.26 0.76 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 177.45 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 116.275 -1.821 . . . . 0.0 106.764 -176.724 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 119.577 -0.249 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -137.54 155.14 49.58 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 117.908 0.322 . . . . 0.0 111.472 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 72.4 mt -66.37 -32.32 73.63 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 173.05 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.72 -40.39 92.12 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 114.508 -1.224 . . . . 0.0 110.328 177.247 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -67.84 -38.42 83.17 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.071 0.548 . . . . 0.0 109.988 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -60.27 -46.63 89.14 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.83 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.7 m -68.01 -40.71 82.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.511 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -55.55 -52.14 64.72 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.497 0.719 . . . . 0.0 111.907 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.33 -28.35 67.07 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.661 -0.649 . . . . 0.0 111.571 -178.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp -69.71 -38.2 76.84 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.906 -0.496 . . . . 0.0 109.684 176.333 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.4 mm -62.48 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 177.357 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.85 -41.91 75.04 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.132 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.32 96.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 178.518 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -62.84 -45.69 91.41 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.259 -178.874 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.84 -46.92 76.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.277 -176.644 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.4 t -57.38 -43.43 82.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.511 0.672 . . . . 0.0 109.537 178.798 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -78.88 3.75 16.05 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -178.04 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 60.6 m -107.58 11.21 28.85 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.645 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.24 7.06 62.49 Favored Glycine 0 CA--C 1.516 0.148 0 N-CA-C 115.528 0.971 . . . . 0.0 115.528 177.499 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -69.91 129.65 40.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.382 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.77 133.31 15.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 109.139 -1.585 . . . . 0.0 109.139 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -84.44 115.66 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 117.83 0.815 . . . . 0.0 108.999 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 73.9 mt -90.19 -44.54 14.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 178.237 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -149.86 132.43 15.78 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.514 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.26 132.47 28.14 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 172.395 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -168.96 -59.99 0.03 OUTLIER Glycine 0 C--N 1.322 -0.224 0 C-N-CA 119.744 -1.217 . . . . 0.0 115.317 176.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -132.2 163.81 27.73 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 -176.609 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.0 m -65.81 -8.11 19.82 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -65.47 -49.24 69.83 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -151.05 124.91 9.15 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 175.181 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -124.65 120.61 59.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 169.131 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -107.28 121.79 45.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -178.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -120.47 128.94 53.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.1 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -84.67 126.13 33.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.24 178.443 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.56 135.32 95.71 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -178.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.82 -24.85 20.82 Favored 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 115.903 -2.265 . . . . 0.0 112.641 178.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -74.94 -29.6 60.99 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.073 0.549 . . . . 0.0 112.124 179.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.0 mttm 57.04 39.69 29.09 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.188 0.994 . . . . 0.0 112.641 178.701 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.24 -177.61 0.3 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 113.892 -1.504 . . . . 0.0 110.474 176.322 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -51.87 -34.02 39.11 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 175.306 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -90.63 112.12 23.72 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 103.495 -2.78 . . . . 0.0 103.495 170.069 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -105.49 -35.14 7.57 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.12 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -127.43 154.99 44.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 122.046 -0.409 . . . . 0.0 111.81 -175.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.7 p -131.79 137.57 54.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 175.406 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.48 114.19 22.48 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 175.404 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tp -79.37 132.71 36.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -136.46 150.52 48.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -174.745 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -125.76 110.5 13.8 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -151.74 150.32 30.06 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 178.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -114.09 134.79 54.64 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 177.601 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.25 134.35 55.18 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -175.312 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -84.21 -36.58 22.67 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.678 0.752 . . . . 0.0 110.912 176.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -135.61 164.63 27.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.476 -176.619 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.4 ptt-85 -64.38 -22.75 67.06 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.787 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -67.72 -33.15 74.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.007 -177.237 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -65.75 -41.32 92.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 175.794 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.9 ttm -62.22 -51.88 66.01 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.828 -179.407 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.9 m -60.87 -31.85 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.813 0.733 . . . . 0.0 111.099 -178.133 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -68.6 -38.71 80.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.283 -178.02 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -65.77 -35.71 81.48 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.276 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.4 mm -67.27 -34.67 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.864 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.25 -29.09 67.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.481 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -69.75 -42.82 73.37 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.164 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -57.73 -39.7 77.91 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.411 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -37.12 79.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.591 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.49 -44.96 89.33 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -60.96 -43.09 99.24 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.404 179.09 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.65 -31.25 51.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 122.038 -0.414 . . . . 0.0 110.399 -179.05 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.76 -33.55 75.39 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 121.513 -0.742 . . . . 0.0 109.476 175.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -72.4 -46.89 53.18 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 174.096 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.96 -47.29 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.91 -30.25 67.67 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.815 -0.553 . . . . 0.0 110.804 -179.237 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -73.58 -39.99 64.24 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.111 -0.368 . . . . 0.0 110.636 176.678 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.41 -48.6 72.26 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.13 5.7 49.78 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.351 0.596 . . . . 0.0 112.124 -178.764 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.55 -3.08 6.58 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 119.297 2.479 . . . . 0.0 119.297 173.331 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.4 mtp180 -64.24 132.87 51.56 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.144 1.472 . . . . 0.0 108.767 -178.807 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -64.71 -24.34 67.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.977 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -147.0 148.89 32.16 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.094 -2.928 . . . . 0.0 103.094 178.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 8.9 mmm -136.77 148.48 47.25 Favored 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.47 0.481 . . . . 0.0 111.155 -176.968 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -126.61 133.94 50.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 171.865 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -126.84 133.76 50.67 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.525 0.73 . . . . 0.0 109.039 -176.075 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.9 tp -94.66 126.26 39.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -116.5 108.7 16.33 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.1 t -105.83 114.87 46.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.237 -176.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -83.3 156.08 23.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 176.62 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -128.18 111.48 13.48 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 172.145 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.9 m -130.11 158.72 38.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.576 0.547 . . . . 0.0 111.453 -173.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.9 m -67.06 -47.3 71.7 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.71 0.767 . . . . 0.0 109.051 -179.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -148.48 174.39 12.13 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.012 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.55 145.32 29.73 Favored Pre-proline 0 C--N 1.313 -0.992 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.798 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 146.25 97.48 Favored 'Trans proline' 0 C--N 1.346 0.43 0 O-C-N 122.246 0.603 . . . . 0.0 112.759 176.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.9 m -81.8 -21.61 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -86.68 83.3 7.62 Favored 'General case' 0 C--O 1.216 -0.667 0 O-C-N 121.986 -0.446 . . . . 0.0 110.906 -177.618 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 t0 14.81 78.9 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 116.996 2.221 . . . . 0.0 116.996 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -90.08 -13.63 35.45 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.326 -1.306 . . . . 0.0 109.995 177.752 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -65.49 -31.3 72.3 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 107.535 -1.284 . . . . 0.0 107.535 -179.133 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 tp10 -59.24 -34.76 72.6 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 173.835 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.0 mm -71.2 -40.09 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.847 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.91 -22.2 65.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 111.256 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -87.97 0.47 55.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -125.99 130.27 50.87 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.953 0.882 . . . . 0.0 113.064 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.0 m -74.37 128.88 36.66 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 173.766 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -82.91 124.29 30.21 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.38 129.09 45.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.624 0.726 . . . . 0.0 109.537 178.959 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -143.1 122.74 13.29 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.5 179.868 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.09 -112.7 5.21 Favored Glycine 0 C--O 1.225 -0.418 0 N-CA-C 108.8 -1.72 . . . . 0.0 108.8 -178.813 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 9.7 t -122.87 22.67 9.62 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-O 121.722 0.772 . . . . 0.0 109.641 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.24 156.72 5.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.521 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 31.5 t -138.51 127.96 24.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 103.657 -2.72 . . . . 0.0 103.657 178.114 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.98 136.5 58.72 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-O 122.296 1.046 . . . . 0.0 109.223 179.12 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -112.3 114.96 50.32 Favored Pre-proline 0 N--CA 1.429 -1.5 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.939 -177.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -79.56 151.69 22.56 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 116.701 -1.733 . . . . 0.0 112.204 178.269 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 149.74 29.85 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 102.639 -3.097 . . . . 0.0 102.639 174.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 tt -149.43 122.29 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 118.431 0.559 . . . . 0.0 109.63 -176.732 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.7 t -95.32 110.36 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 177.704 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.63 136.23 37.44 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 178.778 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.43 -25.46 57.91 Favored Glycine 0 C--O 1.229 -0.211 0 CA-C-N 116.359 -0.382 . . . . 0.0 113.99 -177.396 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -58.0 -30.4 66.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.829 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -139.19 25.14 2.49 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.315 0.579 . . . . 0.0 110.292 -177.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.5 tt -44.41 -37.63 3.53 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -174.541 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -56.93 -49.36 75.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.845 0.748 . . . . 0.0 111.772 -178.976 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -78.66 -39.24 37.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 122.362 1.077 . . . . 0.0 111.141 178.735 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -63.35 -38.14 90.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.776 -175.268 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -66.59 -48.36 69.81 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.006 -0.434 . . . . 0.0 110.18 -178.628 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -69.35 -17.04 63.66 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.961 -176.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.87 62.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.695 -0.23 . . . . 0.0 110.929 178.723 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 p -109.06 -37.32 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 120.794 0.33 . . . . 0.0 111.137 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.38 80.5 72.04 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 121.954 -0.466 . . . . 0.0 111.247 178.963 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -71.29 0.29 6.98 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 114.294 0.844 . . . . 0.0 114.294 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 42.8 p -82.4 -2.63 53.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.166 0.508 . . . . 0.0 110.942 177.622 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -70.5 120.57 16.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.442 0.639 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.9 ttt85 -84.09 102.79 12.8 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.352 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.5 p -62.28 -23.2 66.58 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.162 0.506 . . . . 0.0 111.875 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -65.27 -28.56 69.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.005 0.431 . . . . 0.0 111.491 177.74 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -81.52 -1.76 47.35 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.511 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.3 t -132.84 51.42 2.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.5 -175.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 87.7 p -68.29 162.73 24.5 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 177.528 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -61.58 -26.1 67.75 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -176.694 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -63.71 -30.21 71.34 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.708 0.766 . . . . 0.0 110.619 177.771 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -95.07 -2.67 49.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.334 -177.338 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.31 32.19 0.45 Allowed 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.928 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.7 t -82.8 151.21 26.2 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.74 -0.6 . . . . 0.0 109.859 177.714 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -65.83 -31.19 72.01 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 179.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -68.84 -26.46 65.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.432 0.634 . . . . 0.0 110.901 -178.11 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -68.89 -23.28 64.18 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.974 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.47 -43.74 71.96 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.12 -31.33 65.92 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.698 -179.395 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 76.6 mtp -70.51 -28.93 65.34 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.733 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.01 72.05 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.872 -0.517 . . . . 0.0 110.241 177.556 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -67.07 -44.67 79.52 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -65.06 -40.24 94.41 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.763 0.792 . . . . 0.0 109.57 -178.98 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -58.85 -44.62 91.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.195 177.295 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -68.35 -43.33 77.7 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 178.994 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.3 mt -63.28 -34.88 78.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.865 0.364 . . . . 0.0 110.042 -179.367 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 26.2 m -72.72 -38.57 67.43 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.516 0.674 . . . . 0.0 110.166 175.526 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.6 tt -64.75 -39.11 93.07 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.121 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.88 -42.93 90.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 119.056 0.843 . . . . 0.0 111.561 -177.607 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -72.87 -31.41 64.71 Favored 'General case' 0 C--O 1.217 -0.62 0 O-C-N 121.372 -0.83 . . . . 0.0 108.861 178.323 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -64.3 -36.14 83.14 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 176.526 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -67.56 -35.02 78.23 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.509 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -68.34 -36.94 80.01 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.53 0.681 . . . . 0.0 109.226 178.173 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -66.48 -37.46 85.15 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.458 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -61.61 -46.89 87.89 Favored 'General case' 0 C--O 1.211 -0.926 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.53 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -56.51 -34.85 67.39 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.587 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -67.07 -51.97 47.95 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.092 -0.38 . . . . 0.0 110.911 177.22 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 14.7 t -72.3 -19.58 61.65 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 -179.478 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.61 -24.36 65.44 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.591 0.757 . . . . 0.0 112.25 179.386 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.52 -14.22 39.48 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 176.72 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.92 146.61 43.84 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 176.702 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 23.4 t -73.55 96.79 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -178.809 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.18 179.99 7.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.43 -177.804 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -150.89 160.42 43.91 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -156.96 142.99 17.92 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.283 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -159.92 27.96 0.35 Allowed Glycine 0 C--O 1.228 -0.262 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 177.518 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -82.4 86.83 6.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.096 0.474 . . . . 0.0 111.818 -175.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 56.5 tp -67.83 -40.87 83.71 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.417 179.125 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 54.07 33.83 18.58 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 179.301 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -138.13 104.57 5.26 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 175.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -140.92 -171.75 3.32 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -177.338 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 36.0 t30 56.6 37.37 28.76 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 177.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.29 166.09 14.55 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 175.072 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -149.53 164.45 35.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -175.468 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -159.31 166.45 31.19 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 103.715 -2.698 . . . . 0.0 103.715 177.687 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 . . . . . 0 C--O 1.243 0.742 0 N-CA-C 104.649 -2.352 . . . . 0.0 104.649 179.405 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.2 mtp . . . . . 0 N--CA 1.484 1.244 0 CA-C-O 119.9 -0.095 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -69.14 138.63 54.35 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -56.98 -32.07 65.7 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 120.888 0.375 . . . . 0.0 110.414 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 78.0 mt -53.74 -35.23 60.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 179.091 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -61.34 -28.89 69.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.662 0.268 . . . . 0.0 110.734 -178.215 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -60.31 -55.1 37.81 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -41.34 68.69 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.921 -179.484 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -56.23 -55.76 29.24 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -177.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -69.83 -30.85 68.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -176.747 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -75.43 -25.76 57.76 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.183 -1.007 . . . . 0.0 112.038 178.158 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mm -73.13 -39.13 56.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 174.686 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.64 85.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.043 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.68 80.68 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.472 177.45 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -57.09 -43.88 82.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.582 -179.407 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -65.2 -44.71 87.52 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 0.0 110.133 179.177 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.91 -40.06 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.711 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -66.06 -29.17 69.46 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.636 -0.665 . . . . 0.0 110.346 179.492 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t -76.07 3.71 9.91 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.637 0.375 . . . . 0.0 111.574 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.28 -0.15 59.96 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 115.138 0.815 . . . . 0.0 115.138 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -67.22 125.77 27.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.044 0.922 . . . . 0.0 109.131 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.53 124.46 8.11 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.519 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -75.8 124.52 34.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.098 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.8 mt -90.06 -41.52 13.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -177.447 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -147.82 123.34 10.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.542 -177.475 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 139.84 35.79 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 174.198 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 146.09 -31.4 1.58 Allowed Glycine 0 CA--C 1.505 -0.554 0 N-CA-C 107.408 -2.277 . . . . 0.0 107.408 179.135 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -65.72 154.5 38.78 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 175.094 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.4 p -88.76 -19.22 26.31 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.761 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -133.41 4.52 3.69 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -172.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.12 138.36 31.58 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 117.937 0.335 . . . . 0.0 110.567 178.687 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -140.12 132.7 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 176.624 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -109.03 135.33 50.37 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 178.602 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -129.43 137.21 50.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 124.067 0.947 . . . . 0.0 109.19 -176.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -101.24 137.3 39.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 176.911 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.05 106.42 7.91 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.836 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.45 -28.57 26.57 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 117.049 -1.501 . . . . 0.0 114.646 -176.362 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -78.01 -1.81 34.02 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.579 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.7 mtmt 58.28 43.31 20.38 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.1 m -64.56 -177.63 0.33 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.328 -1.76 . . . . 0.0 113.098 -178.651 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -41.43 -26.98 0.07 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 178.178 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -130.17 135.69 48.45 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.827 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -70.41 -37.7 74.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.412 0.625 . . . . 0.0 110.858 -178.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.9 mt -137.68 157.37 46.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.003 -177.607 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.44 137.18 53.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 176.682 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.03 135.95 49.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 173.118 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -102.1 132.88 47.71 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 179.338 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.35 115.78 12.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -179.187 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -86.8 96.37 10.17 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.881 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -147.34 128.79 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.663 0.744 . . . . 0.0 111.67 -176.606 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.13 147.25 36.68 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 125.081 1.352 . . . . 0.0 108.769 175.263 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.6 mt -143.8 118.2 9.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -177.282 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -87.43 -43.73 11.86 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 122.077 0.942 . . . . 0.0 111.467 -179.58 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -127.34 148.76 50.25 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.04 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 38.2 ptt180 -65.05 -16.0 62.97 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.307 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -63.05 -33.55 75.67 Favored 'General case' 0 C--O 1.216 -0.68 0 C-N-CA 119.702 -0.799 . . . . 0.0 109.675 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -77.57 -31.86 53.41 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 121.602 -0.687 . . . . 0.0 109.883 176.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.8 ttt -62.44 -51.84 65.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.372 178.008 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.8 m -61.07 -36.3 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-O 120.718 0.294 . . . . 0.0 111.59 179.849 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.5 -38.44 89.89 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.169 -177.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -59.47 -45.18 92.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.212 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mp -73.16 -34.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.753 -0.592 . . . . 0.0 111.534 -178.318 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -59.23 -35.8 74.3 Favored 'General case' 0 C--O 1.244 0.803 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -45.64 29.99 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.657 178.825 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -55.2 -41.51 72.07 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.285 179.346 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.5 73.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 122.201 -0.312 . . . . 0.0 111.705 -178.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -73.16 -36.09 66.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.742 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -44.76 95.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 175.852 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.61 -36.04 72.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -60.42 -40.18 90.08 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.321 -0.862 . . . . 0.0 109.68 176.994 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -67.64 -33.64 75.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.486 178.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.2 t -73.87 -47.97 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 122.299 -0.251 . . . . 0.0 111.431 177.678 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -62.22 -30.36 71.03 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.618 -0.677 . . . . 0.0 111.781 -177.912 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -59.46 -45.62 91.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -73.3 -42.39 62.46 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 179.563 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.3 mp -78.35 -18.08 55.63 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 -175.256 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.34 9.25 60.68 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 116.751 1.46 . . . . 0.0 116.751 177.176 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -69.99 141.68 52.92 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.202 1.001 . . . . 0.0 109.03 -178.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.19 -34.73 77.0 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -174.874 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -144.37 161.86 37.92 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 101.837 -3.394 . . . . 0.0 101.837 176.545 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.3 mmm -135.69 112.54 10.22 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 123.552 0.533 . . . . 0.0 109.799 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -93.72 132.25 38.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.855 177.484 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -128.06 121.83 30.63 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.6 tp -89.52 121.61 31.9 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.469 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -112.04 113.29 25.49 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.0 t -112.76 106.27 20.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-O 121.253 0.549 . . . . 0.0 111.301 -178.724 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -74.6 152.06 39.3 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.597 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -128.48 109.01 11.01 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.436 -1.69 . . . . 0.0 106.436 172.623 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 89.2 p -131.88 164.96 24.94 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.196 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 t -77.48 -29.01 52.42 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.674 -0.641 . . . . 0.0 109.55 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -152.59 165.52 34.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 179.714 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.95 154.61 40.74 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.534 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -57.03 145.31 86.44 Favored 'Trans proline' 0 C--N 1.351 0.66 0 N-CA-C 114.829 1.05 . . . . 0.0 114.829 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.3 m -77.62 -21.37 13.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.223 0.535 . . . . 0.0 111.331 -179.693 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -90.85 99.12 12.21 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.972 179.571 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 14.72 58.8 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 176.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -68.34 -18.72 64.56 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.446 0.641 . . . . 0.0 110.486 179.044 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.74 -36.36 82.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.884 -177.467 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -37.67 74.11 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.614 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.3 mm -66.55 -39.99 85.27 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.604 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.267 -178.205 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.15 -23.92 65.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.514 0.674 . . . . 0.0 110.987 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.6 mtmt -94.9 6.16 49.83 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.773 179.295 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -118.94 95.94 5.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -176.833 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -68.34 124.97 24.97 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.515 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -85.72 107.44 17.59 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.944 0.878 . . . . 0.0 109.83 -178.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -99.53 123.53 43.88 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.824 -1.08 . . . . 0.0 108.662 -178.578 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -130.17 75.4 1.65 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -178.775 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.38 -112.68 3.7 Favored Glycine 0 C--O 1.223 -0.574 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -178.334 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.7 p -83.04 -20.82 34.27 Favored 'General case' 0 C--N 1.322 -0.59 0 O-C-N 122.217 -0.578 . . . . 0.0 110.367 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 53.1 t -74.92 140.62 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.9 m -130.79 112.85 13.42 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 171.081 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 54.1 t -106.29 129.65 59.26 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.504 0 O-C-N 121.527 -0.733 . . . . 0.0 110.222 178.866 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.64 104.0 22.01 Favored Pre-proline 0 N--CA 1.435 -1.22 0 CA-C-N 113.995 -1.457 . . . . 0.0 108.039 178.458 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -78.24 142.91 19.48 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 116.721 -1.719 . . . . 0.0 112.13 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 153.28 38.42 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 178.05 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.6 tt -146.86 123.57 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.143 0.497 . . . . 0.0 109.766 -177.334 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 1.9 t -89.87 126.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 104.098 -2.556 . . . . 0.0 104.098 174.592 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.61 136.27 54.45 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 175.907 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -22.44 66.38 Favored Glycine 0 C--O 1.227 -0.298 0 C-N-CA 121.178 -0.534 . . . . 0.0 113.899 -176.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.7 p -57.35 -26.74 61.44 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -177.253 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.5 ptm -141.16 30.58 1.78 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.546 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -44.37 -42.45 6.88 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 116.417 2.006 . . . . 0.0 116.417 -171.612 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -58.56 -51.33 70.34 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.685 -0.634 . . . . 0.0 112.395 -178.366 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -75.22 -33.06 61.33 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.582 0.706 . . . . 0.0 111.334 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -72.08 -42.02 66.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.998 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 20.8 tp -64.27 -41.81 96.75 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 121.717 -0.615 . . . . 0.0 111.272 -176.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.63 -13.31 60.33 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.648 -178.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.317 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.0 t -91.64 -40.35 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 121.33 0.586 . . . . 0.0 110.234 179.096 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -123.02 77.21 50.86 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.602 -179.398 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.25 -13.86 38.94 Favored 'Trans proline' 0 C--N 1.348 0.543 0 N-CA-C 114.127 0.78 . . . . 0.0 114.127 -177.841 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.5 m -77.83 -7.22 56.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.719 0.295 . . . . 0.0 111.57 177.308 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -99.4 132.98 44.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.236 0.541 . . . . 0.0 110.674 -178.736 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -84.41 105.76 15.48 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.824 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 16.8 p -68.66 -26.69 65.45 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -177.744 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -73.07 -24.43 60.67 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 122.104 -0.373 . . . . 0.0 111.349 178.743 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -67.49 -30.47 70.16 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 122.083 0.944 . . . . 0.0 111.399 179.09 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 73.8 m -139.57 50.91 1.76 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.652 -174.189 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 23.1 m -64.6 159.94 20.78 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.098 0.475 . . . . 0.0 112.04 -178.746 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -61.49 -35.74 78.53 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.955 -176.193 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -65.92 -11.81 50.03 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 178.735 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -97.88 -4.82 35.82 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.711 0.767 . . . . 0.0 110.537 177.472 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -81.13 167.34 19.8 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.645 0.736 . . . . 0.0 110.79 -178.741 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 13.4 t -160.06 155.65 25.62 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 178.286 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -58.81 -37.25 75.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.783 0.801 . . . . 0.0 109.509 179.0 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -72.54 -47.12 50.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.098 179.663 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -60.67 -32.51 71.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.524 0.678 . . . . 0.0 109.417 -178.489 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.29 -44.93 93.64 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 179.192 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.76 -31.33 56.99 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.465 -179.42 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.3 mmt -65.3 -28.78 69.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.142 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.89 70.26 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.53 -0.271 . . . . 0.0 111.298 178.401 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -65.52 -51.28 61.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.48 177.694 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.11 -42.12 97.93 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.163 0.982 . . . . 0.0 108.6 -178.211 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -58.9 -40.15 83.64 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.995 178.839 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -64.91 -43.19 93.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.317 0.508 . . . . 0.0 112.063 177.152 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.7 -41.31 98.13 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.346 -179.496 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.6 t -65.86 -38.82 89.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 0.0 110.466 177.423 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.31 -45.92 92.45 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 123.103 0.561 . . . . 0.0 110.908 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 56.0 t -56.79 -50.12 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -65.07 -39.37 93.14 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.965 0.412 . . . . 0.0 110.497 -178.662 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -64.75 -33.93 77.14 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.667 -0.646 . . . . 0.0 112.502 179.927 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -59.99 -23.81 63.94 Favored 'General case' 0 C--O 1.21 -1.005 0 C-N-CA 120.26 -0.576 . . . . 0.0 111.605 179.478 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -63.76 -39.48 94.37 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 178.581 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.62 -44.73 70.07 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 177.402 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -66.79 -53.17 35.63 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -176.1 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -67.45 -27.35 66.96 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -174.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 17.6 ttpp -63.18 -45.8 90.1 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 175.805 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 14.7 m -72.36 -45.43 59.87 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.363 -178.679 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -66.37 -24.47 66.5 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.653 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -75.69 -14.06 60.33 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 178.167 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.47 145.14 45.91 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 174.177 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 13.2 m 32.66 64.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.97 1 N-CA-C 121.949 4.055 . . . . 0.0 121.949 170.567 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -114.4 14.81 17.98 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 121.086 -1.009 . . . . 0.0 112.236 -178.744 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 62.24 -136.86 0.48 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.911 -175.748 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -152.99 151.75 30.64 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.9 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 157.84 128.8 1.05 Allowed Glycine 0 C--O 1.226 -0.354 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 177.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -159.48 151.56 20.8 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 179.206 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 2.1 pp -154.79 163.29 40.48 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 176.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 68.7 tt0 -147.62 164.53 33.2 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 104.106 -2.553 . . . . 0.0 104.106 177.677 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.32 135.65 35.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 118.025 0.375 . . . . 0.0 110.011 -177.305 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -146.02 173.36 12.23 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 175.505 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -150.76 145.35 25.69 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 173.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 2.2 tt -146.59 150.86 36.31 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -177.736 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -154.31 171.99 18.39 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 -179.672 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -151.64 156.45 40.43 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 104.965 -2.235 . . . . 0.0 104.965 179.402 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 . . . . . 0 C--O 1.244 0.763 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -177.958 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 mmt . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.005 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 54.69 34.26 21.21 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 123.82 0.7 . . . . 0.0 111.242 -178.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pp -61.87 -32.21 72.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.577 0.703 . . . . 0.0 111.1 -177.106 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.78 -35.2 64.93 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.306 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -65.78 -29.33 69.81 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.364 0.602 . . . . 0.0 110.272 -176.924 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -62.23 -45.16 94.6 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.196 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 m -70.54 -40.31 73.5 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.302 178.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -55.35 -51.15 67.72 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.018 0.927 . . . . 0.0 111.082 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.664 -0.647 . . . . 0.0 111.769 178.659 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 55.6 mttt -66.71 -37.56 84.95 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.855 -0.528 . . . . 0.0 110.955 176.665 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 mm -71.19 -39.35 73.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.009 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.32 -44.58 80.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.51 -47.24 79.61 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.56 178.018 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 34.8 t60 -55.46 -45.56 76.89 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.683 0.393 . . . . 0.0 111.415 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.7 mt -70.44 -47.89 58.57 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.588 -178.839 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.85 -40.29 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-N 118.422 0.556 . . . . 0.0 109.983 175.639 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -64.17 -27.22 68.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.147 -0.346 . . . . 0.0 111.511 179.151 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 m -86.62 10.25 16.14 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 177.971 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.85 0.28 58.98 Favored Glycine 0 C--O 1.229 -0.159 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 175.602 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -67.81 129.25 39.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.311 1.056 . . . . 0.0 109.748 178.611 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.17 109.41 2.98 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 179.318 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.8 p -70.32 129.15 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.192 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 85.9 mt -94.89 -47.11 13.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.773 -1.103 . . . . 0.0 108.358 -177.321 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -142.36 139.95 31.92 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 -177.226 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -137.52 124.4 21.3 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.111 0.414 . . . . 0.0 110.262 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.49 40.11 94.22 Favored Glycine 0 C--O 1.221 -0.707 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 178.217 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -59.49 -35.72 74.66 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 122.356 1.074 . . . . 0.0 109.213 -178.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.8 t -166.84 -67.68 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 101.287 -3.597 . . . . 0.0 101.287 174.922 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -138.95 15.21 2.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.792 174.984 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -112.92 144.69 42.04 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.674 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 90.8 mt -135.36 127.78 47.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 172.71 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -110.84 133.11 53.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.068 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 mp -131.72 129.69 41.01 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.213 0.605 . . . . 0.0 109.788 -178.383 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -81.43 132.76 35.34 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.491 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.85 117.77 60.82 Favored Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 177.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -72.6 -26.12 16.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 115.892 -2.272 . . . . 0.0 112.807 -175.899 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -72.49 -26.5 61.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.701 -179.859 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.8 mttp 59.24 41.95 19.26 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.646 1.688 . . . . 0.0 108.113 -178.83 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 96.4 p -71.09 -177.61 1.73 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 111.042 -2.799 . . . . 0.0 108.39 176.85 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.2 p -45.85 -26.63 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 176.268 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -101.51 127.19 48.31 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 174.367 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -89.8 -37.7 14.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -178.523 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.9 mt -137.36 161.61 35.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.7 t -127.29 134.53 65.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 31.6 ttt180 -122.46 112.99 18.72 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.79 131.12 35.2 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 175.069 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -136.36 114.67 11.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.217 0.532 . . . . 0.0 111.416 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -82.56 94.71 7.56 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 178.541 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -151.62 136.59 17.31 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.26 146.11 24.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.234 -178.729 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.26 119.35 26.14 Favored 'General case' 0 C--O 1.22 -0.45 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 -177.236 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -79.12 -43.5 23.92 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 122.661 1.219 . . . . 0.0 109.845 178.316 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -127.83 164.67 21.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.87 -178.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -64.21 -15.82 60.75 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.579 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -62.4 -41.37 98.62 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.6 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -66.59 -39.37 88.39 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.7 ttm -63.11 -51.85 64.93 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.396 -178.878 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.87 -31.85 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.641 0.655 . . . . 0.0 112.585 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -68.51 -35.03 76.92 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.667 -178.138 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.72 -41.73 91.5 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.297 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -67.12 -30.88 50.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.077 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -58.45 -40.06 81.58 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.097 179.529 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -76.63 -43.91 36.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.423 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.45 -36.52 69.13 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.934 -178.536 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.17 -40.43 96.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 O-C-N 121.938 -0.476 . . . . 0.0 111.102 179.463 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -76.02 -29.68 58.21 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.313 -0.867 . . . . 0.0 109.638 178.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -60.7 -41.48 95.26 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 173.62 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 45.9 t -64.83 -39.67 86.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.05 177.275 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -54.56 -37.95 66.06 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.779 0.718 . . . . 0.0 111.69 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -61.68 -48.08 82.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.996 179.579 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.3 t -70.63 -41.41 77.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.564 0.697 . . . . 0.0 110.943 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -41.67 93.54 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.971 -0.456 . . . . 0.0 109.942 179.719 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -64.59 -45.82 85.33 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.106 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -58.64 -42.28 87.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.433 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.75 -3.69 58.02 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -179.489 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.68 20.1 67.83 Favored Glycine 0 C--O 1.242 0.615 0 C-N-CA 121.508 -0.377 . . . . 0.0 113.654 179.656 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -73.04 147.84 44.69 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.825 -0.809 . . . . 0.0 110.944 -176.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -69.45 -37.52 77.37 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.47 159.62 39.94 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 171.569 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.9 ttp -134.15 147.19 50.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.745 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -116.0 136.67 52.81 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.4 tp -119.81 134.0 55.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 123.056 0.543 . . . . 0.0 110.699 178.448 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.78 109.85 22.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.066 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -97.71 127.34 43.59 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.053 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.9 t -122.08 109.31 24.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.177 0.513 . . . . 0.0 110.937 179.055 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -81.24 151.83 27.94 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 176.489 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -127.29 107.63 10.16 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 103.61 -2.737 . . . . 0.0 103.61 171.658 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.3 m -127.17 158.65 36.53 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.683 0.614 . . . . 0.0 110.896 -174.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.5 m -67.06 -45.21 78.07 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -177.434 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -146.81 176.74 9.65 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.711 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.19 143.39 29.6 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.395 -0.821 . . . . 0.0 108.874 -176.119 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.71 147.06 73.81 Favored 'Trans proline' 0 C--N 1.35 0.622 0 N-CA-C 114.93 1.088 . . . . 0.0 114.93 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 26.9 m -81.17 -10.23 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 N-CA-C 114.525 1.305 . . . . 0.0 114.525 -177.092 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -112.67 95.77 5.61 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 119.339 -0.362 . . . . 0.0 111.559 -178.378 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.9 t0 14.83 67.33 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 176.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 56.6 p-90 -83.99 -13.99 51.9 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.195 179.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -66.65 -31.48 72.19 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.119 -0.988 . . . . 0.0 111.905 -175.21 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -65.31 -21.74 66.75 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.958 175.615 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 15.5 mm -72.7 -40.48 61.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.931 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.3 -5.03 33.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.983 179.22 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -111.35 3.14 18.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.797 -179.383 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -126.74 128.42 46.62 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.88 0.847 . . . . 0.0 112.142 179.068 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 26.5 m -78.46 126.79 31.26 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 176.819 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -82.64 111.44 18.61 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 177.016 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -118.17 120.99 39.39 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.461 0.648 . . . . 0.0 109.76 -178.392 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -116.69 75.31 0.96 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 178.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.31 -112.7 4.85 Favored Glycine 0 C--O 1.225 -0.466 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.774 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.0 p -81.96 24.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.561 0.744 . . . . 0.0 112.173 -178.662 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 86.2 t -134.83 140.63 45.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.264 -178.957 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 33.8 t -130.62 126.49 36.78 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 175.67 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.9 t -136.7 136.42 48.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 176.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -125.56 131.33 24.01 Favored Pre-proline 0 C--N 1.317 -0.841 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 175.865 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -84.56 154.73 12.05 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 CA-C-O 122.101 0.792 . . . . 0.0 113.774 -177.61 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.78 150.73 39.0 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 174.438 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.7 tt -146.42 124.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -176.774 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 52.1 t -97.44 115.95 38.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 175.057 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.35 138.17 39.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.061 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.86 -25.88 53.48 Favored Glycine 0 C--O 1.223 -0.591 0 N-CA-C 114.728 0.651 . . . . 0.0 114.728 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.7 p -59.66 -27.2 66.17 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.545 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.8 ptm -143.07 18.42 1.94 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.925 0.869 . . . . 0.0 109.906 -177.831 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tt -42.08 -42.41 2.91 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 118.418 2.747 . . . . 0.0 118.418 -170.613 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -60.79 -51.54 68.91 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 119.562 -0.855 . . . . 0.0 112.278 -174.078 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -78.54 -33.27 48.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 176.301 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -58.86 -32.15 69.18 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.432 1.111 . . . . 0.0 110.818 -178.829 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.63 -36.35 73.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.953 -1.021 . . . . 0.0 113.178 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -75.33 -15.0 60.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -176.269 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.55 -28.56 62.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.163 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 22.7 t -95.56 -41.63 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.858 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -126.22 80.19 68.89 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.33 -178.908 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -67.55 -14.53 42.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 118.08 -0.813 . . . . 0.0 112.774 179.752 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.2 m -75.72 -5.71 46.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.923 176.461 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -99.48 135.5 40.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.706 0.765 . . . . 0.0 110.575 -179.022 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 -69.3 119.78 14.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.344 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 36.7 p -70.36 -20.41 62.97 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.767 -0.583 . . . . 0.0 110.856 178.66 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -81.01 -10.77 59.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.705 0.288 . . . . 0.0 111.226 176.665 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -84.59 -24.62 29.1 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.079 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 14.1 t -87.98 125.46 34.54 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.743 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.7 t -144.32 132.32 21.55 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -176.635 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -68.2 -32.63 73.0 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.551 0.691 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -62.14 -17.26 57.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.634 -179.188 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -117.13 10.93 14.01 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.214 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -95.08 67.86 3.09 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.948 0.88 . . . . 0.0 110.574 -177.505 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 83.3 p -125.06 171.95 9.85 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.886 -178.569 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -66.72 -39.77 88.12 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-O 120.959 0.409 . . . . 0.0 111.703 -177.654 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . 0.512 ' CD ' ' H ' ' A' ' 145' ' ' GLU . 2.0 mp0 -63.02 -39.93 96.23 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.85 0.833 . . . . 0.0 108.801 -179.597 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -71.74 -35.1 70.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.655 178.566 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.49 90.69 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.404 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -62.73 -51.08 68.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 21.5 ptp -65.33 -28.84 69.59 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.353 179.419 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.05 -37.37 85.68 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.456 -0.778 . . . . 0.0 110.034 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 44.5 ttt180 -65.64 -45.86 81.39 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.595 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -65.01 -40.31 94.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.843 0.83 . . . . 0.0 110.316 -178.821 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -64.71 -40.0 94.62 Favored 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.872 178.491 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.34 -41.22 98.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.83 0.348 . . . . 0.0 111.639 176.568 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.8 mt -65.17 -33.13 75.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.043 0.449 . . . . 0.0 109.823 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.05 -34.81 61.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.624 0.726 . . . . 0.0 110.571 175.086 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -65.06 -44.15 89.92 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.639 -178.624 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.7 p -62.16 -36.78 76.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.014 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.24 -50.67 64.92 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.024 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -60.36 -30.13 69.35 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.864 -0.734 . . . . 0.0 112.489 -178.577 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -56.97 -28.57 62.42 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -179.615 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -66.95 -38.1 85.52 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -179.165 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -69.46 -38.49 77.79 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 176.722 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -59.58 -44.11 93.45 Favored 'General case' 0 C--O 1.212 -0.895 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.804 177.695 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -68.95 -34.39 75.27 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.395 0.516 . . . . 0.0 112.395 -178.189 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.25 -37.32 86.88 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.296 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 22.9 m -72.3 -38.77 68.65 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.269 0.557 . . . . 0.0 110.597 178.402 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -58.59 -25.41 62.58 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.708 1.203 . . . . 0.0 112.529 -179.276 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.34 -14.12 54.43 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 178.105 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -123.22 -39.73 2.45 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 179.344 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 12.1 m -90.91 154.05 3.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 122.649 1.214 . . . . 0.0 114.099 -172.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -142.94 164.09 31.01 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 175.854 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -135.47 -16.13 1.84 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 53.9 m-20 53.44 -137.12 1.26 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.127 0.571 . . . . 0.0 109.882 -178.387 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 86.76 179.34 49.09 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 121.205 -0.521 . . . . 0.0 112.152 179.408 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -156.55 136.75 12.85 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 -178.792 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 60.4 tp -153.0 141.67 20.96 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 105.526 -2.028 . . . . 0.0 105.526 176.513 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -161.04 168.34 24.65 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 178.61 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 1.2 ttm105 -154.0 152.89 31.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 179.101 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -139.19 145.99 40.0 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 103.517 -2.772 . . . . 0.0 103.517 175.974 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 52.8 t-20 -151.59 107.29 3.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.952 0.342 . . . . 0.0 111.693 -179.318 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 29.6 tp -133.72 144.51 49.16 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 177.368 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 12.1 p90 -151.34 161.85 41.97 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -174.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -132.28 33.43 3.86 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -178.239 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 . . . . . 0 C--O 1.247 0.97 0 CA-C-N 113.903 -1.499 . . . . 0.0 109.254 -174.784 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.0 mtp . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -59.56 -37.53 78.71 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 -171.801 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.77 -45.41 86.47 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.212 -0.93 . . . . 0.0 108.797 179.441 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.25 -35.3 80.61 Favored 'General case' 0 C--O 1.208 -1.084 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.277 178.507 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -65.14 -42.21 94.03 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 178.575 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 177.484 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -59.12 -43.69 91.97 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.613 -178.216 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -57.26 -52.31 65.84 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 123.073 0.549 . . . . 0.0 110.363 179.906 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -69.3 -33.32 73.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.979 -179.268 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.69 -31.48 69.55 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.683 -0.636 . . . . 0.0 111.018 178.803 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.8 mm -77.06 -39.2 28.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.18 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.1 80.94 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.746 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.09 -45.85 86.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.915 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.95 -47.45 77.57 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.454 0.302 . . . . 0.0 110.623 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 34.4 mt -67.1 -51.03 59.29 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -178.64 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.2 t -57.33 -42.71 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.979 178.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -19.09 65.7 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.351 -0.843 . . . . 0.0 111.814 -179.642 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.4 t -87.53 8.1 26.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.021 0.439 . . . . 0.0 111.046 177.876 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.59 1.24 56.53 Favored Glycine 0 C--O 1.228 -0.266 0 N-CA-C 116.033 1.173 . . . . 0.0 116.033 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.426 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 38.3 m-85 -71.9 110.52 6.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 118.046 0.923 . . . . 0.0 109.018 178.215 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.41 134.48 30.89 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.945 -177.454 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -75.79 125.81 35.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.717 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 45.3 mt -92.22 -43.83 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.014 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -153.41 127.55 9.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.793 175.661 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.21 129.65 24.06 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 174.352 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 158.95 -31.97 0.46 Allowed Glycine 0 CA--C 1.506 -0.493 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 176.206 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -66.22 147.51 53.22 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.599 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.4 m -82.08 -11.87 58.55 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.136 -0.353 . . . . 0.0 111.428 -178.635 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -108.17 -39.38 5.5 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 -173.704 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -136.39 146.97 47.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 178.839 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 83.6 mt -134.92 134.23 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.681 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -110.41 135.57 50.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.0 0.429 . . . . 0.0 111.45 -179.229 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mp -132.37 143.02 49.55 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.105 0.962 . . . . 0.0 109.226 -177.58 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -102.47 135.56 43.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.76 115.62 39.73 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.976 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 93.9 Cg_endo -73.56 -24.43 16.09 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 117.373 -1.285 . . . . 0.0 112.547 -177.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -76.28 -24.45 54.43 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.971 178.78 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.69 42.72 6.09 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -178.378 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 m -59.87 -177.52 0.06 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 112.559 -2.11 . . . . 0.0 115.078 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.4 m -52.98 -28.84 25.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.652 173.603 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.428 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 14.4 p-80 -100.53 140.48 34.74 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 172.101 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -97.42 -43.83 7.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.032 0.444 . . . . 0.0 111.761 -172.818 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 51.1 mt -130.5 158.1 40.86 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.8 t -127.6 136.63 59.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 177.777 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.48 134.26 35.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.871 0.843 . . . . 0.0 109.371 173.032 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -97.55 137.06 37.05 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -178.937 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -136.01 108.81 7.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -175.381 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.22 94.78 6.12 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 179.505 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -151.52 118.88 5.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.342 0.592 . . . . 0.0 111.657 -175.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -87.16 151.48 23.15 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.47 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.3 mt -141.19 143.53 34.25 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.856 -172.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -98.11 -39.46 8.89 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.102 0.477 . . . . 0.0 110.356 176.628 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -133.77 151.09 51.49 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -176.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.437 ' H ' ' HB3' ' A' ' 94' ' ' ASP . 9.3 ptt180 -64.48 -21.13 66.57 Favored 'General case' 0 C--O 1.212 -0.908 0 O-C-N 121.528 -0.733 . . . . 0.0 112.535 179.937 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -61.15 -33.05 72.78 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.914 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -72.49 -45.51 59.12 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.517 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.0 ttt -55.0 -49.03 72.5 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.591 -178.584 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.6 m -65.06 -35.25 75.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.758 178.529 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -71.13 -32.99 69.66 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.214 -177.106 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.4 -38.02 76.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 175.897 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.1 mm -71.58 -30.91 40.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.745 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.89 -40.18 87.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -74.55 -42.7 58.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 178.816 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.22 -43.71 87.82 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.012 -0.43 . . . . 0.0 110.683 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.7 -40.27 84.32 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.633 -178.529 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -64.17 -49.37 72.33 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.294 -0.563 . . . . 0.0 109.59 177.883 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -40.61 95.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.89 -33.33 43.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.675 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -66.74 -38.23 86.24 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -60.32 -43.83 96.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.092 -176.398 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.23 -35.82 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.626 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -30.31 66.51 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.888 -1.133 . . . . 0.0 113.552 -178.542 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -58.18 -31.75 67.59 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.554 179.494 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -20.47 65.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.705 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.01 9.37 34.47 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.927 0.394 . . . . 0.0 110.195 177.503 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.79 29.19 71.56 Favored Glycine 0 C--O 1.236 0.24 0 N-CA-C 115.754 1.062 . . . . 0.0 115.754 175.81 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 38.2 ttt85 -69.89 128.29 35.87 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 121.728 -0.866 . . . . 0.0 108.678 -178.819 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.73 -36.16 82.95 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.326 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.22 149.17 29.82 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 176.932 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -120.66 147.98 44.53 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.66 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -134.96 117.47 15.83 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.257 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 tp -112.89 128.31 56.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.13 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -94.26 104.1 16.11 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 174.232 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -101.85 128.48 48.2 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.319 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.6 t -123.48 109.38 23.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.316 176.551 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -72.9 141.91 47.88 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 175.247 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -118.27 103.75 10.12 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 174.261 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 83.5 p -123.07 158.74 29.97 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.991 0.424 . . . . 0.0 110.557 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -75.94 -28.87 58.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 121.482 -0.761 . . . . 0.0 108.999 -179.335 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -155.32 166.61 33.01 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 177.247 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.18 150.31 43.0 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 110.507 -0.183 . . . . 0.0 110.507 -176.008 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.87 145.23 85.49 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 118.03 -0.847 . . . . 0.0 112.046 177.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 m -76.25 -19.74 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -172.56 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.437 ' HB3' ' H ' ' A' ' 54' ' ' ARG . 43.7 t0 -84.31 87.43 7.2 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-O 119.484 -0.293 . . . . 0.0 111.333 -177.526 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 27.56 48.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 118.041 2.608 . . . . 0.0 118.041 176.221 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 34.1 p-90 -62.06 -20.21 63.74 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.03 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -61.03 -31.23 70.86 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.841 -0.537 . . . . 0.0 110.356 -179.253 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -60.03 -35.19 74.56 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.744 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.7 mm -72.45 -43.52 63.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.94 -176.06 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.33 64.52 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.755 -0.591 . . . . 0.0 112.244 -178.525 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -101.92 17.06 24.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -131.02 104.25 7.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.601 -176.507 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.0 m -68.25 125.9 27.87 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.355 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -82.71 127.79 33.75 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 179.255 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -126.03 133.06 51.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.795 0.807 . . . . 0.0 111.311 179.351 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -142.26 111.47 6.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.441 -1.254 . . . . 0.0 108.08 178.354 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.75 -115.94 8.26 Favored Glycine 0 C--N 1.322 -0.195 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.091 179.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 60.7 p -87.46 -12.61 45.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.442 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.6 t -94.1 141.33 15.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -174.163 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.3 m -120.76 138.45 54.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 167.234 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 25.2 t -132.39 134.03 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -96.09 114.48 64.28 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 176.818 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -84.28 59.63 5.97 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 121.987 1.792 . . . . 0.0 114.209 -177.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.33 153.01 44.27 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.88 -178.328 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.7 tt -147.46 135.43 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.0 m -112.18 132.72 60.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.2 141.17 50.16 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -176.307 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.1 -26.44 55.82 Favored Glycine 0 C--O 1.227 -0.283 0 N-CA-C 114.808 0.683 . . . . 0.0 114.808 -176.559 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.0 p -55.3 -29.6 58.54 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -179.345 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.7 ptm -141.63 26.49 1.93 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.348 0.594 . . . . 0.0 110.298 -178.025 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 12.1 tp -45.35 -37.75 5.2 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 119.328 3.084 . . . . 0.0 119.328 -169.301 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -65.98 -43.37 88.01 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.301 0.955 . . . . 0.0 110.778 -179.235 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -73.7 -36.0 65.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 122.218 1.009 . . . . 0.0 109.495 178.562 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -62.81 -42.72 99.84 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 11.2 mt -62.13 -43.93 97.76 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -75.07 -15.24 60.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.355 -177.311 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.61 -40.85 48.13 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.232 -0.292 . . . . 0.0 110.716 178.123 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 12.2 p -92.25 -32.91 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 120.995 0.426 . . . . 0.0 111.252 179.975 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -127.24 80.67 71.29 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.396 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -65.5 -11.84 32.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 N-CA-C 114.694 0.998 . . . . 0.0 114.694 -177.704 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.9 m -77.97 -2.85 38.97 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.123 -0.361 . . . . 0.0 111.666 176.332 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -77.0 127.43 32.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.596 0.712 . . . . 0.0 111.85 -179.1 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 59.9 mtt180 -88.7 97.1 10.94 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.701 178.795 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.5 t -80.09 -16.6 54.66 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.25 178.193 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -73.92 -36.17 64.67 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 179.155 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -59.21 -29.67 67.67 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -177.792 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 65.0 m 62.04 176.81 0.13 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.962 0.905 . . . . 0.0 111.513 -176.219 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 66.9 m -154.6 173.9 15.71 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.207 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.4 -18.63 18.72 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 179.774 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -58.78 -23.53 60.34 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.854 0.359 . . . . 0.0 111.933 177.572 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 -81.04 -7.31 59.53 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.731 0.3 . . . . 0.0 111.161 -179.06 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -101.52 -52.96 3.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.112 -179.334 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 63.0 m -151.01 150.19 30.47 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 121.695 0.76 . . . . 0.0 112.583 179.401 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -66.64 -28.76 68.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.829 178.978 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -62.01 -26.34 68.18 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.379 0.609 . . . . 0.0 111.786 -177.723 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -56.91 -22.54 38.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.751 178.253 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -32.49 57.53 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.96 -0.463 . . . . 0.0 111.759 178.43 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -62.99 -41.05 99.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.635 0.731 . . . . 0.0 109.41 177.959 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtp -70.84 -29.01 65.03 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.567 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.36 -40.42 95.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.164 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.2 ttt180 -63.43 -46.63 85.45 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.94 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -59.43 -42.7 92.47 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.301 0.572 . . . . 0.0 110.317 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -58.73 -44.68 90.52 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.951 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -65.9 -46.2 79.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 179.171 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.7 -41.51 86.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.219 0.533 . . . . 0.0 109.667 -178.156 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.7 m -69.76 -35.73 75.18 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.418 178.585 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.7 tt -65.47 -39.44 91.97 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -177.126 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 88.7 t -53.68 -54.01 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.586 0.63 . . . . 0.0 112.696 -174.715 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.88 -38.7 64.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.342 0.592 . . . . 0.0 109.833 -179.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -58.8 -29.76 67.09 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.577 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -55.07 -30.49 59.75 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.49 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -65.48 -38.44 89.79 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 120.992 0.425 . . . . 0.0 110.76 -179.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -77.04 -34.39 57.26 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.639 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -61.63 -43.45 98.83 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.994 -0.441 . . . . 0.0 110.426 179.508 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -71.63 -23.15 61.65 Favored 'General case' 0 C--O 1.217 -0.614 0 O-C-N 121.923 -0.485 . . . . 0.0 111.299 177.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.7 -21.41 62.57 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 121.435 0.636 . . . . 0.0 111.406 178.649 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -63.46 -9.86 14.74 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 175.75 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -47.23 -29.79 2.61 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.883 2.179 . . . . 0.0 116.883 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.24 -22.81 67.08 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.102 0.477 . . . . 0.0 111.872 178.242 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -86.73 96.94 10.33 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 4.8 t -64.85 99.92 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.302 -178.932 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -152.78 170.26 20.74 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -176.873 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -154.9 -34.01 0.1 Allowed 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.076 178.229 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 21.6 t30 61.78 20.32 11.3 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.71 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 76.73 -158.24 48.36 Favored Glycine 0 C--O 1.223 -0.551 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.043 179.185 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -152.16 -29.51 0.16 Allowed 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.593 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 63.33 5.93 2.23 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 179.175 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -62.78 128.5 36.23 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.57 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.6 ttp85 -158.69 89.58 0.96 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -176.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -142.34 154.93 45.09 Favored 'General case' 0 C--N 1.32 -0.676 0 O-C-N 122.028 -0.42 . . . . 0.0 111.269 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -169.79 125.46 0.83 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 177.219 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 26.3 tp -156.76 152.47 27.01 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.341 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -160.52 169.85 22.14 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 179.727 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -137.18 150.19 47.75 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 177.177 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 . . . . . 0 C--O 1.245 0.818 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 -178.881 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.455 ' H3 ' ' HB2' ' A' ' 147' ' ' ALA . 94.9 mmm . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 119.515 -0.279 . . . . 0.0 111.421 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -78.08 151.19 33.55 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.033 0.833 . . . . 0.0 108.893 179.934 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.8 tt -65.89 -36.47 83.5 Favored 'General case' 0 C--O 1.218 -0.573 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 175.019 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.79 -35.3 80.31 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.315 179.255 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.14 -32.15 70.75 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.149 0.5 . . . . 0.0 109.793 -179.817 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.78 -54.47 38.54 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.6 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' THR . . . . . 0.408 ' HG1' HD13 ' A' ' 121' ' ' LEU . 6.8 m -64.17 -38.13 89.96 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.196 0.522 . . . . 0.0 111.381 -179.646 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -56.23 -52.98 62.47 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.46 0.704 . . . . 0.0 110.538 178.234 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -70.72 -28.09 64.46 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.211 -0.931 . . . . 0.0 111.744 179.094 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -65.26 -43.43 91.33 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 176.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.0 mm -69.28 -38.55 77.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.835 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 -45.18 80.08 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.15 -42.5 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.954 0.407 . . . . 0.0 111.382 178.98 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -60.15 -46.81 88.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.399 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 mt -65.1 -53.52 44.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.86 0.362 . . . . 0.0 111.132 -179.911 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.6 t -59.41 -43.57 90.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.465 -175.226 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -14.2 62.71 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.513 -0.742 . . . . 0.0 112.592 -179.385 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.9 m -89.71 1.49 56.0 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 177.914 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.05 -3.0 27.04 Favored Glycine 0 C--O 1.224 -0.48 0 N-CA-C 115.588 0.995 . . . . 0.0 115.588 176.806 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -67.35 118.33 10.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 118.284 1.042 . . . . 0.0 109.427 178.571 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.64 133.95 14.52 Favored Glycine 0 C--O 1.226 -0.403 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -177.727 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.4 t -77.1 132.62 32.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.34 0.591 . . . . 0.0 110.154 179.457 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 53.7 mt -105.5 -48.51 9.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 174.436 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -141.64 116.2 9.63 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.09 129.03 23.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 118.25 0.477 . . . . 0.0 111.597 178.19 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 125.97 -17.62 6.72 Favored Glycine 0 CA--C 1.51 -0.25 0 C-N-CA 121.12 -0.562 . . . . 0.0 112.645 176.778 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -22.16 63.59 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.69 0.396 . . . . 0.0 111.394 -179.647 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.8 m 72.78 -28.94 0.19 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.526 1.53 . . . . 0.0 114.595 176.223 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -80.69 -53.01 6.9 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 172.822 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -116.66 151.9 35.36 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.365 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.8 mt -137.62 126.48 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 104.597 -2.372 . . . . 0.0 104.597 165.082 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -108.09 125.48 51.63 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.427 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.71 135.24 54.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.821 -177.874 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -84.88 132.95 34.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 175.238 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.11 124.95 91.87 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.259 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -74.52 -23.67 14.68 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 116.591 -1.806 . . . . 0.0 112.486 -179.79 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -67.96 -37.24 81.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.792 -178.633 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.7 mttt 59.07 28.13 17.3 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 123.548 1.642 . . . . 0.0 109.858 -176.073 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -77.38 -173.13 2.75 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 110.871 -2.877 . . . . 0.0 108.5 173.802 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.48 -28.84 0.14 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 117.418 2.377 . . . . 0.0 117.418 -174.576 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.496 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 11.6 p80 -107.69 131.54 54.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.004 1.275 . . . . 0.0 108.709 169.871 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -87.12 -39.79 15.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.837 -1.529 . . . . 0.0 111.582 -172.267 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.3 mt -135.37 164.08 28.58 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.333 -178.6 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 96.6 t -128.68 136.76 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 175.678 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -120.95 116.48 25.19 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -93.68 130.08 39.76 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 175.459 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -136.2 124.39 23.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -174.92 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.87 94.87 5.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.213 0.53 . . . . 0.0 110.076 -179.315 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -144.16 141.64 30.07 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.561 -0.904 . . . . 0.0 108.561 178.188 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -99.17 137.0 38.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 -177.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.84 145.59 47.92 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 -174.903 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -107.36 -39.69 5.59 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.172 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -122.47 161.26 23.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.878 179.411 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -66.19 -15.47 63.17 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.095 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.74 -43.15 94.38 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.53 -46.8 88.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.367 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 81.0 mtp -56.64 -51.96 66.7 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.34 -179.426 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.9 m -67.08 -31.84 55.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.325 -175.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.0 mtt-85 -67.53 -43.77 79.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.478 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -58.37 -45.22 88.67 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.602 -179.378 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.419 HG22 ' CD1' ' A' ' 104' ' ' PHE . 2.5 mt -74.12 -34.2 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.313 -0.867 . . . . 0.0 112.067 -177.446 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.33 -37.68 72.92 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 177.321 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -76.62 -46.22 26.91 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.925 179.219 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -55.29 -43.8 75.12 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.244 -178.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.72 -39.68 81.53 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.382 0.537 . . . . 0.0 111.312 -177.518 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.413 ' HB3' HH21 ' A' ' 70' ' ' ARG . 26.1 mt-10 -73.42 -30.23 63.1 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 121.436 -0.79 . . . . 0.0 111.094 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -40.03 78.55 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 174.918 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 73.0 t -65.9 -36.45 77.54 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.731 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -54.35 -38.72 66.4 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.902 0.774 . . . . 0.0 111.69 178.726 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.413 HH21 ' HB3' ' A' ' 66' ' ' GLU . 6.8 mmt180 -67.31 -43.27 82.1 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.847 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.76 -42.89 90.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.78 -44.34 86.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 123.101 0.56 . . . . 0.0 109.999 178.573 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -65.61 -42.22 91.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.656 0.265 . . . . 0.0 110.467 179.605 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -62.54 -40.59 97.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 0.0 111.161 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.94 0.97 41.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -179.929 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.31 22.59 71.17 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 114.24 0.456 . . . . 0.0 114.24 178.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -76.68 140.25 40.82 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.972 -0.722 . . . . 0.0 110.8 -176.931 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.64 -35.72 62.88 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 178.869 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -150.65 162.37 40.79 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 102.631 -3.1 . . . . 0.0 102.631 176.399 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.6 mtp -137.31 152.93 50.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.496 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.496 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 7.0 tttp -129.75 133.7 47.17 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 176.588 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.23 125.44 34.88 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.387 0.43 . . . . 0.0 110.588 -174.571 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.8 tp -88.04 107.81 18.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 176.601 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -101.96 128.65 48.28 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.3 t -121.31 110.0 26.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 117.945 0.338 . . . . 0.0 111.232 178.443 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -75.04 149.41 39.22 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.785 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -128.79 103.67 7.19 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 174.351 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 88.8 p -130.24 150.57 51.43 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.84 0.352 . . . . 0.0 111.823 -175.946 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -67.08 -29.36 69.11 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -178.083 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -138.61 167.4 22.02 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 -178.099 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.13 144.02 27.37 Favored Pre-proline 0 C--N 1.318 -0.787 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 177.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.47 149.47 66.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 114.802 1.039 . . . . 0.0 114.802 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 15.1 m -76.64 -15.34 14.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 117.209 2.3 . . . . 0.0 117.209 -174.71 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -123.73 98.31 5.76 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -176.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.4 t0 38.07 50.02 1.3 Allowed 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 170.924 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . 0.407 ' CZ3' HG22 ' A' ' 115' ' ' ILE . 53.0 p-90 -80.03 -14.39 58.59 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 176.849 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -66.84 -31.79 72.63 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 121.489 -0.757 . . . . 0.0 110.625 -177.439 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.12 -20.66 66.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 109.99 173.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 12.3 mm -79.27 -45.52 23.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.897 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 -179.299 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.03 -24.42 67.48 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.74 0.781 . . . . 0.0 110.184 178.09 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -77.6 -16.11 58.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.373 -179.29 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -113.1 126.58 55.62 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -176.039 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 46.5 m -70.44 126.41 29.57 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 103.496 -2.779 . . . . 0.0 103.496 171.545 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . 0.419 ' CD1' HG22 ' A' ' 61' ' ' ILE . 81.1 t80 -82.82 119.31 24.21 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.012 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -121.73 122.68 40.1 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.912 0.863 . . . . 0.0 109.51 178.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -143.79 129.25 19.01 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.81 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.11 -127.0 32.21 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 107.899 -2.08 . . . . 0.0 107.899 -176.962 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -104.46 7.89 35.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.171 0.51 . . . . 0.0 110.228 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.9 t -97.72 147.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -176.088 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 m -125.22 138.78 54.12 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 171.196 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.1 t -137.29 134.61 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -99.63 114.27 65.51 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.769 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -81.52 77.18 4.04 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.515 2.143 . . . . 0.0 114.644 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -86.15 155.25 20.83 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . 0.407 HG22 ' CZ3' ' A' ' 96' ' ' TRP . 11.6 tt -147.83 146.16 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -176.617 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 72.7 t -114.48 118.16 57.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.85 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -73.4 143.27 46.84 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.01 175.42 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.42 -41.96 8.14 Favored Glycine 0 C--O 1.223 -0.548 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 169.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.9 t -57.74 -23.9 54.33 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -178.278 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.8 ptm -139.94 40.35 1.98 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 122.151 0.977 . . . . 0.0 109.721 177.759 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.408 HD13 ' HG1' ' A' ' 7' ' ' THR . 0.5 OUTLIER -50.79 -45.79 59.41 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -172.615 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 23.3 mtm105 -57.06 -51.31 69.8 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.967 0.803 . . . . 0.0 111.686 -178.301 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -73.79 -35.22 64.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.551 -175.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.7 -38.23 54.75 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -178.5 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -63.35 -41.98 98.89 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.745 -0.597 . . . . 0.0 110.964 -177.381 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -69.72 -13.38 62.26 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.235 -177.961 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.42 49.94 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -93.01 -36.57 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 120.872 0.367 . . . . 0.0 110.373 179.383 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -127.83 75.67 77.94 Favored Pre-proline 0 C--N 1.326 -0.434 0 O-C-N 122.149 -0.344 . . . . 0.0 111.246 178.229 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 -15.04 42.14 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-O 121.276 0.448 . . . . 0.0 112.953 178.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.5 m -79.99 -7.14 58.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 178.771 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -75.87 132.91 40.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.451 0.643 . . . . 0.0 110.72 -179.461 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -77.06 95.58 4.23 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 175.353 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 23.8 p -62.71 -25.4 68.15 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.727 0.299 . . . . 0.0 110.907 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -62.42 -14.61 42.51 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.138 0.975 . . . . 0.0 112.544 177.711 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -71.2 -6.13 37.2 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.811 -0.556 . . . . 0.0 110.642 178.869 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.8 p -154.24 -179.87 8.32 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 122.711 0.404 . . . . 0.0 109.976 -178.958 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 2.3 p -146.56 156.24 43.09 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 103.324 -2.843 . . . . 0.0 103.324 173.635 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -68.29 -32.41 72.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.377 0.608 . . . . 0.0 110.921 -176.054 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.8 mp0 -68.02 -33.12 74.0 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.694 0.759 . . . . 0.0 109.696 179.028 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -83.54 -3.42 57.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.935 -178.221 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -78.03 38.18 0.27 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.504 0.669 . . . . 0.0 112.094 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 75.1 m -67.48 157.13 34.98 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.24 0.543 . . . . 0.0 110.676 -179.157 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -55.35 -33.38 63.34 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -177.082 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -72.61 -39.47 67.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.666 0.746 . . . . 0.0 111.176 178.945 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.25 -24.41 66.58 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.024 -0.423 . . . . 0.0 110.972 -176.836 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . 0.455 ' HB2' ' H3 ' ' A' ' 1' ' ' MET . . . -59.88 -37.62 79.87 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.71 0.29 . . . . 0.0 110.682 175.304 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.5 -42.29 68.23 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.527 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 23.9 mmt -60.28 -33.8 72.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 0.0 110.137 178.424 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.69 -38.64 87.18 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.056 -0.403 . . . . 0.0 110.328 178.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.25 -43.89 85.23 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.023 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.05 -41.59 97.33 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.2 0.524 . . . . 0.0 109.886 -178.517 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -63.01 -42.31 99.78 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.881 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -62.15 -41.53 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.168 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.0 mt -63.58 -37.68 88.25 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.098 0.475 . . . . 0.0 110.034 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.9 m -69.83 -35.16 74.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.695 0.76 . . . . 0.0 110.505 176.146 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.85 -47.32 69.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.621 -178.728 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.1 p -64.99 -40.3 88.6 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.639 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.226 -178.623 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.64 -39.34 90.99 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.913 -179.418 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -65.47 -40.91 93.74 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 121.705 -0.622 . . . . 0.0 110.338 176.225 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -59.59 -28.36 67.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.021 -179.38 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -61.19 -36.04 78.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.115 0.483 . . . . 0.0 110.397 -178.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 43.5 tp10 -68.37 -34.04 75.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.402 0.62 . . . . 0.0 109.693 178.062 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -70.83 -49.76 42.83 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 121.948 -0.47 . . . . 0.0 111.715 178.711 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.61 -17.64 62.27 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -174.421 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -60.41 -17.96 47.58 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 118.763 0.71 . . . . 0.0 111.566 -179.617 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 68.5 p -70.29 -14.09 62.44 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 178.917 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -63.82 -24.37 67.72 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.95 -0.469 . . . . 0.0 111.077 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -68.76 -14.37 62.98 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 178.827 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -108.72 13.42 25.08 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -176.775 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.48 141.9 17.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 122.202 1.001 . . . . 0.0 110.931 -179.949 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 18.5 p90 -115.63 24.97 11.13 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 179.53 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -150.04 165.56 32.36 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -177.379 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -152.12 143.97 23.69 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.791 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -168.75 176.36 43.01 Favored Glycine 0 C--O 1.226 -0.398 0 N-CA-C 109.979 -1.249 . . . . 0.0 109.979 -179.456 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -140.93 -16.44 0.87 Allowed 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -179.16 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . 0.407 ' HG ' ' H ' ' A' ' 178' ' ' GLU . 6.7 tp 53.53 -166.94 0.07 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -173.503 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . 0.407 ' H ' ' HG ' ' A' ' 177' ' ' LEU . 2.4 pt-20 -166.24 162.38 17.37 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 103.001 -2.962 . . . . 0.0 103.001 177.071 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -148.99 -63.84 0.23 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -175.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.41 171.53 17.91 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.518 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -151.03 142.61 23.58 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 173.606 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 39.3 tp -163.35 157.55 20.19 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 178.307 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -162.77 162.91 26.86 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -178.24 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -138.74 135.96 35.26 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 176.524 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 . . . . . 0 C--O 1.254 1.298 0 N-CA-C 104.037 -2.579 . . . . 0.0 104.037 -178.084 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 ptm . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.818 0.342 . . . . 25.0 110.939 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -111.11 157.0 20.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 50.0 110.929 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.7 tp -70.56 -36.63 73.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 50.0 110.834 -179.88 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -73.73 -55.25 6.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.442 . . . . 50.0 110.958 179.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.04 -35.45 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 50.0 110.851 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -52.46 -46.1 66.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 50.0 110.948 -179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.22 -54.32 11.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.093 -179.977 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -51.19 -38.94 55.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.421 . . . . 50.0 110.926 -179.893 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -75.63 -48.26 22.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.114 -0.494 . . . . 50.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -48.3 74.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.84 -48.09 81.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 50.0 111.138 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.49 -44.15 62.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.0 -33.09 67.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.087 179.941 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.85 -51.86 59.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.8 mt -56.66 -56.13 25.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 50.0 110.903 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -56.57 -33.0 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 50.0 111.134 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.97 -17.88 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.283 -0.417 . . . . 50.0 110.891 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.0 33.87 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.86 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.82 94.86 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.713 -0.756 . . . . 25.0 112.457 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -103.4 104.06 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.857 0.36 . . . . 25.0 110.878 -179.764 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -50.9 111.42 1.26 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.798 -0.715 . . . . 25.0 112.438 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 21.7 t -69.98 106.53 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.763 0.316 . . . . 50.0 111.078 -179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.9 mt -69.12 -34.77 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.138 -0.483 . . . . 25.0 111.106 179.905 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -169.28 116.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.863 179.957 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.57 104.47 13.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.079 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.08 29.77 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.752 -0.737 . . . . 50.0 112.487 -179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 52.24 -96.81 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 50.0 110.882 -179.833 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.7 t 69.11 -70.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 50.0 110.839 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -141.29 -44.84 0.37 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.134 -0.485 . . . . 50.0 110.869 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.57 173.12 15.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 50.0 110.916 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.9 mt -103.65 130.24 54.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.18 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -109.76 135.73 50.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.124 -0.489 . . . . 50.0 110.918 179.94 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 11.3 mt -146.03 124.51 12.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 50.0 110.942 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.24 133.64 42.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 50.0 110.9 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.4 104.04 38.97 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.594 0.711 . . . . 25.0 111.112 179.907 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -32.35 18.68 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.627 2.218 . . . . 50.0 112.328 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -25.63 60.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 50.0 110.823 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 66.27 39.7 4.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.93 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.07 -176.52 1.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 25.0 110.843 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.07 -34.54 13.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 50.0 110.945 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -105.51 122.8 46.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 50.0 110.909 179.848 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.12 -56.03 5.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 50.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.0 mt -119.59 155.26 32.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 50.0 110.895 -179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.9 148.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 50.0 111.169 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -132.23 140.15 48.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 25.0 110.827 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mp -134.35 126.56 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 50.0 110.891 179.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -126.71 150.01 49.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 25.0 110.987 -179.967 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 94.84 4.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.164 -0.471 . . . . 50.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -151.57 148.95 28.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 50.0 110.875 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -92.99 140.06 29.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 25.0 110.874 179.958 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.34 152.09 35.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 50.0 110.871 -179.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.32 -36.25 7.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 50.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -135.97 -175.13 3.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 25.0 110.932 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt85 -80.38 -30.54 37.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 50.0 110.796 -179.894 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -35.1 62.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 50.0 110.917 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -34.87 61.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 50.0 110.905 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.8 tpp -72.57 -52.28 16.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 50.0 110.877 179.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.2 m -58.95 -34.26 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.268 -0.424 . . . . 50.0 111.154 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 mtm-85 -66.51 -37.68 85.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.165 -0.47 . . . . 50.0 110.868 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -54.13 46.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 50.0 110.879 179.949 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -60.73 -37.85 77.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.288 -0.414 . . . . 50.0 111.139 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -51.43 -34.89 37.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 50.0 110.942 179.944 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -76.78 -35.67 57.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 50.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -54.42 -59.72 4.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 50.0 110.924 -179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.22 -38.35 57.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.083 179.924 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.89 -42.04 97.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 50.0 110.886 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.48 -37.2 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.884 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 68.1 t -52.85 -35.74 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 50.0 111.124 179.985 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -53.93 -36.69 63.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 50.0 110.813 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -72.29 -37.12 69.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.176 -0.466 . . . . 50.0 110.842 -179.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 86.5 t -70.87 -52.8 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 25.0 111.166 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -36.36 75.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 50.0 110.806 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -58.25 -45.27 88.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.818 -179.924 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -72.54 -37.55 68.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 50.0 110.9 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mp -70.98 -19.63 62.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 50.0 110.896 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.32 33.34 58.2 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.773 -0.727 . . . . 25.0 112.501 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.03 175.34 6.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 50.0 110.897 -179.89 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -71.27 -52.83 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -148.74 163.86 36.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 50.0 110.859 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 mmm -134.9 130.97 36.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 50.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.7 120.12 39.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 50.0 110.901 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.57 130.99 55.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.314 -0.403 . . . . 50.0 110.967 179.878 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.3 tp -104.08 97.72 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 50.0 110.917 179.856 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -100.21 126.68 46.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 25.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.0 p -129.6 154.87 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 50.0 111.133 179.971 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -122.56 127.4 49.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 50.0 110.866 -179.953 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -98.39 114.61 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 50.0 110.865 -179.938 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 60.2 p -143.76 169.52 17.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 50.0 110.862 -179.778 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.8 m -89.86 -51.22 5.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 25.0 111.157 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -120.58 135.24 55.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 50.0 110.837 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -69.24 160.15 80.1 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.54 0.686 . . . . 25.0 111.092 179.959 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.58 -170.48 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.753 2.302 . . . . 50.0 112.383 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.6 m -145.79 80.67 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 50.0 111.151 179.83 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -172.98 45.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 50.0 110.786 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.9 t70 63.51 55.85 1.7 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.858 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 24.3 p-90 -84.39 -29.63 26.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 50.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -50.7 -48.2 58.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.199 -0.455 . . . . 50.0 110.846 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.92 -33.57 37.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 50.0 110.847 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 21.6 mm -59.99 -46.4 94.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 50.0 111.098 -179.98 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.82 -31.11 71.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.02 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -73.0 -38.07 66.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 50.0 110.932 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt -89.08 156.54 18.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 50.0 110.881 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.3 m -122.81 143.98 49.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.445 . . . . 25.0 111.161 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -90.75 104.16 16.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 50.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -112.43 101.09 9.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 50.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -98.01 103.28 15.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 50.0 110.823 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 52.75 -112.41 2.14 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.725 . . . . 25.0 112.437 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.1 p -95.08 29.81 2.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 25.0 111.125 -179.824 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 17.5 t -122.46 151.61 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 50.0 111.096 179.917 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.8 t -137.73 112.5 8.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 50.0 110.893 -179.818 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 18.9 t -140.94 138.9 34.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 50.0 111.082 -179.952 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.04 141.86 38.21 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.648 0.737 . . . . 50.0 110.885 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.65 135.61 31.16 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.669 2.246 . . . . 50.0 112.351 179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -134.26 135.14 42.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 25.0 111.111 179.875 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.98 137.93 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 50.0 111.165 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 4.7 m -130.74 101.85 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 75.0 111.203 179.862 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.2 154.73 17.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.137 -0.483 . . . . 50.0 110.889 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.65 -29.46 18.37 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.765 -0.731 . . . . 25.0 112.482 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.1 p -57.51 -45.37 85.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 25.0 111.172 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 1.7 mtm -134.59 46.93 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 50.0 110.819 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -61.31 -59.19 5.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 50.0 110.85 -179.963 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.72 -35.58 80.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.91 179.908 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.57 -41.09 89.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 50.0 110.8 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.43 -33.25 54.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 50.0 110.897 -179.964 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.66 -33.8 48.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.495 . . . . 50.0 110.932 -179.954 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -75.36 -30.2 60.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 50.0 110.846 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.54 -37.83 65.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 25.0 111.17 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -90.34 -60.63 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.441 . . . . 50.0 111.108 179.979 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 31.0 m-85 -112.44 77.54 2.32 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.586 0.708 . . . . 50.0 110.881 -179.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 -29.45 23.44 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.643 2.229 . . . . 50.0 112.321 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 43.3 t -69.44 -16.04 63.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 25.0 110.799 -179.813 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -54.24 146.17 15.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 50.0 110.854 -179.877 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -91.06 122.63 33.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 50.0 110.854 -179.93 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.81 -33.6 18.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 25.0 111.176 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.0 -32.4 21.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.851 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -35.57 52.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 25.0 110.875 179.989 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 34.9 t -62.81 94.4 0.07 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.195 -0.457 . . . . 25.0 110.828 -179.818 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.66 -173.25 4.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 25.0 110.873 -179.745 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.26 -31.75 14.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.949 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -34.59 44.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 25.0 110.939 -179.994 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 42.7 m170 -79.15 -28.38 42.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.154 -0.475 . . . . 25.0 110.888 -179.994 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 68.91 -77.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 25.0 111.098 179.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -165.38 -169.88 1.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 25.0 110.858 -179.876 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -52.13 -29.34 21.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.834 -179.868 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.17 -34.71 32.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 50.0 110.877 -179.915 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.26 -33.01 62.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 50.0 110.969 -179.974 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -53.88 -35.39 61.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 25.0 111.154 179.763 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -61.47 -44.76 96.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 50.0 110.852 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.2 mmt -76.93 -35.73 57.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.437 . . . . 50.0 110.852 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.65 66.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.252 -0.431 . . . . 25.0 111.132 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.3 ttt180 -65.13 -53.81 39.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 50.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -43.79 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 25.0 110.877 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -39.5 93.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 50.0 110.959 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 38.9 t80 -53.57 -44.23 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.861 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -51.93 -46.12 64.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 50.0 110.884 -179.908 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.5 m -76.15 -36.22 58.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 50.0 110.869 -179.933 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 10.5 tt -57.17 -34.99 69.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 50.0 110.89 179.994 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 84.1 t -52.63 -54.5 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 50.0 111.101 179.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -75.25 -33.35 61.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 50.0 110.886 -179.961 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -60.74 -36.25 78.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.257 -0.429 . . . . 50.0 110.838 179.85 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.37 -30.09 50.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 50.0 110.986 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.58 -43.26 84.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 50.0 110.858 -179.898 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -77.07 -35.97 56.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 50.0 110.793 -179.876 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -66.44 -35.6 80.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 50.0 110.885 -179.88 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -51.88 -36.0 47.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 50.0 110.885 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -51.84 -51.64 55.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 50.0 110.901 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -35.55 68.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 25.0 111.174 179.982 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -51.92 -36.0 47.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.186 -0.461 . . . . 25.0 110.921 179.93 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -51.55 -35.62 41.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 25.0 111.13 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -51.65 125.54 15.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 25.0 111.098 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 34.2 m -51.8 139.02 8.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 50.0 111.084 -179.994 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -148.82 -170.66 3.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 25.0 110.908 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.48 134.47 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 50.0 110.897 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -177.64 163.1 1.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 25.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 112.0 -176.42 18.02 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.846 -0.692 . . . . 25.0 112.555 -179.96 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 7.0 mttt -141.79 178.63 7.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.781 0.324 . . . . 50.0 110.924 -179.949 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 2.2 tt -142.53 -43.4 0.32 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 50.0 110.915 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -53.8 136.14 40.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.872 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 7.2 ttp180 -175.71 139.52 0.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 25.0 110.908 -179.93 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -140.72 157.75 44.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.153 -0.476 . . . . 25.0 110.831 -179.885 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -133.39 177.04 7.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 50.0 110.903 -179.969 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.25 137.02 50.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 50.0 110.954 179.936 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -51.2 159.87 0.59 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 50.0 110.94 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -145.02 134.08 22.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.485 . . . . 50.0 110.878 -179.943 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 185' ' ' GLN . . . . . 0.545 ' HG3' ' OXT' ' A' ' 185' ' ' GLN . 12.1 pt20 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 25.0 110.903 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 121.312 0.577 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.68 -34.63 78.3 Favored 'General case' 0 C--O 1.215 -0.763 0 O-C-N 122.017 -0.427 . . . . 0.0 110.976 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -61.62 -32.95 73.12 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.602 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -63.15 -52.44 62.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.2 m -59.38 -40.82 87.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.371 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.452 ' HH ' ' N ' ' A' ' 29' ' ' ASP . 14.0 t80 -55.26 -48.35 74.12 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.425 0.69 . . . . 0.0 110.983 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -70.49 -34.08 71.96 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.718 -0.614 . . . . 0.0 111.749 178.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -67.97 -34.88 77.4 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.095 -0.378 . . . . 0.0 111.397 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 24.2 mm -71.85 -41.1 69.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.86 78.04 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.51 -49.8 73.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.519 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -37.92 89.26 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.28 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.47 -48.79 63.56 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.2 p -65.22 -30.61 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.202 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -78.17 -8.56 58.45 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.971 -0.455 . . . . 0.0 111.312 178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 55.4 m -101.25 9.94 41.27 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.95 0.83 61.76 Favored Glycine 0 N--CA 1.452 -0.282 0 N-CA-C 116.836 1.494 . . . . 0.0 116.836 176.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.42 132.08 46.41 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.13 131.29 10.28 Favored Glycine 0 C--O 1.22 -0.753 0 N-CA-C 110.271 -1.132 . . . . 0.0 110.271 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.44 106.23 7.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 118.332 1.066 . . . . 0.0 109.329 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 74.3 mt -72.78 -42.46 61.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -148.7 116.34 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.5 0 O-C-N 123.189 0.306 . . . . 0.0 111.035 179.022 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.452 ' N ' ' HH ' ' A' ' 8' ' ' TYR . 12.5 p-10 . . . . . 0 C--O 1.222 -0.352 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -131.6 131.68 43.45 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.8 mt -136.6 132.79 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 175.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -108.17 129.2 55.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.88 126.26 48.28 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 123.434 0.694 . . . . 0.0 109.565 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -76.32 132.26 39.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.29 116.62 50.93 Favored Pre-proline 0 CA--C 1.546 0.809 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.28 -23.58 20.7 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 117.592 -1.139 . . . . 0.0 113.812 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.9 -27.49 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.654 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.7 mttt 54.83 39.54 31.5 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.952 1.834 . . . . 0.0 108.353 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 t -73.95 -176.26 2.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 110.816 -2.902 . . . . 0.0 107.927 176.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.2 m -47.22 -30.62 3.1 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -90.03 129.9 36.28 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 172.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -89.15 -37.36 15.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.956 0.408 . . . . 0.0 111.891 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.49 166.42 30.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.257 0.551 . . . . 0.0 111.534 -175.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 49.1 t -127.16 136.39 60.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -114.98 126.35 54.66 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mp -95.87 129.46 43.11 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 102.98 -2.97 . . . . 0.0 102.98 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -136.45 113.43 10.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.644 0.735 . . . . 0.0 112.478 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -87.67 96.88 10.59 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.82 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -151.62 139.19 19.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -93.68 137.82 32.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -121.81 120.1 33.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.353 0.121 . . . . 0.0 111.115 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -80.09 -48.63 12.94 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.559 0.695 . . . . 0.0 111.297 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -120.2 156.33 31.36 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.256 0.551 . . . . 0.0 112.4 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HE ' ' CB ' ' A' ' 95' ' ' ASP . 8.4 ptt85 -64.33 -15.52 60.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.249 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -65.11 -45.66 84.2 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -72.52 -36.29 68.29 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -178.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 20.5 ttt -57.46 -48.08 80.12 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -72.29 -31.81 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.744 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.48 -36.43 84.16 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -60.81 -41.23 95.28 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -66.34 -30.93 51.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 O-C-N 122.12 -0.363 . . . . 0.0 111.527 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -61.04 -39.44 89.81 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -76.55 -41.83 45.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.019 0.437 . . . . 0.0 110.168 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -55.99 -43.23 77.45 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.79 88.68 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -71.78 -34.18 69.2 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 121.72 -0.613 . . . . 0.0 109.989 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -63.28 -42.16 99.07 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.44 HG11 HG13 ' A' ' 109' ' ' VAL . 45.5 t -67.17 -32.24 56.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.782 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.9 -33.56 68.87 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.239 -0.913 . . . . 0.0 110.447 177.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.87 -40.45 79.26 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.99 0.424 . . . . 0.0 109.97 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.73 -36.75 75.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.082 0.468 . . . . 0.0 109.746 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -55.79 -39.44 71.28 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.113 -0.367 . . . . 0.0 110.668 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -59.28 -50.86 72.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.048 -178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -73.37 -22.45 60.27 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -82.59 -18.06 42.61 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 122.015 -0.428 . . . . 0.0 112.032 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.09 2.06 12.05 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -75.58 152.71 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 118.108 0.954 . . . . 0.0 112.976 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.5 ttt85 -69.11 -22.84 63.95 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.903 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 -147.35 151.85 37.23 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 104.16 -2.533 . . . . 0.0 104.16 177.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -119.99 135.79 54.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.882 -1.895 . . . . 0.0 105.882 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -126.13 126.13 43.65 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 53.8 tp -114.13 134.47 54.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.817 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.6 tp -95.08 120.43 35.28 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 169.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -114.24 114.79 26.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.312 0.505 . . . . 0.0 110.362 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.5 t -109.08 111.01 34.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.004 0.431 . . . . 0.0 112.048 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -77.21 141.69 39.94 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -116.11 103.68 10.8 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.7 m -128.36 150.62 50.02 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.546 0.529 . . . . 0.0 111.141 -174.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.3 t -70.61 -29.0 65.27 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.511 -0.743 . . . . 0.0 110.458 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -148.54 164.06 35.35 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.64 157.51 49.37 Favored Pre-proline 0 C--N 1.319 -0.718 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.87 147.33 62.8 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.44 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 19.8 m -65.84 -14.16 16.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -152.0 146.64 25.73 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -177.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.48 ' CB ' ' HE ' ' A' ' 54' ' ' ARG . 60.1 m-20 47.22 6.28 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 120.243 3.423 . . . . 0.0 120.243 176.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -58.95 -25.89 63.93 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.86 -1.15 . . . . 0.0 112.61 -175.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.67 -32.24 73.27 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.996 -0.44 . . . . 0.0 112.18 -177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.07 -33.49 75.54 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.853 0.835 . . . . 0.0 109.187 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.3 mm -69.21 -41.14 81.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.483 -173.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.87 -12.55 61.02 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.082 0.468 . . . . 0.0 111.469 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -98.56 0.24 44.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.416 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -121.88 135.75 54.9 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.479 0.656 . . . . 0.0 112.346 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.8 m -82.59 126.95 32.88 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -85.42 119.0 25.29 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 176.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -123.45 131.79 53.75 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -139.31 103.6 4.78 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.738 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.96 -112.7 4.35 Favored Glycine 0 C--O 1.224 -0.497 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.0 p -108.59 8.31 27.06 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.171 0.51 . . . . 0.0 110.578 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.44 HG13 HG11 ' A' ' 68' ' ' VAL . 86.1 t -95.38 141.49 15.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.6 t -127.35 135.67 50.84 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 175.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.4 t -134.25 134.94 54.88 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.603 0 CA-C-O 122.107 0.956 . . . . 0.0 109.284 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -103.18 101.88 24.94 Favored Pre-proline 0 N--CA 1.427 -1.582 0 CA-C-N 113.26 -1.791 . . . . 0.0 108.207 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.31 145.43 24.02 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 116.941 -1.573 . . . . 0.0 112.451 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.36 154.57 40.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 tt -147.33 128.78 6.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.36 121.53 60.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.45 140.03 42.34 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -175.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.56 -32.54 53.42 Favored Glycine 0 C--O 1.229 -0.176 0 CA-C-N 115.568 -0.742 . . . . 0.0 114.188 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 32.9 p -53.35 -30.19 38.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 115.718 1.747 . . . . 0.0 115.718 -178.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.5 ptm -140.94 26.92 2.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.86 0.838 . . . . 0.0 109.44 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.7 tp -47.86 -40.88 22.69 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 118.263 2.69 . . . . 0.0 118.263 -168.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -41.75 94.93 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.675 1.125 . . . . 0.0 112.028 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.55 -40.25 35.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.981 0.896 . . . . 0.0 110.878 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -61.69 -41.86 98.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.589 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.96 -42.48 89.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.44 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -76.64 -15.09 59.91 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.626 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.35 -34.63 63.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.4 t -90.18 -43.17 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 109.903 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -120.49 78.89 28.78 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.773 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -69.68 -9.12 25.36 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 117.669 -1.087 . . . . 0.0 112.515 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 p -74.28 -14.92 60.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.396 176.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -96.72 134.17 40.34 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 . . . . . 0 C--N 1.323 -0.573 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -177.866 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 . . . . . 0 C--O 1.214 -0.797 0 CA-C-O 120.554 0.216 . . . . 0.0 111.506 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -31.72 55.91 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.112 -0.368 . . . . 0.0 111.662 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -64.58 -48.31 75.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.0 mmt -66.4 -35.64 80.83 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.913 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.55 -38.33 77.57 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.33 -0.231 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -65.34 -45.9 82.41 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.29 -43.43 98.88 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.148 0.499 . . . . 0.0 111.029 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.9 mmt-85 -63.17 -44.01 96.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.14 -41.56 88.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 177.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 80.2 mt -65.48 -35.8 81.96 Favored 'General case' 0 C--N 1.321 -0.657 0 O-C-N 121.646 -0.658 . . . . 0.0 111.2 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 87.6 p -75.81 -27.81 58.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.487 -0.758 . . . . 0.0 110.53 175.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.69 -43.68 65.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.474 -177.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.3 -33.07 57.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--N 1.327 -0.387 0 O-C-N 121.719 -0.613 . . . . 0.0 109.584 176.124 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 23.8 tp -63.08 -42.19 99.59 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.448 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -64.63 -41.05 96.43 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -58.59 -48.14 81.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.9 m -66.12 -43.46 87.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.352 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -55.09 -51.63 65.78 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.622 0.369 . . . . 0.0 110.984 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -72.3 -29.95 64.34 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.728 -0.607 . . . . 0.0 112.143 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -71.1 -35.54 71.84 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.557 -0.715 . . . . 0.0 111.166 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.1 mm -71.29 -37.83 67.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.14 -45.15 87.87 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 176.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.66 -40.8 96.07 Favored 'General case' 0 C--O 1.208 -1.123 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -58.94 -49.81 76.44 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.2 mp -68.35 -45.42 72.9 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.089 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.76 -42.77 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.937 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -61.97 -26.53 68.26 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 121.915 -0.491 . . . . 0.0 111.72 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -82.53 5.24 21.44 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 122.575 0.35 . . . . 0.0 111.763 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.12 -1.51 44.06 Favored Glycine 0 CA--C 1.517 0.164 0 N-CA-C 115.483 0.953 . . . . 0.0 115.483 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.01 123.05 19.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.817 0.808 . . . . 0.0 109.393 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.01 129.39 9.66 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.31 133.99 29.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.07 -41.94 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -149.2 142.24 24.87 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 104.804 -2.295 . . . . 0.0 104.804 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.432 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -179.403 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 . . . . . 0 N--CA 1.466 0.332 0 CA-C-O 121.183 0.516 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -133.18 152.28 51.95 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 93.2 mt -135.21 133.48 52.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -114.44 136.11 53.37 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.14 0.576 . . . . 0.0 109.654 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mp -132.91 137.97 46.8 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.349 0.66 . . . . 0.0 109.923 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -93.86 135.82 34.78 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.77 111.93 15.38 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -73.59 -24.96 15.48 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.523 -1.184 . . . . 0.0 114.173 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.19 -8.3 55.72 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt 58.15 43.95 19.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -68.19 -177.66 0.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 113.273 -1.785 . . . . 0.0 110.915 -177.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 p -56.27 -27.64 55.97 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.484 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -105.76 133.4 50.55 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -80.11 -39.81 28.77 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 120.96 0.409 . . . . 0.0 109.933 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.4 mt -137.38 160.35 39.32 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.716 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 58.5 t -131.51 137.43 55.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -123.35 132.27 53.93 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.2 124.08 47.92 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 174.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -136.54 150.0 48.4 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -125.81 119.91 29.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 118.181 0.446 . . . . 0.0 112.019 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.71 140.43 20.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -92.61 111.98 23.76 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.7 mt -104.09 125.19 50.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -87.22 -34.7 18.89 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.18 0.514 . . . . 0.0 110.708 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -130.29 148.01 52.07 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -177.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 95' ' ' ASP . 14.1 ptt180 -67.38 -21.05 65.63 Favored 'General case' 0 CA--C 1.505 -0.768 0 O-C-N 121.088 -1.008 . . . . 0.0 111.803 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -62.11 -28.52 69.69 Favored 'General case' 0 C--O 1.213 -0.865 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.69 -45.07 25.95 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 175.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.4 ttm -54.56 -49.97 69.07 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.484 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.17 -31.87 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.25 -34.57 76.45 Favored 'General case' 0 CA--C 1.506 -0.745 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.238 -176.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -42.24 89.71 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -74.18 -34.43 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 122.019 -0.426 . . . . 0.0 111.355 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -41.54 92.05 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -76.3 -33.73 59.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.948 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -58.2 -46.62 85.51 Favored 'General case' 0 C--O 1.219 -0.52 0 O-C-N 121.966 -0.459 . . . . 0.0 109.798 176.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.05 -32.68 74.11 Favored 'General case' 0 N--CA 1.444 -0.755 0 O-C-N 122.403 -0.185 . . . . 0.0 110.623 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -46.54 85.35 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -61.67 -41.31 97.38 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.422 HG11 HG13 ' A' ' 109' ' ' VAL . 86.7 t -61.31 -35.34 65.56 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.74 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.986 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -55.48 -38.99 69.85 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.493 1.042 . . . . 0.0 110.597 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -73.93 -45.79 48.3 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.705 0.288 . . . . 0.0 111.118 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.06 -44.33 95.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.652 0.263 . . . . 0.0 111.698 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -30.1 70.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.151 -0.968 . . . . 0.0 110.167 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -68.89 -43.15 75.86 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.12 -30.99 70.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.879 0.371 . . . . 0.0 111.246 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -83.33 -14.0 53.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.489 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.98 -3.09 30.63 Favored Glycine 0 CA--C 1.522 0.469 0 N-CA-C 114.191 0.437 . . . . 0.0 114.191 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -71.0 136.02 48.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -64.24 -45.79 86.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 122.124 -0.36 . . . . 0.0 111.785 -176.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -119.98 162.26 19.52 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 178.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.4 ttp -145.31 138.84 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.363 174.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -113.63 143.46 44.53 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 123.647 0.592 . . . . 0.0 109.863 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.1 tt -139.47 136.85 35.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.0 tp -99.22 106.35 18.49 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -97.31 108.52 21.26 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.41 116.31 46.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -175.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -85.98 151.37 23.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -126.3 129.43 48.85 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 172.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.5 p -147.62 163.02 37.94 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.017 0.198 . . . . 0.0 110.784 -174.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.0 m -67.09 -48.96 66.59 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 173.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -151.41 165.99 32.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 105.188 -2.153 . . . . 0.0 105.188 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.16 158.14 36.5 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.14 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -54.48 146.01 54.7 Favored 'Trans proline' 0 C--N 1.349 0.571 0 N-CA-C 116.902 1.847 . . . . 0.0 116.902 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.6 m -77.18 -19.51 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.01 177.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -87.71 87.22 7.31 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.755 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 54' ' ' ARG . 68.8 m-20 19.84 51.25 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 119.054 2.983 . . . . 0.0 119.054 176.436 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -63.05 -20.59 65.48 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.519 -0.738 . . . . 0.0 112.875 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.35 -31.29 69.06 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 122.246 -0.284 . . . . 0.0 111.451 -177.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.73 -30.35 71.46 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.685 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.4 HD11 ' HD2' ' A' ' 54' ' ' ARG . 9.4 mm -73.46 -38.51 53.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.86 0.362 . . . . 0.0 110.3 -176.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.07 -25.3 67.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.101 0.953 . . . . 0.0 110.441 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -97.69 21.71 10.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.215 -177.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.3 ttmm -139.36 98.02 3.41 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.574 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 65.1 m -68.24 127.07 31.58 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.266 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -86.39 112.12 21.16 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -108.4 131.98 54.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.809 0.814 . . . . 0.0 110.103 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -128.86 84.51 2.24 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.94 -110.44 3.15 Favored Glycine 0 C--O 1.22 -0.78 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 71.7 p -98.09 -1.32 42.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.422 HG13 HG11 ' A' ' 68' ' ' VAL . 95.9 t -89.52 138.55 19.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.0 m -133.98 112.72 11.46 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 173.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.9 t -121.53 130.58 74.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -113.58 133.0 22.28 Favored Pre-proline 0 C--O 1.244 0.808 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -81.58 160.88 19.4 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 O-C-N 122.253 0.607 . . . . 0.0 112.446 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.86 152.59 36.72 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 102.444 -3.169 . . . . 0.0 102.444 174.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 tt -147.76 135.46 14.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 51.7 t -108.98 117.32 54.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.41 146.91 42.54 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.295 177.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.49 -41.5 8.35 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 172.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.3 t -65.51 -19.75 66.06 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -177.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 24.4 ptm -136.63 32.0 2.78 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 122.095 0.95 . . . . 0.0 109.355 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -49.19 -43.83 42.58 Favored 'General case' 0 C--O 1.213 -0.821 0 N-CA-C 116.545 2.054 . . . . 0.0 116.545 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.4 ptt-85 -54.69 -51.35 65.82 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.309 0.504 . . . . 0.0 112.052 -177.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -75.05 -39.66 60.81 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.951 -177.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -70.37 -32.12 69.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -175.586 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.45 -41.22 93.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.721 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.11 -21.23 66.77 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.7 -22.69 60.86 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.648 0.261 . . . . 0.0 110.91 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.0 t -109.06 -42.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.167 0.508 . . . . 0.0 111.554 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -125.54 73.88 68.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.366 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.83 -12.38 32.65 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 117.991 -0.873 . . . . 0.0 113.362 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.0 m -80.39 -5.08 55.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -103.6 132.95 49.41 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 39.5 mtp85 . . . . . 0 C--N 1.325 -0.473 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.74 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 C--O 1.215 -0.732 0 N-CA-C 110.688 -0.115 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -39.85 72.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.731 0.3 . . . . 0.0 111.524 177.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -68.67 -41.94 78.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.531 0.681 . . . . 0.0 109.266 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 46.3 mtt -64.41 -37.0 86.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.84 -37.55 87.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.447 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -64.61 -52.6 56.64 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -63.85 -36.02 82.55 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.373 0.606 . . . . 0.0 111.148 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -63.86 -39.67 94.75 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -66.95 -42.14 85.74 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.129 0.171 . . . . 0.0 111.289 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.37 -34.84 75.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.177 0.513 . . . . 0.0 109.822 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 24.0 m -75.97 -35.69 59.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.392 0.615 . . . . 0.0 111.477 176.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 5.7 tt -65.56 -43.16 90.74 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.5 p -57.72 -40.76 77.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.739 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.6 tm? . . . . . 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.539 . . . . 0.0 110.265 179.525 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 C--O 1.214 -0.766 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -60.99 -32.41 71.98 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.649 0.737 . . . . 0.0 112.052 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -56.98 -27.15 61.13 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -61.29 -52.3 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 178.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 m -69.45 -40.22 77.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.141 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -52.82 -58.03 8.24 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -68.01 -28.07 67.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.476 -0.765 . . . . 0.0 111.905 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -73.18 -29.87 63.14 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 122.09 -0.381 . . . . 0.0 111.455 178.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.424 HD11 HD11 ' A' ' 125' ' ' LEU . 12.9 mm -69.87 -41.88 79.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.56 80.28 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.42 98.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.094 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -39.32 86.33 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.644 -0.423 . . . . 0.0 111.27 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.45 -44.23 83.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.84 -42.58 89.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.027 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -77.96 -2.41 36.79 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.358 -0.839 . . . . 0.0 112.692 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -98.37 7.96 45.5 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 173.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.54 -1.32 57.02 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 116.694 1.437 . . . . 0.0 116.694 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.445 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 12.8 m-85 -69.69 125.32 26.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 118.336 1.068 . . . . 0.0 110.442 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.46 133.67 13.1 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.6 t -78.25 117.09 22.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.465 HD11 HD22 ' A' ' 43' ' ' LEU . 75.3 mt -87.24 -44.74 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -149.56 123.26 9.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.827 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.628 0 N-CA-C 104.115 -2.55 . . . . 0.0 104.115 172.389 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.462 0.162 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -135.53 141.02 45.17 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 42.3 mt -136.1 131.69 49.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -106.83 128.74 54.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.09 133.45 53.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.564 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -87.52 137.03 32.69 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.03 107.25 11.03 Favored Pre-proline 0 CA--C 1.549 0.921 0 O-C-N 123.034 0.209 . . . . 0.0 111.554 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 90.2 Cg_endo -73.49 -20.23 20.92 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 118.009 -0.861 . . . . 0.0 112.418 -178.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.88 -25.45 66.4 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.708 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mttt 59.59 40.75 19.86 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 -173.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.0 p -75.79 -177.52 3.82 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 112.498 -2.137 . . . . 0.0 108.728 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.2 -1.56 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -136.08 133.57 37.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -76.91 -35.75 57.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.449 0.643 . . . . 0.0 109.898 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.465 HD22 HD11 ' A' ' 23' ' ' ILE . 54.8 mt -136.24 162.62 32.47 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.0 t -126.4 133.7 68.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -118.47 115.67 25.1 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.078 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 tp -90.24 123.31 33.93 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -136.35 141.9 43.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 117.902 0.319 . . . . 0.0 111.548 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -111.39 119.73 39.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 t-160 -151.71 123.62 8.06 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.21 121.0 26.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.42 108.3 18.28 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -176.723 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -70.29 -46.84 63.49 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 122.458 1.123 . . . . 0.0 109.856 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -119.78 155.46 32.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.051 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -62.56 -22.29 66.23 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -65.58 -32.26 73.75 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -69.96 -49.12 54.94 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.534 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -66.48 -32.07 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -71.24 -27.65 63.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.303 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -68.5 -37.52 80.14 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.84 -30.64 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.334 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.88 -42.13 98.69 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -70.05 -41.8 73.71 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.029 0.919 . . . . 0.0 109.187 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.59 -37.11 77.67 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.005 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.34 -41.92 96.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.853 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -64.26 -39.95 94.99 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.95 -44.52 97.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.3 t -67.08 -40.86 86.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.666 0 CA-C-O 119.737 -0.173 . . . . 0.0 110.57 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -35.01 72.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.262 0.553 . . . . 0.0 109.932 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -73.6 -45.73 51.29 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.803 -0.561 . . . . 0.0 110.786 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.68 -42.69 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -59.36 -30.23 68.26 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.341 -0.849 . . . . 0.0 110.729 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -66.16 -36.73 83.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -70.27 -39.66 74.82 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 121.315 0.579 . . . . 0.0 109.689 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.6 mt -75.38 -7.79 54.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.264 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.53 10.53 63.64 Favored Glycine 0 CA--C 1.522 0.485 0 CA-C-O 121.316 0.398 . . . . 0.0 113.368 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -76.23 137.67 40.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.366 0.603 . . . . 0.0 110.333 -176.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -72.0 -30.53 65.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.994 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -151.46 149.34 29.14 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 103.791 -2.67 . . . . 0.0 103.791 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.7 ttp -131.42 143.15 50.24 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 118.913 0.779 . . . . 0.0 109.901 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.1 mtpt -107.57 136.94 46.49 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.0 tp -125.75 137.31 53.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.3 tp -94.81 121.27 36.23 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.36 135.53 42.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.0 t -132.79 111.62 17.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -82.75 150.58 26.59 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.584 0.553 . . . . 0.0 110.541 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -128.94 115.87 18.5 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 173.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 96.2 p -137.06 160.8 37.88 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 123.478 0.486 . . . . 0.0 110.6 -177.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.7 t -70.55 -30.89 67.74 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.909 -0.495 . . . . 0.0 110.992 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -152.93 170.82 19.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.85 154.8 61.45 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -58.73 148.41 83.06 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 117.469 -1.221 . . . . 0.0 111.902 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 25.6 m -61.41 -22.22 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -155.49 147.2 23.14 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 48.4 9.24 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 120.027 3.343 . . . . 0.0 120.027 172.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.2 p-90 -63.46 -23.11 67.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 114.252 1.205 . . . . 0.0 114.252 -176.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -60.58 -31.35 70.49 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.927 -0.483 . . . . 0.0 112.006 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -58.47 -32.93 69.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.622 0.725 . . . . 0.0 109.873 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.6 mm -69.85 -39.37 77.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.91 -8.02 53.7 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -112.0 2.82 17.06 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.439 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -112.73 133.68 54.63 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.405 0.621 . . . . 0.0 111.426 -178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 54.2 m -79.39 125.0 28.96 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -86.34 121.05 28.37 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -128.07 139.89 52.27 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 122.024 0.916 . . . . 0.0 113.448 -177.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -140.34 75.27 1.5 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.056 -1.429 . . . . 0.0 108.831 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.13 -110.8 3.6 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 119.575 -1.298 . . . . 0.0 112.331 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.3 p -73.82 10.53 1.11 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.164 0.985 . . . . 0.0 112.941 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.8 t -130.46 142.94 42.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 121.869 -0.52 . . . . 0.0 111.079 -177.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.0 t -142.22 131.52 23.54 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 173.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.8 t -134.02 138.83 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.111 0 CA-C-O 121.942 0.877 . . . . 0.0 110.27 -177.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -111.89 110.07 54.67 Favored Pre-proline 0 N--CA 1.435 -1.178 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.485 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.19 157.68 20.08 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 115.878 -2.281 . . . . 0.0 113.345 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.1 156.76 37.85 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.2 tt -146.88 132.88 12.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.47 0.653 . . . . 0.0 111.517 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.1 119.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.6 136.36 53.12 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.09 -35.95 42.62 Favored Glycine 0 C--O 1.221 -0.669 0 N-CA-C 117.182 1.633 . . . . 0.0 117.182 -174.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -22.54 57.18 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -147.58 40.66 1.01 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.735 1.255 . . . . 0.0 108.631 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.2 tt -48.48 -54.17 15.24 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.0 ttt180 -57.32 -36.19 70.82 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.785 1.175 . . . . 0.0 113.931 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.06 -41.23 64.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.069 0.462 . . . . 0.0 110.425 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -66.04 -39.09 89.89 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.396 1.093 . . . . 0.0 109.362 178.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.424 HD11 HD11 ' A' ' 11' ' ' ILE . 1.1 tm? -62.77 -48.66 78.19 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.316 -176.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -72.33 -16.07 61.88 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.432 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.1 -36.2 55.85 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.407 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.05 -44.08 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.435 0.635 . . . . 0.0 110.443 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -128.5 77.16 77.67 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.931 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -66.69 -16.04 49.25 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 118.195 -0.736 . . . . 0.0 112.896 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.5 m -74.8 -10.52 59.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 178.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -71.35 129.31 38.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.892 0.853 . . . . 0.0 110.868 -178.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 . . . . . 0 C--N 1.322 -0.606 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.704 -177.363 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 . . . . . 0 N--CA 1.467 0.393 0 CA-C-O 121.122 0.487 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.36 -30.86 69.82 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -68.28 -39.54 82.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.4 mtt -68.16 -28.92 67.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.71 -35.21 79.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.342 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -65.27 -49.54 69.19 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 178.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -60.38 -42.15 95.24 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.492 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -61.46 -40.72 95.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.66 -43.46 93.55 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 70.4 mt -65.02 -37.94 89.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.164 0.507 . . . . 0.0 110.148 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 35.4 m -69.25 -34.67 75.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.409 0.623 . . . . 0.0 110.382 177.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.28 -45.88 78.93 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.353 -178.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.7 p -63.78 -34.04 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.068 0.849 . . . . 0.0 110.959 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.4 tm? . . . . . 0 C--O 1.218 -0.586 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.591 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.1 tp . . . . . 0 N--CA 1.472 0.634 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.62 -37.96 80.04 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.905 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -62.52 -35.9 80.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.545 -175.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -62.52 -48.28 80.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 21.0 m -69.35 -37.33 77.6 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.412 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -57.17 -51.3 69.86 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.518 0.727 . . . . 0.0 110.296 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -69.29 -29.75 67.69 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.625 -0.672 . . . . 0.0 111.098 178.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -68.48 -36.06 78.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.814 -0.554 . . . . 0.0 111.044 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.491 HD11 HD11 ' A' ' 125' ' ' LEU . 13.9 mm -72.34 -38.88 62.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.86 84.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.0 95.41 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.612 178.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -60.67 -45.6 93.52 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 122.708 0.403 . . . . 0.0 110.619 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.11 -46.32 78.03 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.711 0.291 . . . . 0.0 110.562 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.57 -37.91 80.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.951 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -63.98 -31.87 73.21 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.997 -0.439 . . . . 0.0 110.479 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.2 t -79.17 9.42 4.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 122.883 0.473 . . . . 0.0 111.52 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 92.17 1.05 70.07 Favored Glycine 0 N--CA 1.453 -0.189 0 N-CA-C 116.295 1.278 . . . . 0.0 116.295 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -64.74 126.08 26.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.278 1.039 . . . . 0.0 109.454 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.93 132.11 11.58 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.8 t -77.34 117.51 22.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.45 HD11 HD22 ' A' ' 43' ' ' LEU . 63.4 mt -87.02 -47.01 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -149.78 123.15 9.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.297 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.532 0 N-CA-C 104.137 -2.542 . . . . 0.0 104.137 173.488 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t0 . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -141.92 150.36 41.38 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -178.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.3 mt -138.19 127.65 33.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -103.6 130.0 50.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.51 138.13 54.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 123.626 0.77 . . . . 0.0 110.239 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -92.37 134.72 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 112.12 15.42 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 122.133 0.173 . . . . 0.0 110.74 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.81 -26.98 9.14 Favored 'Trans proline' 0 C--N 1.352 0.759 0 N-CA-C 114.932 1.089 . . . . 0.0 114.932 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -73.77 -5.02 38.22 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 57.62 42.19 24.38 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -176.111 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 p -70.0 -177.68 1.4 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 113.338 -1.755 . . . . 0.0 112.367 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.1 m -56.18 -30.36 62.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.091 176.433 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' A' ' 81' ' ' LYS . 84.3 m-70 -92.78 134.54 34.95 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -78.53 -45.45 21.88 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.45 HD22 HD11 ' A' ' 23' ' ' ILE . 84.6 mt -141.84 164.74 29.37 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.548 -174.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 85.6 t -133.59 138.88 50.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -121.91 128.15 51.23 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -98.17 131.97 44.09 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -136.19 141.31 44.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 118.134 0.425 . . . . 0.0 110.204 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.8 95.59 4.48 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -176.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -151.67 146.26 25.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 178.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -86.7 151.57 23.29 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.3 mt -138.73 129.12 25.86 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 122.251 0.22 . . . . 0.0 110.645 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -91.51 -37.3 13.22 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.974 0.416 . . . . 0.0 110.302 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -129.56 147.79 51.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.422 ' HD2' HD11 ' A' ' 99' ' ' ILE . 24.2 ptt-85 -65.38 -22.16 66.76 Favored 'General case' 0 CA--C 1.507 -0.708 0 O-C-N 121.645 -0.659 . . . . 0.0 111.945 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -62.09 -31.04 71.43 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.01 -39.35 63.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.7 ttm -62.51 -50.48 71.24 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.489 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.9 m -60.36 -31.97 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.39 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -69.16 -34.0 74.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.664 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -63.99 -40.7 96.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.403 0.62 . . . . 0.0 109.669 177.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.431 HG23 HG11 ' A' ' 111' ' ' VAL . 3.1 mt -70.88 -33.3 51.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.777 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -62.61 -32.75 73.82 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 176.21 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -67.91 -49.88 59.35 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.42 -39.25 70.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.231 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.97 -37.28 81.88 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.06 -42.22 80.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.602 0.715 . . . . 0.0 109.186 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -62.43 -42.49 99.49 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.407 0.622 . . . . 0.0 109.738 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.73 -42.96 83.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.953 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -66.99 -33.47 75.64 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.101 -179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -41.78 86.81 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 176.366 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 95.3 t -73.02 -38.76 56.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.49 -35.33 77.37 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.288 -0.882 . . . . 0.0 111.595 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 -58.33 -39.94 80.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 109.87 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -73.41 -20.67 60.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.0 mp -106.01 -15.73 14.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.09 4.43 42.46 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.778 1.071 . . . . 0.0 115.778 178.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -76.89 135.63 38.83 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.632 -0.922 . . . . 0.0 109.338 -178.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -66.84 -20.66 65.97 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 -175.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.424 HH21 ' CD ' ' A' ' 105' ' ' GLU . 40.6 ttt180 -152.06 154.08 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.6 151.39 50.25 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 177.038 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.429 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 85.7 mttt -126.11 117.46 23.21 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 170.309 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -116.81 126.75 53.53 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.69 123.92 34.68 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 176.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -119.26 109.64 16.07 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.83 112.84 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -176.141 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.16 133.03 35.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 122.87 0.468 . . . . 0.0 110.066 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -108.38 110.12 21.6 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 95.0 p -130.89 152.75 49.88 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 24.1 m -67.22 -46.51 73.6 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.864 0.84 . . . . 0.0 109.226 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -147.24 161.11 41.6 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.96 158.65 34.63 Favored Pre-proline 0 C--N 1.312 -1.058 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.797 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -54.02 150.84 29.54 Favored 'Trans proline' 0 C--N 1.349 0.563 0 N-CA-C 116.254 1.598 . . . . 0.0 116.254 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.5 m -76.5 -11.96 14.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.88 101.66 8.03 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 40.14 27.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 119.442 3.127 . . . . 0.0 119.442 172.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.4 p-90 -59.72 -20.97 59.86 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.47 -0.769 . . . . 0.0 112.88 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -60.08 -31.29 69.88 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -175.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -66.15 -34.63 78.48 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.422 HD11 ' HD2' ' A' ' 54' ' ' ARG . 11.7 mm -65.37 -43.89 94.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.502 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.33 -1.27 20.08 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -111.98 -2.82 14.99 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -103.31 115.23 30.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.91 -175.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.1 m -68.24 126.59 30.03 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 172.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -88.32 128.05 35.49 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.424 ' CD ' HH21 ' A' ' 79' ' ' ARG . 8.0 mt-10 -126.91 140.65 52.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.453 0.644 . . . . 0.0 111.433 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -140.87 75.49 1.51 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.179 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.89 -111.97 4.14 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 119.897 -1.144 . . . . 0.0 111.609 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 41.1 p -80.23 13.21 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.83 137.97 55.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.0 m -133.58 133.6 42.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.431 HG11 HG23 ' A' ' 61' ' ' ILE . 84.2 t -123.59 138.58 52.93 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.875 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -102.46 99.64 13.62 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.84 120.01 2.99 Favored 'Trans proline' 0 C--N 1.349 0.597 0 CA-C-O 121.395 0.498 . . . . 0.0 113.035 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -127.22 145.4 50.78 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.5 tt -138.72 139.16 41.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.3 m -116.83 133.71 62.68 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-O 122.109 0.957 . . . . 0.0 108.484 174.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.46 152.64 27.27 Favored 'General case' 0 C--O 1.207 -1.152 0 CA-C-N 114.363 -1.289 . . . . 0.0 108.456 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.4 -41.21 8.55 Favored Glycine 0 C--N 1.317 -0.509 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.8 t -61.74 -26.19 67.91 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 27.0 ptm -131.41 32.87 4.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.201 1.001 . . . . 0.0 110.573 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 28.1 tp -51.3 -41.49 60.53 Favored 'General case' 0 C--O 1.211 -0.959 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -174.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.744 -176.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -78.37 -40.14 37.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.618 0.723 . . . . 0.0 111.936 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.49 -39.06 85.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.5 0.667 . . . . 0.0 112.508 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.491 HD11 HD11 ' A' ' 11' ' ' ILE . 3.0 tm? -63.47 -43.32 97.66 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.061 -0.399 . . . . 0.0 111.268 -177.339 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -72.58 -14.7 61.68 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.678 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.2 -32.09 62.91 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.3 t -92.08 -43.65 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-O 121.245 0.545 . . . . 0.0 110.264 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -124.66 78.05 63.73 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.187 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.11 -11.17 31.03 Favored 'Trans proline' 0 C--N 1.346 0.446 0 N-CA-C 114.197 0.807 . . . . 0.0 114.197 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 19.3 t -78.0 -14.85 59.37 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.278 0.561 . . . . 0.0 110.426 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -80.88 124.93 29.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.314 0.578 . . . . 0.0 110.254 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 38.3 mtp-105 . . . . . 0 C--O 1.218 -0.599 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.197 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 52.7 m-20 . . . . . 0 N--CA 1.467 0.413 0 CA-C-O 120.791 0.329 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.19 90.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.81 0.338 . . . . 0.0 110.608 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.37 -43.46 70.08 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 74.4 mtp -61.35 -27.61 68.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.265 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.859 -0.526 . . . . 0.0 110.683 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -64.41 -45.95 85.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.08 -42.54 94.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.42 0.628 . . . . 0.0 110.184 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 70.5 mmt-85 -66.5 -40.16 89.1 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.814 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -62.68 -42.52 99.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.229 0.468 . . . . 0.0 111.262 176.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.34 -39.42 94.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 84.8 p -71.58 -27.84 63.42 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.744 -0.598 . . . . 0.0 110.804 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.1 tt -72.33 -43.29 64.33 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.838 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 8.8 p -63.62 -36.19 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 118.935 0.789 . . . . 0.0 108.883 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.222 -0.356 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.657 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 121.129 0.49 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.62 -46.94 80.47 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.55 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.483 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 8.2 pt-20 -73.81 -29.14 61.99 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.698 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -56.93 -45.46 82.72 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.211 -1.404 . . . . 0.0 107.211 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.9 m -71.66 -44.52 64.15 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.292 0.568 . . . . 0.0 111.519 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.483 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 73.0 t80 -55.51 -51.25 67.65 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 123.873 0.869 . . . . 0.0 113.15 -178.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -68.64 -31.28 70.31 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.98 -0.45 . . . . 0.0 110.341 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -70.84 -35.14 72.32 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.902 -0.499 . . . . 0.0 111.259 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 mm -69.06 -40.75 81.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 176.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.7 90.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.17 84.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.002 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -57.06 -47.28 81.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -68.69 -46.18 69.72 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.544 0.202 . . . . 0.0 111.544 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.11 -44.49 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-O 121.319 0.58 . . . . 0.0 110.153 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -72.44 -7.62 50.78 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -97.97 9.05 43.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.49 -6.17 45.16 Favored Glycine 0 CA--C 1.517 0.202 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 175.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -66.6 133.74 50.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 118.091 0.945 . . . . 0.0 109.598 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.5 115.65 4.36 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 107.47 -2.252 . . . . 0.0 107.47 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.5 p -71.08 130.13 34.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.9 mt -94.34 -42.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 -178.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -147.57 138.48 23.47 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.441 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.597 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 N--CA 1.461 0.122 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -125.64 139.31 53.67 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.857 -1.065 . . . . 0.0 112.919 -172.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 80.8 mt -135.03 133.81 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -112.14 135.61 52.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -131.14 129.95 42.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -83.92 132.73 34.75 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.26 118.85 71.02 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -76.81 -23.99 10.44 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 117.408 -1.261 . . . . 0.0 115.089 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -75.49 -17.95 59.97 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -177.225 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt 61.03 37.77 17.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.484 1.135 . . . . 0.0 110.266 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -173.34 0.07 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 112.754 -2.021 . . . . 0.0 110.653 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.8 p -49.88 -42.61 48.21 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 89.1 m-70 -78.8 138.25 38.11 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.068 0.461 . . . . 0.0 111.168 174.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -101.71 -37.2 8.43 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.058 176.004 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.4 mt -139.78 163.79 31.67 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -172.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -131.52 134.95 60.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 174.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -119.57 113.72 21.15 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 84.9 mt -95.61 125.0 39.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -136.35 130.47 32.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.624 0.193 . . . . 0.0 110.598 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -107.95 114.18 27.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.072 0.463 . . . . 0.0 109.959 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -151.64 142.71 23.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.105 -176.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -93.05 98.72 11.51 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -87.06 103.31 15.25 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.946 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -68.49 -42.6 78.42 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.784 0.802 . . . . 0.0 111.958 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -121.71 156.4 33.17 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.859 -0.525 . . . . 0.0 111.478 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -66.73 -16.06 63.98 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.147 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -63.74 -40.16 96.06 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -69.96 -36.73 75.48 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 55.7 ttm -61.33 -50.24 73.74 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.86 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.7 m -70.09 -31.95 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.243 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 -66.9 -34.65 78.25 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.206 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -64.56 -33.97 77.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mm -71.84 -30.89 39.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 O-C-N 121.634 -0.666 . . . . 0.0 110.956 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -64.23 -40.34 95.85 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.38 -44.25 91.95 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 121.935 0.874 . . . . 0.0 109.21 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -62.68 -39.67 94.69 Favored 'General case' 0 C--O 1.206 -1.222 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.233 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.49 -40.44 82.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 118.998 0.817 . . . . 0.0 111.518 -177.124 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -66.8 -41.47 87.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.565 0.697 . . . . 0.0 109.832 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.78 -47.29 84.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.522 0.677 . . . . 0.0 110.141 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.86 -42.64 97.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.258 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.42 -31.7 72.07 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 119.97 1.259 . . . . 0.0 111.401 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -64.72 -44.1 91.31 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.2 t -68.99 -36.03 71.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.185 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ttp-105 -59.24 -35.2 73.24 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.801 -0.562 . . . . 0.0 110.687 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -62.11 -39.04 91.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -73.4 -39.86 64.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.378 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.28 -17.96 61.26 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.17 -2.98 32.82 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 116.163 1.225 . . . . 0.0 116.163 177.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -71.39 152.6 43.0 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.384 1.092 . . . . 0.0 108.681 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.62 -27.19 61.99 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.795 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -142.03 159.43 42.24 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -122.19 141.78 51.11 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 53.5 tttp -123.35 127.95 49.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.4 tp -129.3 123.71 32.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -86.46 109.43 19.06 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -98.84 127.54 44.79 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 22.7 t -124.21 113.5 36.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-O 121.169 0.509 . . . . 0.0 111.469 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -84.18 142.81 30.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.78 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.55 109.82 16.16 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 173.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.0 p -125.59 161.09 27.99 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -173.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.3 m -67.17 -49.28 65.29 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -148.72 156.88 42.97 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 101.798 -3.408 . . . . 0.0 101.798 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.29 159.19 86.05 Favored Pre-proline 0 C--N 1.313 -0.989 0 O-C-N 124.268 0.98 . . . . 0.0 109.294 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.16 154.12 29.82 Favored 'Trans proline' 0 C--N 1.353 0.765 0 N-CA-C 115.081 1.147 . . . . 0.0 115.081 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.1 m -63.26 -24.48 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 118.089 2.626 . . . . 0.0 118.089 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -155.44 145.03 21.2 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 t0 45.88 19.48 0.06 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 117.896 2.554 . . . . 0.0 117.896 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 29.9 p-90 -76.08 -23.54 55.01 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 120.864 -1.147 . . . . 0.0 111.967 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.65 -37.7 76.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -18.4 64.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 111.832 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.7 mm -72.93 -40.17 59.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.88 0.61 17.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.153 0.501 . . . . 0.0 111.566 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -111.85 3.13 17.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.426 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -122.17 155.87 34.89 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.293 0.568 . . . . 0.0 111.396 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -102.0 126.04 48.82 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -83.46 112.56 20.07 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -118.29 123.14 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.518 0.675 . . . . 0.0 112.337 -176.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -124.24 75.49 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.57 -112.32 4.89 Favored Glycine 0 C--O 1.226 -0.401 0 C-N-CA 119.912 -1.137 . . . . 0.0 111.504 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 50.9 p -72.85 11.92 0.6 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 87.5 t -127.83 140.51 48.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 -178.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.2 p -138.05 125.39 21.8 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 105.77 -1.937 . . . . 0.0 105.77 169.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -128.85 133.4 66.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -113.45 116.74 45.94 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.74 156.13 27.47 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 118.109 -0.794 . . . . 0.0 112.892 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -147.54 155.05 41.48 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 102.889 -3.004 . . . . 0.0 102.889 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 16.3 tt -145.98 138.58 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.262 0.553 . . . . 0.0 109.733 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 8.2 m -115.9 142.06 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.868 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 172.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.95 150.72 40.05 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.593 -2.373 . . . . 0.0 104.593 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.98 -22.68 64.99 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.339 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.0 p -72.83 -30.05 63.72 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -176.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 mtm -129.25 20.84 5.75 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.378 0.609 . . . . 0.0 110.593 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.4 tt -42.18 -42.49 3.02 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 116.817 2.154 . . . . 0.0 116.817 -173.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 52.4 ptt85 -62.82 -40.53 97.68 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.632 -0.667 . . . . 0.0 111.934 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -78.66 -40.11 35.0 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.705 0.764 . . . . 0.0 109.867 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -59.22 -42.72 91.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.484 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.3 mt -62.22 -43.5 98.68 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -75.35 -14.14 60.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.965 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.59 -39.74 62.03 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.417 HG13 ' CD1' ' A' ' 129' ' ' PHE . 5.7 p -95.8 -38.54 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' PHE . . . . . 0.417 ' CD1' HG13 ' A' ' 128' ' ' VAL . 49.1 m-85 -125.21 77.32 67.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 123.14 0.576 . . . . 0.0 110.393 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.49 -7.45 20.31 Favored 'Trans proline' 0 C--N 1.345 0.393 0 N-CA-C 114.211 0.812 . . . . 0.0 114.211 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.4 m -92.67 1.68 57.13 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -81.45 140.37 34.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.061 0.458 . . . . 0.0 110.237 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 . . . . . 0 C--N 1.327 -0.37 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.446 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 . . . . . 0 C--O 1.216 -0.672 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.19 81.4 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 122.057 -0.402 . . . . 0.0 110.188 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.43 -43.99 84.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 38.0 mmt -62.63 -36.7 83.64 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.412 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.25 -41.98 85.42 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.101 -0.374 . . . . 0.0 110.288 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -65.2 -50.41 66.0 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.791 0.329 . . . . 0.0 110.311 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -61.18 -41.86 97.54 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.378 0.608 . . . . 0.0 111.669 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -67.49 -36.49 81.2 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.84 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -62.33 -44.67 95.96 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.253 0.933 . . . . 0.0 111.365 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.61 -38.51 87.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 19.5 m -69.98 -35.2 74.25 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.448 0.642 . . . . 0.0 111.428 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.92 -37.7 86.76 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 123.794 0.838 . . . . 0.0 110.514 -178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.2 t -57.45 -47.29 85.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.321 -0.634 0 CA-C-O 121.487 0.66 . . . . 0.0 109.914 179.87 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.215 -0.731 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.57 -33.22 75.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.359 0.599 . . . . 0.0 111.82 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.28 -30.07 71.28 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -62.06 -41.07 97.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.482 ' HA ' ' HE3' ' A' ' 10' ' ' LYS . 44.6 m -69.41 -44.11 72.06 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.461 -0.149 . . . . 0.0 110.973 176.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -52.35 -47.4 66.11 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.588 0.355 . . . . 0.0 110.557 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -67.8 -43.47 79.58 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 7' ' ' THR . 19.9 pttp -73.51 -25.31 60.37 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.029 -1.044 . . . . 0.0 112.243 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.0 mm -72.31 -38.6 61.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 174.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.23 -40.91 78.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.5 -42.67 99.14 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.504 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -34.18 75.92 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.745 -0.597 . . . . 0.0 112.45 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.8 -44.46 63.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.9 t -53.64 -42.73 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.149 171.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.51 -31.07 70.14 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.72 -0.613 . . . . 0.0 110.66 178.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.3 m -82.56 9.31 9.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.17 1.26 62.9 Favored Glycine 0 CA--C 1.517 0.173 0 N-CA-C 115.827 1.091 . . . . 0.0 115.827 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.429 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 32.7 m-85 -71.04 126.6 30.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.773 0.787 . . . . 0.0 109.662 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.23 113.72 3.78 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 107.338 -2.305 . . . . 0.0 107.338 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.9 p -70.31 128.67 33.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 75.8 mt -86.78 -38.84 12.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -144.16 134.64 24.68 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.594 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.977 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 . . . . . 0 C--O 1.232 0.174 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -135.11 137.18 42.56 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.4 mt -125.3 131.5 72.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -111.38 139.57 46.68 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.01 129.73 42.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.997 0.919 . . . . 0.0 108.742 -177.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -82.05 130.61 35.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.72 113.03 22.91 Favored Pre-proline 0 CA--C 1.549 0.904 0 CA-C-N 117.715 0.234 . . . . 0.0 110.486 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 88.0 Cg_endo -74.7 -18.71 19.32 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 117.825 -0.983 . . . . 0.0 113.36 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.84 -23.34 60.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.851 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.0 mttt 60.42 38.84 19.11 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.2 p -71.7 -177.63 1.98 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 112.963 -1.926 . . . . 0.0 112.103 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.9 m -61.26 -10.01 6.09 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.345 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.68 132.32 54.29 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.33 -40.56 10.85 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -174.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -139.16 162.12 35.73 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.59 135.47 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 35.0 ttt-85 -124.66 116.31 22.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.519 0.728 . . . . 0.0 109.828 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.31 132.15 36.35 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 103.39 -2.818 . . . . 0.0 103.39 175.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -136.53 136.03 39.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.826 0.285 . . . . 0.0 110.901 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.53 113.55 27.19 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.787 -0.571 . . . . 0.0 110.543 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -151.62 149.88 29.65 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -108.34 131.42 54.75 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.5 mt -124.1 120.62 32.9 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -171.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -88.49 -37.81 15.48 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.887 0.851 . . . . 0.0 111.585 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -129.67 144.71 51.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.727 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -64.33 -17.54 63.78 Favored 'General case' 0 C--O 1.215 -0.736 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -60.75 -33.33 72.77 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.518 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -77.65 -34.91 52.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.065 0.459 . . . . 0.0 110.209 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.0 ttt -60.81 -48.83 80.0 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.559 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.2 m -66.31 -31.84 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.433 0.635 . . . . 0.0 110.086 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -38.21 87.15 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.198 -177.278 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -62.36 -38.99 91.68 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.3 mm -68.66 -31.81 52.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.949 -0.47 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -61.66 -39.48 91.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -44.32 58.17 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.689 0.757 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -59.53 -39.74 84.92 Favored 'General case' 0 C--O 1.21 -0.989 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.097 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.86 90.65 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.576 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -70.92 -35.95 72.46 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 119.887 -0.725 . . . . 0.0 109.759 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.83 -44.77 96.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.2 t -66.9 -39.76 84.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -62.21 -33.53 74.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 119.654 1.116 . . . . 0.0 111.187 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.8 ttt-85 -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -69.03 -37.41 77.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.935 0.398 . . . . 0.0 110.014 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -41.35 88.13 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.855 -0.528 . . . . 0.0 111.052 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -66.79 -40.11 88.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -63.48 -40.19 96.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.022 0.439 . . . . 0.0 110.861 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -78.02 -13.96 59.68 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.65 1.47 38.06 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -68.36 156.28 38.1 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.008 -0.701 . . . . 0.0 110.082 -177.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -39.35 93.85 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -149.41 167.99 24.65 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 103.453 -2.795 . . . . 0.0 103.453 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 ttp -129.18 147.97 51.08 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 118.746 0.703 . . . . 0.0 109.979 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -116.33 123.7 48.27 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 123.521 0.513 . . . . 0.0 110.559 177.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.4 tp -116.87 128.12 54.94 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.253 0.346 . . . . 0.0 111.405 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -91.32 110.83 22.13 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -102.54 129.12 48.99 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 32.6 t -121.05 109.38 25.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -76.84 142.95 40.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -119.35 107.62 13.59 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 172.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 97.7 p -126.74 155.65 42.41 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.33 -171.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 18.2 m -67.09 -47.91 69.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -147.0 158.19 43.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.813 -2.662 . . . . 0.0 103.813 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.92 157.14 39.83 Favored Pre-proline 0 C--N 1.312 -1.025 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.087 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -55.08 143.73 72.53 Favored 'Trans proline' 0 C--N 1.347 0.46 0 N-CA-C 116.374 1.644 . . . . 0.0 116.374 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.47 -21.72 15.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.638 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -90.81 91.98 8.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.872 178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.9 t0 14.88 70.98 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 117.773 2.509 . . . . 0.0 117.773 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -74.01 -16.85 61.04 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.608 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.75 -35.22 79.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.224 -0.298 . . . . 0.0 110.553 -175.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -60.81 -23.54 65.14 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.825 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.1 mm -79.04 -44.46 24.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 -176.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.04 -1.58 23.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.256 0.55 . . . . 0.0 111.917 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -108.59 5.35 24.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.503 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -124.72 132.27 53.39 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.153 0.502 . . . . 0.0 110.872 178.813 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -77.68 125.2 28.98 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 173.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -82.71 120.6 25.79 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -126.23 127.64 45.97 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.793 0.806 . . . . 0.0 110.008 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -139.3 114.71 9.79 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 60.21 -126.45 41.49 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 119.968 -1.11 . . . . 0.0 111.439 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.0 p -96.3 29.05 2.98 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.11 -0.641 . . . . 0.0 111.065 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 48.5 t -124.61 145.52 31.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.852 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.9 m -132.6 134.95 45.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.66 138.95 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.786 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 109.06 60.48 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -87.94 63.95 3.55 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.151 2.567 . . . . 0.0 117.171 -175.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 156.68 38.98 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.819 -0.551 . . . . 0.0 110.589 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -147.91 142.36 19.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 O-C-N 121.887 -0.508 . . . . 0.0 110.116 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.4 t -117.69 120.84 65.93 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.29 136.22 40.52 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.303 0.573 . . . . 0.0 109.857 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.45 -34.93 91.23 Favored Glycine 0 CA--C 1.51 -0.232 0 N-CA-C 114.868 0.707 . . . . 0.0 114.868 -176.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.2 t -53.16 -26.8 18.31 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.9 ptm -140.56 32.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.634 0.73 . . . . 0.0 109.808 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -46.64 -36.55 7.13 Favored 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 mtm180 -58.36 -46.99 85.23 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 121.496 -0.752 . . . . 0.0 111.175 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -78.65 -38.66 38.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.103 0.954 . . . . 0.0 111.922 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.63 -35.43 72.93 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.37 -41.05 73.61 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.887 -0.508 . . . . 0.0 110.684 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -69.3 -16.14 63.5 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.629 -177.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.82 65.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.067 0.461 . . . . 0.0 109.836 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.8 t -97.57 -43.84 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.457 0.646 . . . . 0.0 110.643 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -129.47 78.14 76.15 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.113 -178.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.05 -12.67 34.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 CA-C-O 121.381 0.492 . . . . 0.0 112.998 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -11.59 59.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -94.92 124.93 39.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.215 0.531 . . . . 0.0 111.164 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 . . . . . 0 C--N 1.324 -0.532 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.687 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 m120 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 120.044 -0.027 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.21 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.625 0.25 . . . . 0.0 110.567 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -66.38 -35.53 80.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.499 0.666 . . . . 0.0 109.348 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 77.0 mtp -71.04 -30.8 67.08 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.787 -0.571 . . . . 0.0 109.998 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -70.95 -30.41 66.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -61.19 -52.22 65.73 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.4 -37.2 86.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.536 0.684 . . . . 0.0 110.449 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -60.01 -46.87 88.06 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.036 176.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -65.88 -41.86 91.07 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.97 -36.88 82.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 29.3 m -76.12 -32.94 59.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.56 0.695 . . . . 0.0 112.21 176.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -62.31 -42.78 99.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -176.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.5 p -57.73 -39.18 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.829 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 110.027 176.837 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp . . . . . 0 C--O 1.222 -0.384 0 CA-C-O 121.1 0.476 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.29 -35.35 78.75 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.81 -27.44 68.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.073 0.464 . . . . 0.0 110.222 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -65.13 -50.67 65.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.534 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -64.47 -39.79 94.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.256 0.551 . . . . 0.0 110.309 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -55.42 -52.44 63.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.318 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -71.54 -27.1 62.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.346 -0.846 . . . . 0.0 111.964 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -64.97 -39.52 93.6 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 22.2 mm -71.85 -38.2 64.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 178.443 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.49 -44.89 81.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 176.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.73 93.23 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.674 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -59.32 -47.03 86.94 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 122.747 0.419 . . . . 0.0 111.585 -179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.7 mt -68.39 -47.31 67.66 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.698 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -57.84 -39.77 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.886 -0.509 . . . . 0.0 110.519 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.32 -25.56 67.95 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 121.871 -0.518 . . . . 0.0 111.276 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -84.77 4.89 30.75 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.796 0.438 . . . . 0.0 111.366 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.14 -1.68 47.38 Favored Glycine 0 CA--C 1.518 0.249 0 N-CA-C 115.939 1.135 . . . . 0.0 115.939 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.452 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.3 m-85 -65.78 129.17 38.84 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 117.736 0.768 . . . . 0.0 110.864 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.3 134.88 13.69 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.6 t -79.38 122.4 34.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 76.7 mt -90.73 -44.96 14.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 176.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -155.0 146.24 22.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 177.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 178.739 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 . . . . . 0 N--CA 1.465 0.311 0 CA-C-O 120.838 0.351 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -129.09 151.75 49.43 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.2 mt -134.54 134.78 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -115.1 131.58 56.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -127.62 132.93 49.7 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.655 0.782 . . . . 0.0 109.908 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -86.22 134.84 33.75 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.13 109.75 13.67 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.5 Cg_endo -74.38 -24.41 14.25 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 117.889 -0.941 . . . . 0.0 114.054 -174.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -74.88 -4.45 37.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.859 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt 44.02 40.4 3.35 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 122.948 1.356 . . . . 0.0 111.875 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.3 m -67.21 -172.96 0.24 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 112.621 -2.081 . . . . 0.0 110.613 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.9 t -50.35 -35.72 29.12 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -83.3 138.95 33.34 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 173.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -98.04 -37.84 9.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -142.39 161.59 37.65 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.853 -175.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.5 t -132.55 136.25 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -122.11 130.18 53.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 176.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.06 128.72 54.62 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -136.43 143.56 43.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.87 99.81 6.32 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -151.69 149.47 29.13 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.49 151.56 20.72 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -133.18 124.54 27.63 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.275 0.23 . . . . 0.0 111.468 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -75.96 -42.7 47.7 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -136.04 151.03 49.43 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.203 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -63.98 -18.72 64.57 Favored 'General case' 0 C--O 1.212 -0.881 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -60.61 -33.17 72.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -77.22 -40.92 43.26 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.65 -40.88 89.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.0 -31.85 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 O-C-N 121.79 -0.569 . . . . 0.0 111.256 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -70.65 -34.62 72.24 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.628 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -59.32 -38.66 80.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mm -71.63 -31.31 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 121.99 -0.444 . . . . 0.0 111.457 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -63.07 -39.61 95.22 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -68.19 -45.41 73.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.705 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -58.05 -45.11 87.55 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.189 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.79 -31.18 69.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.56 -45.43 68.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.339 0.59 . . . . 0.0 109.454 177.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -61.51 -44.06 97.74 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.83 0.824 . . . . 0.0 109.299 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 73.6 t -65.73 -32.81 59.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.427 -178.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 121.764 -0.585 . . . . 0.0 109.434 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -62.16 -46.03 90.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.96 0.41 . . . . 0.0 110.273 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 79.7 t -61.74 -40.43 86.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.888 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.412 HH21 ' HB2' ' A' ' 75' ' ' LEU . 2.7 tpm_? -66.48 -40.26 89.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.16 -0.963 . . . . 0.0 111.877 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -55.47 -46.07 76.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -73.41 -18.79 61.11 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.412 ' HB2' HH21 ' A' ' 72' ' ' ARG . 97.3 mt -99.27 -10.04 22.88 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -177.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.81 -1.53 5.71 Favored Glycine 0 CA--C 1.531 1.052 0 N-CA-C 120.935 3.134 . . . . 0.0 120.935 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -67.9 154.19 42.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.161 1.481 . . . . 0.0 108.107 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -65.44 -29.51 70.2 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 ttt85 -151.41 147.92 27.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.48 150.32 23.5 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.171 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -134.43 122.22 22.21 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 168.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -124.0 129.74 51.42 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.8 tp -92.29 121.84 34.19 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -115.81 108.57 16.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 5.4 t -108.45 117.34 53.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -84.68 150.58 25.03 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -129.05 116.77 19.81 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -139.59 158.24 44.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.97 0.414 . . . . 0.0 111.887 -174.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 55.0 m -69.23 -49.23 58.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -128.28 170.43 13.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.67 154.17 43.3 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.75 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.15 146.17 89.43 Favored 'Trans proline' 0 C--N 1.348 0.551 0 N-CA-C 114.579 0.953 . . . . 0.0 114.579 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.9 m -82.17 -6.01 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -113.14 100.43 8.59 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.438 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.4 t0 14.43 60.41 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 117.981 2.585 . . . . 0.0 117.981 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 p-90 -73.1 -17.45 61.4 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.99 -32.45 73.99 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.03 -28.38 67.7 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.178 0.514 . . . . 0.0 110.137 175.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.1 mm -75.37 -40.66 42.7 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 O-C-N 122.013 -0.429 . . . . 0.0 110.588 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.11 62.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 122.138 0.97 . . . . 0.0 109.306 177.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -88.6 -3.02 58.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.849 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -126.38 130.39 50.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.754 0.788 . . . . 0.0 112.296 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.3 m -76.41 125.62 29.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -83.3 123.08 29.27 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 176.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -127.65 139.19 52.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.774 0.797 . . . . 0.0 111.649 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -139.97 82.06 1.85 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.627 -1.17 . . . . 0.0 108.928 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.06 -112.66 5.02 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 119.698 -1.239 . . . . 0.0 111.726 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 p -86.2 8.69 20.13 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.76 0.424 . . . . 0.0 111.281 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -110.0 141.37 25.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 122.574 0.35 . . . . 0.0 110.637 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.0 t -135.46 137.4 42.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.104 -2.924 . . . . 0.0 103.104 171.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 99.8 t -133.77 136.5 53.99 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -105.03 104.18 45.51 Favored Pre-proline 0 N--CA 1.433 -1.321 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.467 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.99 147.71 24.2 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 117.387 -1.275 . . . . 0.0 112.191 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 155.91 39.9 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.9 tt -149.81 142.16 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.093 -1.817 . . . . 0.0 106.093 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.35 103.84 15.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.64 138.47 31.44 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.43 -22.92 66.14 Favored Glycine 0 C--N 1.321 -0.29 0 CA-C-N 116.072 -0.513 . . . . 0.0 113.977 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 119' ' ' THR . 22.0 p -59.21 -29.27 67.37 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -177.411 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.4 ptm -144.65 36.52 1.18 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 109.261 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -44.61 -40.35 5.72 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -173.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -58.24 -51.45 69.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 118.387 0.54 . . . . 0.0 111.411 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -76.99 -34.88 57.49 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.327 0.584 . . . . 0.0 112.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -67.43 -36.27 80.91 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.596 0.712 . . . . 0.0 111.707 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.85 -44.1 77.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.169 -179.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -71.88 -14.29 61.9 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.321 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.23 -26.42 62.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.442 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.1 p -108.73 -37.83 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 120.635 0.255 . . . . 0.0 111.465 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -125.19 75.29 67.92 Favored Pre-proline 0 CA--C 1.536 0.421 0 O-C-N 121.863 -0.523 . . . . 0.0 111.289 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.22 -7.42 21.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 N-CA-C 114.724 1.009 . . . . 0.0 114.724 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 20.3 t -85.85 -5.82 59.18 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.971 -0.456 . . . . 0.0 111.039 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -89.37 130.86 35.67 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 71.8 mtm-85 . . . . . 0 C--N 1.325 -0.487 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 -178.662 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 . . . . . 0 C--O 1.214 -0.768 0 CA-C-O 121.048 0.451 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.78 -35.86 64.28 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 111.905 176.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.61 -43.09 73.45 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 121.954 -0.466 . . . . 0.0 109.816 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 33.3 mmt -64.56 -33.24 75.44 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.87 79.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.222 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -68.06 -43.83 77.75 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -65.89 -39.43 90.63 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.5 0.667 . . . . 0.0 110.372 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -62.92 -38.8 92.43 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -64.71 -40.33 95.17 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 0.0 111.86 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 30.3 mt -64.54 -36.58 84.68 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 122.12 -0.363 . . . . 0.0 111.059 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 7.6 p -76.06 -32.17 59.17 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.585 -0.697 . . . . 0.0 111.281 174.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -42.62 98.09 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 p -58.99 -39.2 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.413 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.329 -0.314 0 O-C-N 121.473 -0.767 . . . . 0.0 110.192 177.851 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.5 tp . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 121.677 0.751 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.9 mt -73.67 -37.06 65.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.39 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.69 -34.03 77.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.631 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -59.33 -50.58 73.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 m -66.0 -41.9 90.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.89 0.376 . . . . 0.0 111.283 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -57.21 -52.13 66.57 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.113 0.565 . . . . 0.0 111.95 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.402 ' CZ3' HD11 ' A' ' 31' ' ' ILE . 92.6 m95 -70.8 -30.98 67.58 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.807 -0.558 . . . . 0.0 110.656 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -69.59 -38.15 77.21 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.874 -0.516 . . . . 0.0 111.693 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.4 HD11 HD11 ' A' ' 125' ' ' LEU . 12.0 mm -70.39 -36.51 67.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.33 -43.03 83.02 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.83 -44.82 84.4 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -59.08 -45.05 91.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.228 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.6 mt -69.23 -47.61 64.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.0 p -62.4 -29.03 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.362 177.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.4 -24.94 61.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 177.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 t -87.84 8.83 24.15 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.501 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.74 2.41 61.37 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 116.79 1.476 . . . . 0.0 116.79 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.411 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 6.9 m-85 -72.48 113.05 9.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 118.182 0.991 . . . . 0.0 109.458 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.54 126.0 24.15 Favored Glycine 0 C--O 1.226 -0.39 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.538 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 70.9 t -76.42 121.95 29.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.6 mt -91.39 -42.09 13.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -153.11 145.0 23.61 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 118.273 0.488 . . . . 0.0 112.31 -179.51 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -113.43 147.07 38.5 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.402 HD11 ' CZ3' ' A' ' 9' ' ' TRP . 96.6 mt -132.76 129.57 58.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 103.069 -2.938 . . . . 0.0 103.069 169.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -108.16 129.3 55.18 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.411 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -130.1 134.72 47.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -179.358 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -84.23 136.87 33.77 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -90.97 105.76 13.41 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 118.005 0.366 . . . . 0.0 111.194 -178.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -72.06 -17.31 28.4 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 118.402 -0.599 . . . . 0.0 112.892 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.33 -15.85 62.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.0 mtmt 58.12 38.95 26.51 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -175.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -62.57 -177.43 0.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 112.945 -1.934 . . . . 0.0 112.377 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.9 m -57.21 -10.66 1.33 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.034 0.534 . . . . 0.0 111.828 175.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -127.93 151.26 49.32 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -96.9 -31.2 12.69 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.083 0.468 . . . . 0.0 109.952 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -135.33 161.91 34.07 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.5 t -123.17 133.58 68.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 ttt-85 -117.31 108.78 16.02 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 174.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.7 mt -85.89 130.53 34.52 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 103.777 -2.675 . . . . 0.0 103.777 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -134.65 123.09 23.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 117.993 0.361 . . . . 0.0 111.267 -176.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -102.69 94.55 5.68 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.04 0.447 . . . . 0.0 111.582 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -151.24 139.73 20.53 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -92.65 151.6 20.01 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -134.64 119.85 18.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.68 -173.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -86.48 -37.58 18.13 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.71 0.767 . . . . 0.0 110.52 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.5 145.79 51.41 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.135 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.66 ' HD2' HD11 ' A' ' 99' ' ' ILE . 28.0 ptt180 -66.1 -20.74 66.26 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.097 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -64.09 -33.24 75.32 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.141 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -77.64 -35.25 52.73 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.475 -0.766 . . . . 0.0 109.21 175.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 18.5 ttt -58.26 -50.41 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.954 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 29.8 m -60.61 -31.87 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -69.11 -37.94 78.65 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -59.87 -41.71 92.11 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -71.78 -36.39 58.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 121.447 -0.783 . . . . 0.0 111.72 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -65.11 -30.72 71.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -76.53 -41.72 45.73 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.618 0.723 . . . . 0.0 109.564 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -58.06 -35.0 70.72 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.272 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.44 78.57 Favored 'General case' 0 C--N 1.319 -0.759 0 O-C-N 122.056 -0.403 . . . . 0.0 111.41 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -72.89 -36.02 67.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.609 0.719 . . . . 0.0 109.168 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -43.18 99.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.92 -38.42 81.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.49 -41.15 80.16 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.419 1.009 . . . . 0.0 110.243 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.55 -41.66 99.03 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.165 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 87.5 t -69.99 -46.43 73.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.454 0.645 . . . . 0.0 109.704 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.54 -40.1 78.1 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 111.131 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -63.33 -51.72 64.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.403 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -71.12 -22.26 62.1 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.08 -4.96 57.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.886 0.374 . . . . 0.0 110.51 175.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.82 13.71 64.24 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 114.289 0.475 . . . . 0.0 114.289 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -79.64 145.4 33.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.776 -0.838 . . . . 0.0 112.605 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.1 mtp85 -72.41 -32.89 66.74 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.882 177.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -153.13 150.8 29.45 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 177.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.3 ttp -131.59 150.58 52.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -117.74 139.25 51.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -135.16 131.62 37.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.378 0.535 . . . . 0.0 110.287 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.7 tp -93.55 122.28 35.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -110.57 108.45 18.41 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.6 t -105.23 105.6 18.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 120.897 0.38 . . . . 0.0 110.801 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -75.73 144.59 41.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 174.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -121.74 104.14 9.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 103.125 -2.916 . . . . 0.0 103.125 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -123.1 156.56 34.7 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.543 0.527 . . . . 0.0 110.149 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -67.06 -52.69 39.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 110.583 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.29 -179.41 4.73 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.99 141.8 23.23 Favored Pre-proline 0 C--N 1.317 -0.832 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -57.12 142.92 94.35 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 117.696 -1.069 . . . . 0.0 113.851 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.1 m -77.65 -10.25 12.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -173.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -110.04 56.21 0.63 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.3 t0 61.76 52.53 3.48 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 123.238 1.494 . . . . 0.0 114.882 174.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -65.45 -17.88 64.89 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.349 -0.844 . . . . 0.0 112.69 175.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -58.81 -37.4 76.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -173.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.9 -18.61 65.46 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.66 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.3 mm -73.02 -37.87 54.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.11 -25.08 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.427 0.632 . . . . 0.0 110.438 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -89.15 3.14 52.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.184 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -116.95 98.49 6.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.31 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 47.1 m -68.53 126.11 28.61 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 172.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -86.25 108.44 18.38 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -110.31 101.39 10.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.76 0.79 . . . . 0.0 113.013 -176.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.2 tttm -99.48 75.58 1.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.76 -108.35 2.08 Favored Glycine 0 C--O 1.228 -0.238 0 C-N-CA 119.529 -1.319 . . . . 0.0 112.568 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 52.0 p -72.4 9.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.535 1.134 . . . . 0.0 112.965 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 99.3 t -129.49 144.82 36.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 C-N-CA 122.796 0.438 . . . . 0.0 110.471 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.0 t -136.34 118.32 15.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -118.79 126.39 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.471 -2.075 0 CA-C-O 122.74 1.257 . . . . 0.0 110.379 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -99.42 104.53 27.63 Favored Pre-proline 0 N--CA 1.419 -2.001 0 CA-C-N 111.4 -2.636 . . . . 0.0 109.474 -176.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -80.27 149.47 19.45 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 117.843 -0.971 . . . . 0.0 113.973 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.32 149.84 31.55 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.0 tt -142.72 123.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.1 t -102.57 107.84 22.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 136.16 33.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -60.7 -33.58 83.08 Favored Glycine 0 CA--C 1.511 -0.182 0 N-CA-C 114.908 0.723 . . . . 0.0 114.908 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.5 t -56.05 -23.88 36.19 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.5 ptm -140.97 35.83 1.75 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.586 1.184 . . . . 0.0 109.44 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.81 -41.94 34.39 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 -171.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -61.52 -51.36 68.93 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.16 1.8 . . . . 0.0 111.387 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -73.69 -32.94 64.2 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.828 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -72.73 -39.92 66.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.889 0.852 . . . . 0.0 111.309 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 11' ' ' ILE . 3.5 tm? -68.22 -43.47 77.93 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.751 -0.593 . . . . 0.0 110.491 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.424 -177.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.41 -32.03 62.54 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.4 t -91.21 -43.64 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.367 0.603 . . . . 0.0 110.157 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -127.39 79.61 73.0 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.036 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.6 -13.85 38.19 Favored 'Trans proline' 0 C--N 1.347 0.456 0 N-CA-C 114.535 0.937 . . . . 0.0 114.535 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.6 m -84.47 -2.46 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -76.83 137.29 39.11 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.447 0.641 . . . . 0.0 111.183 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 . . . . . 0 C--N 1.325 -0.465 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.76 178.616 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 57.8 t30 . . . . . 0 CA--C 1.533 0.311 0 CA-C-O 120.988 0.423 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.92 -38.06 72.93 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.286 -0.259 . . . . 0.0 110.705 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -64.03 -45.73 87.6 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtt -62.69 -28.95 70.3 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.675 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.08 -34.49 73.53 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 121.63 -0.669 . . . . 0.0 111.115 -178.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -66.37 -45.64 79.42 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -67.1 -38.03 84.96 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.259 0.552 . . . . 0.0 110.375 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 60.3 mtt85 -61.86 -43.49 98.73 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -63.88 -42.17 97.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 118.515 0.598 . . . . 0.0 111.887 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.5 -36.36 83.95 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 122.092 -0.38 . . . . 0.0 111.648 -178.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 10.6 p -76.14 -35.66 59.14 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.321 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -41.24 95.38 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.69 0.796 . . . . 0.0 112.837 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -63.13 -38.25 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 118.753 0.706 . . . . 0.0 111.349 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 N--CA 1.467 0.402 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.406 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 C--O 1.224 -0.28 0 CA-C-O 120.914 0.387 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 22.4 tp -60.65 -48.11 83.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.821 0.343 . . . . 0.0 110.491 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -73.75 -30.63 62.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.443 0.64 . . . . 0.0 110.804 -178.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -61.62 -43.0 99.67 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.9 m -66.34 -44.31 83.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.778 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -53.05 -55.43 23.82 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -68.59 -35.66 77.66 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.527 -0.733 . . . . 0.0 112.858 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -74.88 -25.24 58.81 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.113 -0.992 . . . . 0.0 112.515 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.567 HD11 HD11 ' A' ' 125' ' ' LEU . 7.4 mm -67.76 -40.78 84.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.96 -40.29 80.21 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -41.95 96.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.392 177.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -63.54 -42.33 98.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.585 0.231 . . . . 0.0 110.539 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -65.2 -45.74 83.56 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.4 t -60.48 -40.11 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.101 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -62.16 -30.63 71.19 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.664 -0.647 . . . . 0.0 110.623 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.8 m -80.39 11.41 3.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.926 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.14 3.19 63.71 Favored Glycine 0 C--O 1.229 -0.194 0 N-CA-C 115.296 0.879 . . . . 0.0 115.296 175.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.454 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 16.5 m-85 -68.8 126.4 29.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.024 0.912 . . . . 0.0 110.361 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 134.89 13.75 Favored Glycine 0 C--O 1.225 -0.445 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.57 119.18 24.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 O-C-N 122.013 -0.698 . . . . 0.0 110.142 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 77.2 mt -89.41 -46.03 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -149.76 120.37 7.49 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.285 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.599 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 173.665 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 . . . . . 0 C--O 1.22 -0.473 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -144.73 142.97 30.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.36 0.982 . . . . 0.0 113.445 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.8 mt -136.5 125.98 38.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -107.77 123.87 49.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.454 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.3 mm? -124.15 128.58 49.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -83.0 132.22 35.15 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.56 123.52 89.64 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.67 -19.51 24.21 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 116.955 -1.563 . . . . 0.0 112.943 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -66.07 -33.87 76.78 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 56.75 27.38 12.66 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.65 1.214 . . . . 0.0 110.638 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 t -79.46 -172.85 3.43 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 112.217 -2.265 . . . . 0.0 106.347 176.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.7 m -41.75 -25.45 0.06 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -110.38 127.27 55.0 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 169.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -91.01 -32.42 15.93 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.62 166.42 32.15 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.36 136.67 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.2 ttt180 -112.64 111.28 21.98 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -81.47 128.53 33.98 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 101.917 -3.364 . . . . 0.0 101.917 173.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -136.13 114.89 12.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.732 -176.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tttm -87.38 94.66 9.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -151.7 136.41 17.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.264 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -97.26 147.24 24.33 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 175.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.97 134.61 47.56 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -92.25 -39.93 11.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -120.39 147.84 44.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.634 0.73 . . . . 0.0 112.418 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -61.3 -21.26 63.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.48 -33.25 74.73 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.961 -0.462 . . . . 0.0 109.8 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -68.24 -37.59 80.95 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 54.1 ttm -61.94 -46.5 89.03 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.67 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.1 m -68.02 -36.62 76.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.745 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -26.43 62.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.862 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -65.15 -34.5 78.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -72.08 -30.87 37.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.495 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.63 -40.17 93.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -67.91 -44.85 75.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.864 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -61.02 -38.76 87.21 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.465 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.71 76.03 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -68.87 -37.04 78.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.244 0.545 . . . . 0.0 109.917 177.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -64.21 -42.3 96.67 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.511 HG11 HG13 ' A' ' 109' ' ' VAL . 44.9 t -62.29 -40.41 87.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.066 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.521 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -57.53 -36.1 71.15 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 119.108 0.867 . . . . 0.0 111.333 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -64.33 -45.95 85.59 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.531 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.72 -40.8 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.663 0.744 . . . . 0.0 110.248 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -39.83 78.56 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.348 0.659 . . . . 0.0 110.201 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -63.35 -47.57 81.59 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.487 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -73.36 -23.01 60.15 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.989 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.3 -11.88 57.25 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.668 0.271 . . . . 0.0 111.353 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.21 17.6 68.32 Favored Glycine 0 CA--C 1.52 0.401 0 CA-C-O 121.55 0.528 . . . . 0.0 112.482 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 mmt-85 -69.62 136.95 51.85 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.113 -0.64 . . . . 0.0 111.503 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -72.09 -32.04 66.63 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -152.32 145.34 24.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 N-CA-C 102.536 -3.135 . . . . 0.0 102.536 173.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.1 ttp -125.36 143.04 51.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -178.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -120.58 129.79 53.92 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -117.64 134.06 55.29 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.021 -176.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.87 124.9 38.18 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -112.06 128.27 56.14 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 121.905 -0.497 . . . . 0.0 109.793 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.65 105.85 17.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -75.14 136.58 41.07 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -111.99 108.36 17.66 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 173.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -126.39 158.52 35.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.71 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.9 t -80.01 -28.9 39.36 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.632 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -155.41 167.11 31.44 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.85 158.83 41.54 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 122.669 0.388 . . . . 0.0 111.174 -175.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.41 153.17 42.47 Favored 'Trans proline' 0 C--N 1.355 0.898 0 O-C-N 122.178 0.567 . . . . 0.0 112.871 175.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -62.72 -29.69 47.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -157.41 151.61 24.76 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.8 t0 49.8 15.89 0.18 Allowed 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 27.7 p-90 -76.81 -25.21 53.01 Favored 'General case' 0 C--O 1.216 -0.669 0 O-C-N 121.118 -0.989 . . . . 0.0 110.741 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.05 -31.93 72.39 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 121.989 -0.444 . . . . 0.0 111.783 -175.18 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.59 -17.71 62.9 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.128 0.49 . . . . 0.0 110.823 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.8 mm -75.87 -36.12 31.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -70.22 -17.51 63.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.074 0.464 . . . . 0.0 111.341 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -96.34 2.71 52.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -121.48 138.42 54.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.434 0.635 . . . . 0.0 111.013 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 62.4 m -80.59 125.88 30.55 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -82.66 130.49 35.13 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 105.084 -2.191 . . . . 0.0 105.084 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -129.6 137.11 50.52 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.557 0.694 . . . . 0.0 112.448 -178.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -132.6 75.59 1.64 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.15 -112.66 5.18 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.989 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.8 t -77.5 16.49 0.63 Allowed 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.68 0.752 . . . . 0.0 111.935 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.511 HG13 HG11 ' A' ' 68' ' ' VAL . 76.6 t -130.07 141.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 121.47 -0.769 . . . . 0.0 111.677 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 70.9 m -132.49 140.21 48.27 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -138.24 138.17 43.45 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.291 0 CA-C-O 121.566 0.698 . . . . 0.0 110.564 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.98 108.77 62.52 Favored Pre-proline 0 N--CA 1.435 -1.2 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.101 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.41 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 51.8 Cg_endo -78.83 155.33 26.83 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 115.363 -2.625 . . . . 0.0 112.132 176.118 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -153.13 153.42 32.75 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 102.269 -3.234 . . . . 0.0 102.269 175.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.4 tt -146.88 130.08 8.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.0 m -105.92 133.53 50.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 N-CA-C 104.473 -2.417 . . . . 0.0 104.473 172.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.82 136.18 53.14 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -55.21 -34.13 58.57 Favored Glycine 0 C--O 1.227 -0.332 0 N-CA-C 115.65 1.02 . . . . 0.0 115.65 -174.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.4 t -61.7 -17.08 54.2 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -141.49 25.44 2.02 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.665 0.745 . . . . 0.0 109.815 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -48.0 -39.78 20.61 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -170.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -58.72 -51.33 70.41 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.456 1.026 . . . . 0.0 111.729 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -73.76 -34.71 64.82 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.333 0.587 . . . . 0.0 111.585 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.91 -40.59 91.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.065 0.936 . . . . 0.0 111.789 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.567 HD11 HD11 ' A' ' 11' ' ' ILE . 2.7 tm? -67.54 -44.76 77.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.433 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -70.97 -13.75 62.12 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.164 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.82 -35.5 62.44 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 176.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.62 -36.8 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 120.632 0.253 . . . . 0.0 111.327 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -126.39 75.85 73.46 Favored Pre-proline 0 C--N 1.326 -0.422 0 O-C-N 122.079 -0.388 . . . . 0.0 110.755 177.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.95 -14.99 39.69 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 118.53 -0.513 . . . . 0.0 112.766 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 m -76.03 0.78 17.42 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.821 0.449 . . . . 0.0 112.008 178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -117.27 139.07 51.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 -179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 . . . . . 0 CA--C 1.514 -0.441 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.699 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.223 -0.314 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.03 -45.48 92.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.96 0.409 . . . . 0.0 110.727 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -63.7 -46.08 87.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.218 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 84.1 mtp -64.33 -29.46 70.54 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.089 -0.382 . . . . 0.0 110.947 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -34.9 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.716 -0.615 . . . . 0.0 110.672 178.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -66.45 -47.18 73.96 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -67.09 -38.88 86.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.541 0.686 . . . . 0.0 110.401 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.4 ttt-85 -60.64 -44.19 96.69 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.35 99.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 111.995 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -33.77 76.55 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.856 0.36 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -75.97 -35.26 59.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.751 0.786 . . . . 0.0 111.523 175.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -62.13 -43.57 98.55 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 124.041 0.936 . . . . 0.0 113.341 -176.487 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 4.3 p -57.4 -43.43 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.86 -176.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.326 -0.421 0 O-C-N 121.657 -0.652 . . . . 0.0 110.117 178.603 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.1 tt . . . . . 0 N--CA 1.471 0.599 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 53.6 tp -54.32 -35.25 62.47 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.609 0.718 . . . . 0.0 112.299 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 61.9 mt-10 -57.12 -25.03 58.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -178.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -51.81 -50.46 60.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.602 0.637 . . . . 0.0 110.714 177.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.0 m -68.56 -39.61 80.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.2 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -58.76 -57.29 13.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.113 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.401 ' CZ3' HD11 ' A' ' 31' ' ' ILE . 98.3 m95 -70.34 -31.55 68.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -70.09 -35.12 73.94 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.644 -1.222 . . . . 0.0 109.183 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 125' ' ' LEU . 1.2 mm -65.0 -44.78 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.16 -42.04 80.31 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.33 -41.28 98.89 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -62.73 -45.75 91.29 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -66.84 -51.89 50.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.194 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.7 t -56.28 -43.09 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.927 0.394 . . . . 0.0 110.306 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -71.28 -18.24 62.43 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.109 -0.994 . . . . 0.0 112.362 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.9 t -88.08 9.51 22.32 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.967 0.507 . . . . 0.0 110.734 177.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.28 0.24 57.03 Favored Glycine 0 CA--C 1.517 0.205 0 N-CA-C 116.135 1.214 . . . . 0.0 116.135 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.408 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 22.8 m-85 -69.93 107.43 3.57 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.73 133.26 34.88 Favored Glycine 0 CA--C 1.511 -0.211 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.212 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.5 t -75.95 125.02 35.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.518 HD11 HD22 ' A' ' 43' ' ' LEU . 52.4 mt -93.91 -46.05 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -147.79 133.37 18.78 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.409 -178.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.805 0 N-CA-C 101.203 -3.629 . . . . 0.0 101.203 173.876 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 C--O 1.235 0.322 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.19 164.71 14.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.401 HD11 ' CZ3' ' A' ' 9' ' ' TRP . 52.1 mt -135.58 126.29 43.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 76.8 m95 -105.9 132.87 51.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 4.2 mp -133.72 145.16 49.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -98.66 150.14 22.08 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 125.64 88.02 Favored Pre-proline 0 CA--C 1.544 0.75 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.63 -29.06 13.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 116.939 -1.574 . . . . 0.0 113.242 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -73.52 -19.42 60.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.847 0.356 . . . . 0.0 110.744 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.1 mttm 53.89 43.34 31.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.103 1.43 . . . . 0.0 110.045 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.2 p -69.73 -177.71 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 112.237 -2.256 . . . . 0.0 108.737 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -46.82 -33.07 4.14 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.09 113.47 21.06 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 172.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -78.48 -44.86 23.48 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.359 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.518 HD22 HD11 ' A' ' 23' ' ' ILE . 24.4 mt -137.35 166.17 24.46 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -173.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.2 t -134.55 139.74 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.791 0.837 . . . . 0.0 109.497 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 -120.34 124.27 45.14 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -91.77 130.17 37.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 104.264 -2.495 . . . . 0.0 104.264 174.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -136.49 139.79 42.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -125.72 103.12 7.65 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.775 0.716 . . . . 0.0 111.906 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -149.05 138.81 21.91 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.31 145.78 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.425 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.498 HD13 ' HG2' ' A' ' 57' ' ' MET . 7.2 mt -129.02 126.24 39.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.46 0.171 . . . . 0.0 111.085 -173.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -90.17 -38.15 13.69 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.674 0.749 . . . . 0.0 110.637 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -133.42 151.27 51.79 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.787 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HD2' HD11 ' A' ' 99' ' ' ILE . 21.4 ptt-85 -65.34 -18.14 65.08 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -64.53 -33.33 75.65 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.787 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -69.29 -40.37 77.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.498 ' HG2' HD13 ' A' ' 51' ' ' LEU . 91.8 mtp -55.92 -47.95 76.57 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.149 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -64.15 -31.21 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.682 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -71.13 -41.37 70.6 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -57.46 -43.65 84.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.164 0.507 . . . . 0.0 110.629 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -68.03 -30.65 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.423 -176.499 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.94 73.82 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.92 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -73.71 -43.75 58.36 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -54.38 -39.1 66.89 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 175.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.29 93.79 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.042 0.837 . . . . 0.0 110.791 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -67.97 -42.39 80.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.516 0.674 . . . . 0.0 109.379 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -59.18 -42.38 90.68 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.6 -36.9 77.65 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.975 0 CA-C-O 118.833 -0.603 . . . . 0.0 110.558 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.0 -42.59 85.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.951 1.25 . . . . 0.0 109.391 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -65.91 -48.41 71.51 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.328 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.0 t -66.17 -35.8 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.264 0.554 . . . . 0.0 110.346 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -43.91 96.9 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 121.558 -0.714 . . . . 0.0 110.037 178.197 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -67.61 -39.3 84.75 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.396 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.91 -40.36 88.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.825 0.345 . . . . 0.0 111.477 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -91.83 0.54 57.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.85 19.71 65.72 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 115.746 1.058 . . . . 0.0 115.746 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -77.93 142.58 38.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.684 -0.892 . . . . 0.0 110.698 -176.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -63.65 -40.48 96.96 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.13 -0.356 . . . . 0.0 111.182 -178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.3 ptt-85 -144.91 160.37 41.41 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 102.09 -3.3 . . . . 0.0 102.09 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -135.09 145.9 48.37 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 119.568 1.076 . . . . 0.0 110.895 175.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 110' ' ' SER . 40.2 tttp -123.62 127.82 48.8 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.666 0.604 . . . . 0.0 109.671 174.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -122.5 132.64 54.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.814 -175.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.9 tp -92.79 123.66 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 174.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -115.6 108.5 16.49 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.3 t -105.08 112.92 40.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.107 0.254 . . . . 0.0 111.46 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.41 135.16 35.64 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 175.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -110.92 117.84 34.47 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.9 p -132.87 168.39 18.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -176.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.4 t -92.55 -28.95 16.44 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.64 161.73 39.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.36 149.88 39.13 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -177.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -64.35 151.14 86.67 Favored 'Trans proline' 0 C--N 1.346 0.418 0 O-C-N 122.34 0.652 . . . . 0.0 112.562 177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.0 m -77.76 -12.7 13.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 119.096 2.998 . . . . 0.0 119.096 -169.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.82 101.66 8.04 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 117.404 2.372 . . . . 0.0 117.404 -173.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 44.52 28.66 0.33 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 117.703 2.483 . . . . 0.0 117.703 172.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -63.11 -21.75 66.39 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -176.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -61.72 -31.27 71.42 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.746 -0.596 . . . . 0.0 110.774 -177.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.5 -28.09 69.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.082 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.474 HD11 ' HD2' ' A' ' 54' ' ' ARG . 7.4 mm -73.59 -35.81 45.7 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.75 71.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.444 0.64 . . . . 0.0 111.114 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.65 -24.42 59.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.293 0.568 . . . . 0.0 111.358 178.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -85.16 99.36 11.02 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -171.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 59.6 m -68.26 122.58 18.64 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 171.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.88 120.66 25.96 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -118.76 128.18 54.24 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.079 0.943 . . . . 0.0 110.474 -179.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -130.75 75.57 1.67 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.246 -1.343 . . . . 0.0 107.773 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.02 -112.63 5.0 Favored Glycine 0 C--O 1.219 -0.831 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.703 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.1 p -84.49 16.99 2.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -121.64 140.73 44.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.447 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 7.9 p -134.88 137.71 43.47 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -134.01 130.05 54.82 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.724 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -99.09 110.76 59.05 Favored Pre-proline 0 N--CA 1.432 -1.361 0 CA-C-N 114.424 -1.262 . . . . 0.0 107.979 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -79.64 149.95 21.32 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 117.417 -1.255 . . . . 0.0 111.597 179.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.84 150.69 29.59 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.9 tt -145.89 137.36 19.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 -178.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.0 m -119.83 133.79 65.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 103.559 -2.756 . . . . 0.0 103.559 175.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.38 136.21 53.9 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 -176.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -45.58 -43.35 10.95 Favored Glycine 0 N--CA 1.461 0.318 0 N-CA-C 116.915 1.526 . . . . 0.0 116.915 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.405 HG22 ' H ' ' A' ' 119' ' ' THR . 0.2 OUTLIER -53.25 -29.93 35.48 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -178.565 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.9 ptm -140.6 30.84 1.88 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 122.664 1.221 . . . . 0.0 109.624 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.06 -37.81 47.81 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -58.39 -40.83 83.43 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.621 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -78.44 -43.37 27.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.808 0.813 . . . . 0.0 111.105 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.66 -43.37 93.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.991 0.901 . . . . 0.0 112.196 -177.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.479 HD12 ' CD2' ' A' ' 132' ' ' PHE . 1.2 tm? -65.01 -42.06 94.79 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.27 -175.186 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -74.78 -18.39 60.48 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.72 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.72 -36.26 65.18 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 59.5 t -85.59 -40.19 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.427 0.632 . . . . 0.0 110.117 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -124.91 82.26 61.17 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.122 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -68.92 -4.54 13.65 Favored 'Trans proline' 0 C--N 1.347 0.462 0 N-CA-C 114.919 1.084 . . . . 0.0 114.919 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 35.4 p -80.53 -8.18 59.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.367 0.603 . . . . 0.0 109.628 175.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 132' ' ' PHE . . . . . 0.479 ' CD2' HD12 ' A' ' 125' ' ' LEU . 71.2 t80 -86.15 124.93 33.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.697 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 . . . . . 0 C--N 1.324 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.546 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 32.0 m120 . . . . . 0 C--O 1.219 -0.55 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.68 95.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.19 0.519 . . . . 0.0 111.117 177.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -44.23 92.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 48.7 mtp -69.03 -28.89 66.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.02 92.49 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.901 -0.499 . . . . 0.0 110.222 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.99 -46.73 80.21 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -60.33 -45.6 92.86 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.241 1.019 . . . . 0.0 110.373 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 22.2 ttm180 -65.48 -33.86 76.92 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.3 -42.75 92.74 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 121.224 -0.19 . . . . 0.0 110.905 177.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.18 -41.0 91.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 28.0 m -67.09 -35.36 79.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.562 0.696 . . . . 0.0 111.019 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tt -70.18 -33.76 72.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 39.9 t -58.36 -44.44 88.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--N 1.324 -0.519 0 C-N-CA 120.475 -0.49 . . . . 0.0 109.928 178.804 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.5 tt . . . . . 0 N--CA 1.471 0.62 0 CA-C-O 121.63 0.729 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.35 -39.74 89.38 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.24 -38.15 90.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.712 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -62.24 -46.18 90.01 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 23.5 m -65.16 -43.23 92.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.047 0.451 . . . . 0.0 110.519 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.63 -53.94 51.76 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.384 0.673 . . . . 0.0 111.156 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -69.8 -27.41 64.87 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.956 -0.465 . . . . 0.0 111.679 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -71.13 -36.85 72.26 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.745 -0.597 . . . . 0.0 111.881 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.4 mm -67.84 -45.9 83.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.86 -45.86 74.61 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.9 91.96 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.39 -34.74 76.58 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.684 -176.493 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -71.07 -52.18 20.92 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.531 178.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.0 m -60.1 -32.84 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.828 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -67.99 -23.96 65.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.417 . . . . 0.0 110.723 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 t -89.17 9.82 24.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.809 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.73 2.68 59.73 Favored Glycine 0 C--O 1.227 -0.293 0 N-CA-C 115.612 1.005 . . . . 0.0 115.612 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 15.5 m-85 -72.31 99.76 2.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.064 0.932 . . . . 0.0 109.402 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.76 134.36 40.99 Favored Glycine 0 CA--C 1.512 -0.125 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.819 -177.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.2 t -77.23 124.26 35.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 79.3 mt -90.09 -43.58 14.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -150.13 127.33 11.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.402 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.674 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 170.551 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -140.45 144.51 36.13 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -176.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 87.7 mt -139.31 132.24 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -105.22 134.33 48.51 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -129.72 139.75 51.26 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.927 0.491 . . . . 0.0 110.294 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -86.93 140.47 29.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -92.44 105.61 14.96 Favored Pre-proline 0 CA--C 1.553 1.068 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 91.9 Cg_endo -72.76 -17.29 25.99 Favored 'Trans proline' 0 C--N 1.352 0.729 0 CA-C-N 118.431 0.475 . . . . 0.0 112.991 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -67.47 -16.41 64.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.751 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.9 mttt 54.49 42.37 31.38 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 122.67 1.224 . . . . 0.0 108.823 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.4 p -72.78 -175.04 1.59 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 112.884 -1.962 . . . . 0.0 109.637 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.5 m -52.35 -31.71 34.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.769 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -98.66 136.25 38.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.043 0.537 . . . . 0.0 109.62 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -83.34 -33.75 25.8 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.9 mt -135.01 158.03 45.39 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.619 -176.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.21 141.7 43.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -138.5 150.71 46.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.247 0.546 . . . . 0.0 111.079 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.1 mt -113.98 135.96 53.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -136.47 129.92 31.81 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.261 0.35 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -106.11 114.84 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -151.76 150.4 30.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -118.85 139.56 51.41 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 103.601 -2.74 . . . . 0.0 103.601 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -152.22 144.45 23.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -82.03 -35.15 29.1 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -133.3 154.52 50.63 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.461 ' HD2' HD11 ' A' ' 99' ' ' ILE . 28.5 ptt-85 -62.9 -17.87 62.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -61.77 -33.34 73.92 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.622 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.53 -39.1 67.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 ttp -61.84 -45.81 92.17 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.586 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.41 -33.35 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.22 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -65.05 -39.87 93.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.758 -178.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -57.87 -43.49 86.01 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.172 0.295 . . . . 0.0 110.421 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mt -74.07 -35.59 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.761 -0.587 . . . . 0.0 111.341 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.3 -39.0 78.19 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -76.61 -40.76 48.44 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.571 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.56 93.34 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.21 -33.93 76.56 Favored 'General case' 0 C--O 1.209 -1.036 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.66 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.19 -41.73 96.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.584 0.707 . . . . 0.0 109.75 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -63.61 -46.21 86.78 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.304 0.574 . . . . 0.0 109.697 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.4 t -65.24 -38.23 82.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.908 -177.745 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -58.6 -43.03 89.41 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -64.47 -42.05 96.15 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.177 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.9 t -65.7 -39.47 84.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.619 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.3 OUTLIER -61.93 -44.95 95.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.561 -0.712 . . . . 0.0 111.95 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.3 m80 -64.44 -31.54 72.79 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.484 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -66.73 -24.21 66.2 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.914 0.387 . . . . 0.0 111.325 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.7 mp -100.68 -17.64 16.9 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.202 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.52 6.94 59.89 Favored Glycine 0 CA--C 1.523 0.594 0 CA-C-O 121.574 0.541 . . . . 0.0 113.93 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 -71.37 140.8 50.31 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -59.14 -47.01 86.84 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -170.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -153.97 153.72 32.49 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.675 0.671 . . . . 0.0 110.609 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.469 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -102.19 164.13 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.654 0.782 . . . . 0.0 112.716 -178.349 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.6 mptt -148.2 129.01 14.28 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 101.389 -3.56 . . . . 0.0 101.389 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -139.57 128.11 22.99 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -174.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.6 tp -91.43 121.16 32.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -115.16 108.62 16.86 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.184 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 12.4 t -101.69 113.06 36.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -82.14 143.51 31.4 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 175.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -123.25 117.35 25.09 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 173.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.1 m -135.59 158.31 44.7 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 123.447 0.467 . . . . 0.0 111.522 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 52.3 m -68.16 -49.16 62.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-O 121.885 0.85 . . . . 0.0 108.844 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -144.31 158.77 43.56 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 103.142 -2.91 . . . . 0.0 103.142 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.76 155.94 53.0 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.959 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -63.61 154.11 70.96 Favored 'Trans proline' 0 C--N 1.346 0.404 0 O-C-N 122.208 0.583 . . . . 0.0 112.789 177.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.6 m -88.26 10.52 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -121.83 83.49 2.1 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 114.449 1.278 . . . . 0.0 114.449 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 31.09 45.0 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 118.005 2.594 . . . . 0.0 118.005 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -70.01 -15.37 63.01 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.43 -0.794 . . . . 0.0 111.48 179.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -64.38 -29.67 70.74 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.664 -0.648 . . . . 0.0 109.687 -178.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.444 ' HA ' ' HE2' ' A' ' 101' ' ' LYS . 78.0 mm-40 -67.29 -18.32 65.14 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.635 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.461 HD11 ' HD2' ' A' ' 54' ' ' ARG . 10.1 mm -87.16 -38.4 12.11 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.667 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.04 -39.57 82.39 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.419 0.628 . . . . 0.0 112.477 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 98' ' ' GLU . 48.0 pttt -89.63 3.79 51.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.763 -178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -102.22 107.19 18.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.805 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.5 m -68.31 123.19 20.07 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 175.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -85.65 125.35 33.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 178.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -125.89 127.32 45.82 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 121.688 0.756 . . . . 0.0 109.496 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -143.72 113.12 6.92 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.249 -178.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 55.39 -126.28 38.8 Favored Glycine 0 C--O 1.24 0.502 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.294 178.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.2 p -84.55 15.2 3.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.527 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.4 t -119.29 148.77 22.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.309 0.576 . . . . 0.0 112.216 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 t -139.31 140.07 37.48 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 100.598 -3.853 . . . . 0.0 100.598 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.8 t -136.29 133.94 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -101.07 111.68 63.82 Favored Pre-proline 0 C--O 1.244 0.781 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 174.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -78.2 153.37 28.09 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 117.058 -1.495 . . . . 0.0 111.376 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.61 151.63 34.1 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.61 137.56 16.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.1 t -116.87 107.9 23.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 177.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.21 141.17 28.86 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.65 -19.9 61.04 Favored Glycine 0 C--O 1.228 -0.28 0 N-CA-C 114.435 0.534 . . . . 0.0 114.435 -177.265 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 38.8 p -62.69 -29.47 70.67 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.631 0.975 . . . . 0.0 113.631 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.8 ptm -144.42 40.55 1.33 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.05 -43.63 30.57 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -173.214 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -43.8 97.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 119.069 0.849 . . . . 0.0 111.844 -176.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -73.68 -39.13 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.911 0.386 . . . . 0.0 111.232 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.47 -39.76 92.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.492 0.663 . . . . 0.0 110.445 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -63.71 -49.41 73.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.019 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -70.49 -15.45 62.8 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.881 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.61 64.61 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 31.7 t -91.86 -44.64 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 121.458 0.647 . . . . 0.0 110.689 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -124.97 77.98 66.21 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.123 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.2 -6.64 19.3 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 118.611 -0.459 . . . . 0.0 112.476 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 49.2 p -88.11 -5.72 58.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.677 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -79.2 124.15 28.08 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.003 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.649 -179.455 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 . . . . . 0 C--O 1.22 -0.5 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.84 95.29 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.731 0.241 . . . . 0.0 110.629 178.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -64.25 -44.82 90.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.7 mtm -62.76 -29.97 71.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.862 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.3 83.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 177.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -64.8 -45.72 85.08 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.623 0.249 . . . . 0.0 110.426 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -60.03 -44.32 94.7 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.317 0.579 . . . . 0.0 110.556 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -69.78 -28.53 65.82 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.083 -0.385 . . . . 0.0 111.071 178.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -66.45 -37.48 85.24 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.13 -34.68 78.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.83 0.347 . . . . 0.0 110.127 178.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 m -74.23 -38.02 63.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.678 0.751 . . . . 0.0 110.551 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.65 -39.92 88.46 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.6 p -60.61 -34.84 60.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 CA-C-N 118.934 0.788 . . . . 0.0 110.278 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? . . . . . 0 C--N 1.328 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 108.914 176.329 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.859 0.361 . . . . 25.0 110.979 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.4 mt -61.38 -35.91 78.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 25.0 110.884 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -51.96 -39.9 60.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.799 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -52.08 -39.54 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.87 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.928 HG21 HD21 ' A' ' 121' ' ' LEU . 0.2 OUTLIER -70.44 -54.31 12.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.092 -0.503 . . . . 25.0 111.118 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -51.9 -43.98 63.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 25.0 110.914 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -71.98 -34.65 69.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -55.34 28.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.908 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.452 HG22 HD23 ' A' ' 15' ' ' LEU . 42.1 mm -59.72 -37.4 70.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.251 -0.431 . . . . 25.0 111.093 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.26 -53.74 32.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 25.0 111.107 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.444 ' HB1' HD22 ' A' ' 157' ' ' LEU . . . -60.01 -35.63 75.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 25.0 111.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -61.27 -54.97 37.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.865 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.62 ' HB3' HD22 ' A' ' 33' ' ' LEU . 4.3 mm? -56.07 -55.31 34.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.932 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.1 t -53.27 -51.88 36.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.117 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -33.72 70.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.923 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.69 -16.57 64.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.821 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 117.95 -24.91 8.65 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 25.0 112.445 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -51.2 103.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 25.0 110.833 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.34 149.79 34.94 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.705 -0.76 . . . . 25.0 112.516 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.577 HG11 ' HB2' ' A' ' 25' ' ' ALA . 21.8 t -90.29 106.71 17.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.814 0.34 . . . . 25.0 111.099 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.9 mt -69.53 -35.69 67.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 25.0 111.137 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -161.03 118.98 2.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.577 ' HB2' HG11 ' A' ' 22' ' ' VAL . . . . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 25.0 111.086 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.718 0.294 . . . . 25.0 110.801 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.13 128.83 18.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.871 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 78.1 mt -141.49 131.93 26.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.101 -0.5 . . . . 25.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.7 m95 -101.33 149.66 23.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 25.0 110.864 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.62 HD22 ' HB3' ' A' ' 15' ' ' LEU . 1.8 mt -140.74 116.74 10.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 25.0 110.913 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.553 ' HA ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -74.48 146.35 42.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 25.0 110.894 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.434 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . . . -103.42 104.11 39.49 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.677 0.751 . . . . 25.0 111.085 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 35' ' ' ALA . 54.0 Cg_endo -69.84 -32.22 18.65 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.636 2.224 . . . . 25.0 112.279 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -57.57 -27.02 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.306 -0.407 . . . . 25.0 110.858 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.9 mttt 66.07 44.65 2.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.907 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 p -83.91 -176.71 6.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.43 . . . . 25.0 110.806 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.42 -35.0 17.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 25.0 110.851 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.55 132.13 35.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.934 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASP . . . . . 0.682 ' O ' HD23 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.36 -65.26 0.95 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 25.0 110.937 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.682 HD23 ' O ' ' A' ' 42' ' ' ASP . 18.8 mt -138.37 166.66 23.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.949 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.37 129.23 73.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 25.0 111.093 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.431 ' HB2' HD11 ' A' ' 82' ' ' LEU . 42.4 ttt180 -115.95 146.67 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 25.0 110.859 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.3 tp -123.83 110.33 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 25.0 110.974 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -116.72 140.61 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.287 -0.415 . . . . 25.0 110.966 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -125.65 101.52 6.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.52 . . . . 25.0 110.889 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -144.08 148.76 35.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 25.0 110.898 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -78.82 146.05 33.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 25.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.0 129.62 36.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.927 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.63 -52.2 2.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.108 -0.496 . . . . 25.0 110.804 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -99.83 168.41 9.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 25.0 110.956 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -34.48 36.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.828 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -54.68 -34.92 62.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 25.0 110.957 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -65.78 -33.38 75.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 25.0 110.84 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.498 ' HG2' HG21 ' A' ' 99' ' ' ILE . 1.5 tpp -58.15 -52.91 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.839 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.593 HG13 HG12 ' A' ' 99' ' ' ILE . 24.8 m -68.86 -33.04 57.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.234 -0.439 . . . . 25.0 111.12 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -26.22 68.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 25.0 110.805 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -77.26 -29.98 54.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 25.0 110.884 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.457 HG21 ' HB2' ' A' ' 104' ' ' PHE . 8.1 mm -73.62 -43.26 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 25.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -29.12 16.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.271 -0.422 . . . . 25.0 110.887 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.76 -35.95 57.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 25.0 110.895 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.744 ' O ' HG23 ' A' ' 68' ' ' VAL . 1.1 mp0 -58.4 -51.43 69.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.468 . . . . 25.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.06 -35.9 48.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.154 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -61.74 -43.43 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.446 . . . . 25.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -35.52 58.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.277 -0.42 . . . . 25.0 110.866 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.948 HG11 HG13 ' A' ' 109' ' ' VAL . 81.1 t -52.79 -36.6 23.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 25.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -61.19 -36.1 78.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 25.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -48.41 81.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.898 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' VAL . . . . . 0.573 HG11 HD11 ' A' ' 43' ' ' LEU . 21.7 t -74.82 -41.49 46.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 25.0 111.188 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.83 -36.31 47.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.846 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -72.32 -35.94 68.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.825 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -47.28 53.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.43 . . . . 25.0 110.887 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.6 HD23 ' HD2' ' A' ' 77' ' ' ARG . 4.4 mp -70.88 -19.61 62.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 25.0 110.956 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.74 33.37 87.07 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.845 -0.693 . . . . 25.0 112.497 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.6 ' HD2' HD23 ' A' ' 75' ' ' LEU . 71.9 mtt-85 -103.63 176.17 5.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 25.0 110.847 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.444 ' O ' HG22 ' A' ' 108' ' ' THR . 0.1 OUTLIER -85.29 -52.96 5.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.935 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -127.03 144.77 50.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.116 -0.493 . . . . 25.0 110.805 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.561 ' HB3' HG13 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -116.83 111.57 19.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.854 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -82.08 119.18 23.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.914 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.431 HD11 ' HB2' ' A' ' 45' ' ' ARG . 5.7 tt -130.7 135.18 47.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.904 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.4 tp -99.43 107.44 19.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 25.0 110.896 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.408 ' O ' ' HB3' ' A' ' 114' ' ' ALA . 1.7 t30 -105.36 108.89 20.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 25.0 110.87 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.569 ' CG1' HG23 ' A' ' 116' ' ' VAL . 21.8 t -106.41 146.43 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 25.0 111.174 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -108.16 137.59 45.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -114.12 103.66 11.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 25.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 p -131.06 169.25 16.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.862 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.8 t -67.09 -35.29 79.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 25.0 111.126 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -162.78 176.03 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.434 . . . . 25.0 110.853 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.603 ' HB1' ' HD2' ' A' ' 92' ' ' PRO . . . -73.68 161.34 79.24 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.533 0.683 . . . . 25.0 111.099 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.603 ' HD2' ' HB1' ' A' ' 91' ' ' ALA . 53.1 Cg_endo -69.92 176.86 6.32 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.651 2.234 . . . . 25.0 112.324 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.441 HG23 ' N ' ' A' ' 94' ' ' ASP . 10.6 m -51.46 -47.36 35.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.109 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.441 ' N ' HG23 ' A' ' 93' ' ' VAL . 0.2 OUTLIER 171.92 -172.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 25.0 110.868 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 57.48 38.79 28.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.43 ' HZ3' ' HB2' ' A' ' 100' ' ' ALA . 18.2 p-90 -120.57 -32.2 4.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 25.0 110.907 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -51.83 -35.28 43.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.861 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.87 -40.24 96.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 25.0 110.858 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.593 HG12 HG13 ' A' ' 58' ' ' VAL . 2.4 mp -65.02 -47.77 86.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 25.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.43 ' HB2' ' HZ3' ' A' ' 96' ' ' TRP . . . -50.9 -30.35 14.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 25.0 111.087 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.55 -38.19 12.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.944 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.28 139.88 58.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 25.0 110.921 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.9 m -101.89 143.66 31.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.44 . . . . 25.0 111.183 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.457 ' HB2' HG21 ' A' ' 61' ' ' ILE . 7.9 t80 -97.14 104.28 16.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.858 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -112.92 100.97 9.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 25.0 110.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -101.74 86.81 3.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.43 -112.43 4.97 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.726 -0.749 . . . . 25.0 112.458 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' THR . . . . . 0.444 HG22 ' O ' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -95.0 30.01 2.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.355 . . . . 25.0 111.252 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.948 HG13 HG11 ' A' ' 68' ' ' VAL . 18.3 t -119.39 151.82 21.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 25.0 111.043 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 36.2 p -137.05 112.55 9.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.044 -0.526 . . . . 25.0 110.794 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -142.81 139.1 28.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.041 -0.527 . . . . 25.0 111.101 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -116.32 136.0 22.97 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.691 0.758 . . . . 25.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 149.16 66.24 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.669 2.246 . . . . 25.0 112.317 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' A' ' 85' ' ' VAL . . . -152.72 136.56 16.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.279 -0.418 . . . . 25.0 111.119 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.1 tt -138.83 144.21 30.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.159 -0.473 . . . . 25.0 111.093 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.744 HG13 ' CB ' ' A' ' 124' ' ' ASP . 90.8 t -124.57 124.91 69.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 25.0 111.196 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.567 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -70.65 140.06 51.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 25.0 110.834 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -75.04 -33.12 55.52 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.706 -0.759 . . . . 25.0 112.489 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.766 HG23 ' HG2' ' A' ' 120' ' ' MET . 5.1 t -84.63 -34.05 23.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 25.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' MET . . . . . 0.766 ' HG2' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER -111.08 33.04 4.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 25.0 110.835 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.928 HD21 HG21 ' A' ' 7' ' ' THR . 3.2 tt -52.68 -36.2 56.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.416 . . . . 25.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -58.55 -37.46 75.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.855 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.03 -35.82 64.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 25.0 110.927 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.744 ' CB ' HG13 ' A' ' 116' ' ' VAL . 3.4 m-20 -72.61 -38.13 67.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 25.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -52.22 -42.79 63.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.925 -179.939 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -79.83 -34.97 38.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 25.0 110.886 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.12 -33.81 76.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 25.0 111.112 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.55 -60.13 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 25.0 111.108 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -113.09 76.18 2.3 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.762 0.792 . . . . 25.0 110.944 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -30.71 22.04 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.727 2.285 . . . . 25.0 112.311 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 t -69.6 -16.32 63.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.265 -0.425 . . . . 25.0 110.863 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -70.45 139.69 51.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.828 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 25.0 110.934 -179.954 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.786 0.327 . . . . 25.0 110.861 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.57 -49.72 75.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 25.0 111.064 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -36.63 66.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 25.0 110.878 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.0 mtt -68.93 -41.44 78.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.932 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.64 -38.62 72.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 25.0 111.088 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -63.72 -53.68 47.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 25.0 110.871 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.08 -43.74 64.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.275 -0.42 . . . . 25.0 110.839 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -66.54 -38.96 88.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 25.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.32 -46.47 88.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.51 -36.32 55.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.93 -36.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 25.0 110.878 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.444 HD22 ' HB1' ' A' ' 13' ' ' ALA . 0.7 OUTLIER -62.73 -54.6 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 25.0 110.925 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.0 -35.95 23.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 25.0 111.13 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 25.0 110.999 179.961 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.9 tt . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.12 -35.06 79.03 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.335 0.588 . . . . 0.0 110.887 177.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -59.62 -27.17 66.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.107 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.49 -48.98 78.63 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.6 m -67.44 -38.76 85.02 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.968 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -55.17 -53.43 56.01 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -65.95 -30.87 71.51 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.953 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.68 -33.38 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.088 -0.382 . . . . 0.0 111.85 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.423 HD11 HD11 ' A' ' 125' ' ' LEU . 7.4 mm -68.04 -43.66 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.348 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.36 -43.61 88.48 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.32 96.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.36 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -59.03 -46.02 89.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.143 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.28 -53.2 39.59 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.29 -0.164 . . . . 0.0 111.025 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 73.1 t -53.99 -44.47 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.944 -0.473 . . . . 0.0 111.883 178.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.83 -16.28 64.02 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.462 -0.774 . . . . 0.0 112.722 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.2 m -89.79 1.24 56.38 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.423 0.289 . . . . 0.0 110.924 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.06 -1.0 28.45 Favored Glycine 0 C--O 1.228 -0.278 0 N-CA-C 115.887 1.115 . . . . 0.0 115.887 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.464 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 37.7 m-85 -68.63 118.51 11.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 117.974 0.887 . . . . 0.0 109.39 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.86 130.82 11.93 Favored Glycine 0 CA--C 1.508 -0.386 0 N-CA-C 111.051 -0.819 . . . . 0.0 111.051 -177.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.6 t -75.47 130.31 36.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.14 0.495 . . . . 0.0 110.164 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.9 mt -102.46 -44.54 10.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 175.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -150.62 138.63 20.08 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.371 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 -177.278 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 . . . . . 0 C--O 1.225 -0.219 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -131.48 138.61 49.06 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -171.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.9 mt -138.96 137.26 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -120.79 133.55 55.32 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.151 0.58 . . . . 0.0 109.967 177.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.4 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 2.6 mp -131.07 137.28 49.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.908 0.883 . . . . 0.0 110.272 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -86.17 137.04 32.95 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.78 118.25 70.9 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 84.8 Cg_endo -76.26 -25.45 9.95 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 117.192 -1.405 . . . . 0.0 112.035 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -72.94 -30.52 63.93 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.393 1.077 . . . . 0.0 112.012 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.2 mttp 55.99 39.24 30.54 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.722 1.249 . . . . 0.0 111.554 177.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.2 t -77.66 -172.99 2.81 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 104.48 -2.415 . . . . 0.0 104.48 170.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -41.4 -1.78 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.071 1 N-CA-C 121.945 4.054 . . . . 0.0 121.945 -178.15 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -132.95 125.37 29.66 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -74.58 -33.63 62.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.589 0.709 . . . . 0.0 109.54 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.06 161.03 37.81 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.711 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.7 t -130.79 139.06 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -123.87 136.38 54.32 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tp -113.21 124.97 53.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -136.45 135.56 38.76 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -118.5 100.09 7.23 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.063 0.459 . . . . 0.0 112.177 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.41 150.23 30.21 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -87.82 151.41 22.88 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.6 mt -138.22 120.28 15.59 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.449 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -88.14 -33.41 18.22 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.098 0.475 . . . . 0.0 110.755 -178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -129.87 149.9 51.4 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.494 ' HD2' HD11 ' A' ' 99' ' ' ILE . 15.0 ptt180 -66.93 -22.42 65.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.673 -0.642 . . . . 0.0 111.147 -179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -32.69 73.77 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -74.37 -39.5 62.7 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 46.3 ttm -58.54 -48.59 80.38 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.279 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 20.8 m -63.2 -31.9 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 122.037 -0.414 . . . . 0.0 111.59 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -70.07 -34.13 72.8 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.834 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.22 -42.56 91.3 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 175.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -66.17 -31.28 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -63.82 -39.54 94.47 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -76.64 -41.98 43.85 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -57.48 -36.58 71.67 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 113.034 0.754 . . . . 0.0 113.034 178.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.488 ' HA ' HG11 ' A' ' 109' ' ' VAL . . . -61.89 -37.28 84.0 Favored 'General case' 0 C--O 1.208 -1.124 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -37.28 77.39 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.815 0.341 . . . . 0.0 110.471 177.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -61.16 -47.69 85.04 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.481 HG11 HG13 ' A' ' 109' ' ' VAL . 75.4 t -65.12 -40.72 89.78 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.408 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.31 -40.83 83.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -65.23 -44.74 87.25 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.733 -0.605 . . . . 0.0 110.884 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.7 t -67.01 -36.97 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-O 121.231 0.538 . . . . 0.0 110.176 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.07 -44.52 94.68 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.812 -0.555 . . . . 0.0 110.749 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -65.59 -41.08 93.22 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.2 -40.0 92.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.2 mp -94.57 -0.07 54.83 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.07 15.38 65.07 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 116.241 1.256 . . . . 0.0 116.241 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.8 mtt-85 -72.47 142.86 48.59 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.25 -32.99 67.17 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.35 -0.843 . . . . 0.0 112.979 -177.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.45 160.82 43.12 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 102.31 -3.218 . . . . 0.0 102.31 178.174 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.6 mtp -141.86 148.23 38.44 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.858 1.208 . . . . 0.0 113.004 178.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -117.6 141.27 48.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 174.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.2 tp -128.26 135.44 49.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 68.0 tp -94.14 119.5 33.06 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 170.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -115.04 108.73 17.06 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -177.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.4 t -107.68 118.44 55.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -176.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -88.01 146.21 25.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.226 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -121.47 116.86 25.5 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 172.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 78.2 p -136.45 160.32 39.11 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.226 0.329 . . . . 0.0 110.722 -174.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.2 t -76.87 -29.24 55.73 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.583 -0.698 . . . . 0.0 111.381 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -150.7 164.08 37.01 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 106.26 -1.755 . . . . 0.0 106.26 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.88 152.78 41.87 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -177.321 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -59.4 149.21 82.83 Favored 'Trans proline' 0 C--N 1.349 0.579 0 O-C-N 122.367 0.667 . . . . 0.0 113.42 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.8 m -77.79 -16.14 14.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 117.317 2.34 . . . . 0.0 117.317 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -120.73 100.26 7.01 Favored 'General case' 0 C--O 1.21 -0.991 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -175.148 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 44.6 31.46 0.63 Allowed 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 117.29 2.33 . . . . 0.0 117.29 172.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.7 p-90 -61.94 -22.23 65.44 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.461 -0.775 . . . . 0.0 112.642 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.88 -31.28 69.65 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.04 -0.413 . . . . 0.0 111.664 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -58.75 -39.85 82.14 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.768 -0.826 . . . . 0.0 108.768 177.529 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.494 HD11 ' HD2' ' A' ' 54' ' ' ARG . 8.8 mm -63.89 -39.35 85.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.04 -177.12 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.28 -10.33 57.33 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -112.0 3.81 17.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -109.88 105.85 15.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.852 -175.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.0 m -68.36 122.42 18.35 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 174.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -84.05 122.55 28.94 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -123.01 132.87 54.32 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.783 0.802 . . . . 0.0 109.643 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -147.61 125.48 11.97 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.23 -119.42 13.0 Favored Glycine 0 C--O 1.227 -0.343 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -176.797 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -119.23 19.34 12.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.167 0.984 . . . . 0.0 108.576 175.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 65' ' ' ALA . 84.6 t -97.14 138.45 22.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.618 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -126.12 139.98 52.94 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 172.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.2 t -132.72 136.76 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.262 0 CA-C-O 121.813 0.816 . . . . 0.0 110.347 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.2 103.37 47.9 Favored Pre-proline 0 N--CA 1.433 -1.279 0 CA-C-N 113.422 -1.717 . . . . 0.0 109.347 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.18 152.61 27.62 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 115.636 -2.443 . . . . 0.0 112.483 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.69 154.69 38.96 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.63 -2.73 . . . . 0.0 103.63 175.338 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -150.76 135.89 10.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.5 m -111.99 138.03 42.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 172.473 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.44 142.57 47.43 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.76 -27.68 59.36 Favored Glycine 0 C--O 1.227 -0.283 0 CA-C-N 115.956 -0.565 . . . . 0.0 114.169 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.8 p -55.45 -30.03 59.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.84 26.27 2.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.352 0.596 . . . . 0.0 110.527 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 27.6 tp -43.51 -44.04 5.79 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -170.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -60.91 -43.27 98.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 119.118 0.872 . . . . 0.0 112.068 -177.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -74.95 -38.7 61.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 122.282 1.039 . . . . 0.0 110.564 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.82 -38.97 92.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.035 0.921 . . . . 0.0 111.686 -177.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.423 HD11 HD11 ' A' ' 11' ' ' ILE . 2.5 tm? -61.78 -50.04 73.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.102 -178.62 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -72.06 -15.7 62.02 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.404 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.21 -34.67 63.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 56.2 t -91.18 -41.51 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.113 0.482 . . . . 0.0 109.979 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -124.24 76.33 60.65 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 122.882 0.473 . . . . 0.0 111.532 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.13 -11.64 32.15 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 117.726 -1.049 . . . . 0.0 112.181 177.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 24.7 p -76.27 -8.74 57.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.556 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -93.21 131.41 38.33 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.195 0.521 . . . . 0.0 109.598 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 . . . . . 0 C--N 1.323 -0.557 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.673 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 . . . . . 0 C--O 1.217 -0.625 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.89 -36.79 70.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 177.016 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.83 -41.27 95.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.467 0.651 . . . . 0.0 109.382 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 45.9 mtt -68.36 -35.44 77.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.517 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.2 -30.73 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.315 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.97 -48.27 74.62 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.01 -40.58 91.23 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.568 0.699 . . . . 0.0 110.007 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -60.26 -38.92 84.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.394 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -68.18 -45.42 73.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.706 -0.224 . . . . 0.0 110.905 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.19 -39.02 91.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.307 0.575 . . . . 0.0 110.028 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 42.0 m -66.32 -34.59 78.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.04 0.448 . . . . 0.0 110.577 177.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.3 tt -67.33 -39.9 85.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.762 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 66.9 t -58.49 -50.02 80.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.0 tm? . . . . . 0 C--N 1.325 -0.469 0 C-N-CA 120.142 -0.623 . . . . 0.0 110.968 -178.708 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.3 tt . . . . . 0 N--CA 1.467 0.385 0 CA-C-O 121.114 0.483 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 69.7 mt -64.1 -42.71 96.8 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.402 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -67.17 -38.48 85.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.667 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -60.9 -50.7 72.37 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.6 m -59.77 -40.1 87.11 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 121.075 0.464 . . . . 0.0 111.008 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -59.7 -45.13 93.07 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -75.6 -34.23 60.6 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.791 1.281 . . . . 0.0 108.776 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tptt -64.63 -39.65 94.09 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.834 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.5 mm -72.1 -40.47 66.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 -42.31 84.24 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.26 98.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -62.07 -46.91 87.04 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.352 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -63.48 -48.04 79.29 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.051 -0.406 . . . . 0.0 110.718 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.6 -37.19 79.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.014 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -74.2 -10.5 59.67 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.077 -1.014 . . . . 0.0 111.765 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.0 m -94.77 12.69 27.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.0 2.63 66.33 Favored Glycine 0 CA--C 1.517 0.204 0 N-CA-C 116.496 1.359 . . . . 0.0 116.496 175.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -70.36 115.09 9.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 118.444 1.122 . . . . 0.0 109.237 178.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.34 133.86 20.44 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.0 t -78.6 118.69 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.519 HD11 HD22 ' A' ' 43' ' ' LEU . 40.6 mt -90.27 -44.92 14.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 177.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -149.65 124.65 9.99 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.451 -177.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.685 0 N-CA-C 104.689 -2.337 . . . . 0.0 104.689 173.097 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 . . . . . 0 N--CA 1.456 -0.173 0 N-CA-C 115.667 1.728 . . . . 0.0 115.667 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -136.93 147.09 46.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 116.511 2.041 . . . . 0.0 116.511 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.1 mt -136.36 130.05 47.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 174.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.9 m95 -103.23 127.25 50.6 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 177.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -123.02 142.37 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.039 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -92.26 133.84 35.45 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 175.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.22 114.0 29.07 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.22 -29.13 14.65 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 116.667 -1.756 . . . . 0.0 113.245 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -74.15 -11.76 60.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.006 0.523 . . . . 0.0 111.279 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 mttm 59.4 41.6 19.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 123.355 1.55 . . . . 0.0 107.896 -178.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -177.57 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 110.898 -2.864 . . . . 0.0 117.952 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 p -50.4 -26.78 5.35 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.537 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -117.12 139.09 51.16 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -81.98 -35.04 29.4 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.519 HD22 HD11 ' A' ' 23' ' ' ILE . 73.4 mt -133.62 158.84 42.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.831 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.58 134.38 66.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -116.39 102.86 9.9 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.18 129.17 34.3 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.167 -2.16 . . . . 0.0 105.167 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -136.37 138.32 41.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -105.22 95.22 5.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.73 122.78 7.63 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.203 0.525 . . . . 0.0 111.065 -178.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -91.54 134.56 34.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -124.36 126.61 46.27 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -171.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -72.9 -41.18 64.9 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -129.18 152.07 49.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -63.41 -19.72 64.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -73.22 -33.01 65.1 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 121.982 -0.449 . . . . 0.0 109.938 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -67.25 -28.41 68.02 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.755 -0.591 . . . . 0.0 109.484 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 77.4 mtp -63.86 -51.73 63.26 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 9.1 m -65.8 -31.79 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.541 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -61.46 -43.91 98.03 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.543 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -64.52 -46.61 82.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.278 0.561 . . . . 0.0 110.187 -178.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mp -68.22 -33.25 59.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 121.272 -0.892 . . . . 0.0 110.618 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.188 -0.945 . . . . 0.0 110.08 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -76.56 -43.64 38.16 Favored 'General case' 0 C--O 1.243 0.729 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.404 ' O ' HG23 ' A' ' 68' ' ' VAL . 55.4 mt-30 -56.93 -40.08 75.68 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.628 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -35.88 75.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.045 0.384 . . . . 0.0 111.276 -178.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -72.46 -40.05 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.502 0.667 . . . . 0.0 109.308 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.4 -38.57 84.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.554 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 64' ' ' GLN . 89.3 t -70.43 -38.4 73.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 CA-C-O 118.628 -0.701 . . . . 0.0 110.802 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.84 -34.32 77.1 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.414 1.461 . . . . 0.0 110.123 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttt-85 -62.56 -44.8 95.43 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.611 -0.436 . . . . 0.0 109.926 175.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 84.4 t -66.62 -41.39 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.19 -42.87 77.82 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 123.271 0.628 . . . . 0.0 109.411 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -67.7 -40.9 84.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.623 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -58.53 -41.51 85.68 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -100.44 6.65 44.43 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.11 12.38 60.3 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 117.213 1.645 . . . . 0.0 117.213 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.8 ttt85 -62.07 145.1 54.18 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.854 0.827 . . . . 0.0 109.825 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -68.2 -34.91 77.14 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 122.039 -0.413 . . . . 0.0 110.755 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -149.05 160.66 43.13 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.0 mmm -127.92 136.08 50.86 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.48 138.06 50.66 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 tt -138.55 140.98 39.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 118.356 0.525 . . . . 0.0 112.251 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -104.44 118.43 36.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 173.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -107.99 127.38 53.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.3 t -121.79 111.91 32.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 121.363 -0.135 . . . . 0.0 111.171 -178.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -81.59 147.57 29.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -120.76 115.95 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 171.278 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 t -131.25 160.5 34.72 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.568 0.543 . . . . 0.0 111.128 -173.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.1 m -67.1 -46.75 73.25 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -149.29 170.87 17.51 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.45 152.95 70.87 Favored Pre-proline 0 C--N 1.314 -0.971 0 CA-C-N 115.385 -0.825 . . . . 0.0 108.92 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.75 151.42 47.92 Favored 'Trans proline' 0 C--N 1.35 0.618 0 O-C-N 122.358 0.662 . . . . 0.0 112.008 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -61.18 -20.03 21.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 117.761 2.504 . . . . 0.0 117.761 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -155.51 145.63 21.66 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.6 t0 39.9 30.15 0.06 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 174.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -73.47 -22.4 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.339 -0.85 . . . . 0.0 110.705 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -64.85 -32.02 73.53 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.922 -0.486 . . . . 0.0 111.525 -176.368 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -64.18 -25.11 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.713 -0.395 . . . . 0.0 109.996 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.6 mm -73.96 -43.43 52.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -178.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.83 -16.95 63.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.665 0.745 . . . . 0.0 110.105 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -95.1 4.03 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.61 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -126.64 118.76 25.46 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.7 m -68.28 126.83 30.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 173.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -85.72 111.77 20.43 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -110.67 125.23 53.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.933 0.397 . . . . 0.0 110.951 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.4 ttpp -138.58 101.9 4.46 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.01 -112.72 5.08 Favored Glycine 0 C--N 1.322 -0.231 0 C-N-CA 120.164 -1.017 . . . . 0.0 111.806 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.9 p -89.66 9.15 28.06 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 44.7 t -115.46 143.48 25.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.6 m -127.76 118.18 23.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 171.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.5 t -120.49 130.88 73.97 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.304 0 CA-C-O 121.624 0.726 . . . . 0.0 111.21 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.49 110.9 61.66 Favored Pre-proline 0 N--CA 1.433 -1.322 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.587 177.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -80.14 150.56 20.37 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.169 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.92 154.14 37.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 176.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.0 tt -147.4 125.8 3.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -177.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.7 t -102.37 120.96 52.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.05 136.24 47.24 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -179.387 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.67 -22.53 53.32 Favored Glycine 0 C--O 1.228 -0.257 0 N-CA-C 114.694 0.637 . . . . 0.0 114.694 -177.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 54.3 p -59.47 -32.08 69.91 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.1 ptm -139.89 29.5 2.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 122.051 0.929 . . . . 0.0 108.845 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 tt -46.1 -41.25 12.06 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -172.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -62.35 -45.0 95.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.006 0.821 . . . . 0.0 111.126 -176.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -74.44 -39.75 62.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.783 0.801 . . . . 0.0 111.287 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -66.58 -37.84 85.78 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.007 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 14.4 tp -62.1 -36.37 81.51 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.928 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.33 -15.93 61.88 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.71 -31.37 59.63 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.01 -40.28 10.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.258 -179.03 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -125.83 77.05 70.63 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.441 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -67.49 -19.82 48.42 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.427 0.895 . . . . 0.0 114.427 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.2 m -80.06 -9.46 59.7 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -64.82 140.01 58.82 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.286 0.565 . . . . 0.0 111.346 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? . . . . . 0 CA--C 1.511 -0.543 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.576 179.842 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 . . . . . 0 C--O 1.215 -0.729 0 N-CA-C 111.46 0.17 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.66 96.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.435 0.636 . . . . 0.0 110.054 177.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -68.92 -39.56 79.58 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 90.5 mtp -65.82 -36.7 84.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.98 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.95 78.78 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.263 . . . . 0.0 110.524 178.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -65.44 -44.85 85.99 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 177.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.02 -44.23 96.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.521 0.677 . . . . 0.0 109.73 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 -61.11 -41.12 96.11 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.645 179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.32 -41.38 98.51 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.66 -38.28 90.5 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.349 -0.844 . . . . 0.0 110.142 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 59.9 p -69.94 -30.02 67.31 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.854 175.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.49 -43.97 92.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.357 0.663 . . . . 0.0 109.898 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 76.7 t -57.95 -46.54 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.659 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 C--N 1.323 -0.552 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.107 179.747 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 N--CA 1.469 0.524 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -61.75 -30.56 70.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.418 ' HB2' ' HB1' ' A' ' 147' ' ' ALA . 95.7 mt-10 -62.84 -35.46 80.02 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.1 m -61.93 -42.78 99.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.53 0.681 . . . . 0.0 111.845 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -59.92 -51.03 71.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.511 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -69.75 -27.34 64.87 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 121.867 -0.521 . . . . 0.0 111.357 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -66.21 -43.56 86.36 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.811 -0.555 . . . . 0.0 110.886 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.7 mm -70.62 -37.5 69.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.0 -45.35 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.49 -44.52 90.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.377 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -57.58 -46.74 83.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.37 -178.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.12 -50.91 59.79 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -66.0 -31.04 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.54 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -68.16 -14.34 62.9 Favored 'General case' 0 C--O 1.221 -0.425 0 O-C-N 121.855 -0.528 . . . . 0.0 110.719 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.7 m -95.91 8.9 42.35 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 122.767 0.427 . . . . 0.0 109.998 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.64 -2.88 58.94 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 115.435 0.934 . . . . 0.0 115.435 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -65.44 115.23 5.47 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 109.905 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.3 138.57 27.96 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.374 -176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.2 t -83.11 107.35 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.428 HD11 HD22 ' A' ' 43' ' ' LEU . 84.0 mt -71.91 -47.23 56.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.92 130.56 10.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.232 178.063 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.587 0 N-CA-C 101.146 -3.65 . . . . 0.0 101.146 170.305 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 . . . . . 0 C--O 1.23 0.051 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -142.32 149.72 39.84 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.1 mt -141.25 133.1 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -103.5 130.02 50.8 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.551 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -124.39 141.18 52.28 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -99.29 145.79 26.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.47 105.65 17.02 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.02 -16.47 32.28 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 118.012 -0.858 . . . . 0.0 111.49 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -61.62 -28.7 69.56 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.017 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 58.79 37.79 24.87 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.2 p -76.75 -176.28 3.78 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 112.495 -2.139 . . . . 0.0 109.593 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 p -54.87 -8.91 0.29 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -132.9 136.12 45.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -80.27 -35.94 35.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.305 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 HD11 ' A' ' 23' ' ' ILE . 40.4 mt -138.6 163.34 32.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.116 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.2 p -138.63 139.41 41.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -119.34 132.87 55.94 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mp -106.24 122.46 46.27 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 177.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.53 121.28 18.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 118.118 0.417 . . . . 0.0 110.659 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -100.8 114.93 29.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.677 0.751 . . . . 0.0 109.188 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -151.64 150.37 30.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.456 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.0 147.72 44.87 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 174.402 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 73.6 mt -139.83 107.64 5.66 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -83.0 -40.55 19.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.64 0.734 . . . . 0.0 110.892 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -132.44 156.72 46.22 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.927 -0.578 . . . . 0.0 112.145 -178.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 95' ' ' ASP . 15.9 ptt180 -64.97 -15.33 62.1 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.098 0.475 . . . . 0.0 111.093 175.136 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -63.35 -37.44 87.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -75.46 -30.86 60.08 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.952 0.406 . . . . 0.0 110.057 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 97.1 mtp -63.58 -47.35 81.87 Favored 'General case' 0 C--O 1.211 -0.972 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.92 -30.74 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.682 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 mtm-85 -61.49 -43.41 98.91 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -59.13 -42.18 89.99 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.17 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -64.51 -30.79 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -61.03 -40.18 92.62 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 177.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -72.96 -37.22 67.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.207 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 68.2 mm-40 -56.2 -50.54 70.95 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.25 -36.57 82.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 122.161 -0.337 . . . . 0.0 111.841 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.47 -43.49 97.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.991 0.424 . . . . 0.0 109.871 178.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -67.33 -42.42 83.61 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.419 HG11 HG13 ' A' ' 109' ' ' VAL . 57.0 t -62.94 -37.55 79.59 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.168 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -58.42 -41.0 84.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.008 0.822 . . . . 0.0 110.137 178.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 87.4 mtt-85 -63.87 -41.66 97.7 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.3 t -69.81 -43.42 79.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.118 0.485 . . . . 0.0 110.167 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -57.53 -41.14 80.29 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -65.85 -37.67 86.81 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.357 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -68.94 -40.26 79.09 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.076 0.465 . . . . 0.0 110.463 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 mp -75.42 -13.21 60.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.136 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.69 6.41 55.19 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 114.084 0.394 . . . . 0.0 114.084 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -73.57 140.78 46.51 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.801 . . . . 0.0 110.352 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -66.45 -38.03 86.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.634 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -131.16 161.3 32.46 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mtp -144.87 148.63 34.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 118.708 0.685 . . . . 0.0 109.824 174.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -121.47 143.49 49.22 Favored 'General case' 0 CA--C 1.514 -0.41 0 O-C-N 123.594 0.559 . . . . 0.0 110.97 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -139.76 125.66 19.64 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.0 tp -93.53 121.75 35.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -111.98 112.61 24.38 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.126 -0.359 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.3 t -105.98 110.94 33.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-O 121.201 0.524 . . . . 0.0 111.834 -176.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -80.1 136.64 36.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -114.18 112.31 22.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 173.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.6 m -132.13 158.23 42.2 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.846 0.355 . . . . 0.0 111.108 -175.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.5 t -74.86 -28.93 60.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.826 -0.546 . . . . 0.0 110.393 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -154.99 166.12 34.6 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 -178.489 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.4 155.09 54.33 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.15 154.34 73.98 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 117.328 -1.315 . . . . 0.0 111.994 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.57 -12.54 13.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 120.402 3.482 . . . . 0.0 120.402 -168.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -151.54 140.45 21.0 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -175.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 54' ' ' ARG . 7.3 m-20 42.69 15.3 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 120.153 3.39 . . . . 0.0 120.153 173.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 25.3 p-90 -63.68 -21.41 66.37 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 120.837 -1.164 . . . . 0.0 113.598 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.66 -29.46 70.65 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -62.39 -33.5 74.88 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.616 0.722 . . . . 0.0 109.615 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 mm -69.19 -40.49 80.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.825 -174.069 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.73 -15.19 63.1 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.866 0.365 . . . . 0.0 111.793 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -102.2 3.27 38.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -177.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -117.42 130.32 56.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.483 0.659 . . . . 0.0 112.155 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -80.71 125.27 29.83 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 173.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -84.02 126.08 32.7 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -123.85 135.61 53.86 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.84 0.829 . . . . 0.0 110.502 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -135.49 91.73 2.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.75 -109.54 2.85 Favored Glycine 0 C--O 1.22 -0.76 0 N-CA-C 107.336 -2.305 . . . . 0.0 107.336 -177.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.0 p -110.85 7.26 21.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.777 0.323 . . . . 0.0 111.558 178.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.419 HG13 HG11 ' A' ' 68' ' ' VAL . 78.7 t -87.68 139.36 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.7 m -126.86 136.99 53.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.9 t -132.09 135.35 58.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -111.14 115.83 52.14 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -79.69 151.08 21.87 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 117.373 -1.284 . . . . 0.0 112.331 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.15 152.72 42.1 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 175.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.7 tt -146.81 131.31 10.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.2 m -113.68 128.45 70.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 103.598 -2.742 . . . . 0.0 103.598 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.33 136.32 54.88 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -47.16 -39.9 13.27 Favored Glycine 0 C--O 1.226 -0.382 0 N-CA-C 117.173 1.629 . . . . 0.0 117.173 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 119' ' ' THR . 0.2 OUTLIER -55.58 -29.31 58.81 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.764 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -142.46 32.7 1.48 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.099 1.428 . . . . 0.0 108.934 -178.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 tp -52.04 -36.4 50.18 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -60.17 -49.86 75.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.562 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.68 -32.98 64.23 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.735 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -63.45 -45.33 91.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.829 0.347 . . . . 0.0 110.719 177.08 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.68 -44.08 96.94 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -75.37 -14.08 60.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.819 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.52 -41.82 37.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.945 0.402 . . . . 0.0 110.03 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG13 ' CD2' ' A' ' 129' ' ' PHE . 5.2 p -88.91 -33.98 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.244 0.545 . . . . 0.0 110.577 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' PHE . . . . . 0.451 ' CD2' HG13 ' A' ' 128' ' ' VAL . 61.1 m-85 -126.78 75.62 75.38 Favored Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 122.0 -0.438 . . . . 0.0 110.233 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -67.29 -10.75 29.71 Favored 'Trans proline' 0 C--N 1.349 0.593 0 CA-C-O 121.415 0.506 . . . . 0.0 113.006 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.4 p -80.26 -9.97 59.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.459 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.84 135.64 33.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.424 0.63 . . . . 0.0 110.5 -178.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 85.9 mtt-85 . . . . . 0 CA--C 1.507 -0.696 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -179.882 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 . . . . . 0 C--O 1.221 -0.411 0 CA-C-O 121.52 0.676 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.418 ' HB1' ' HB2' ' A' ' 5' ' ' GLU . . . -57.1 -39.98 76.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.839 177.279 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -78.7 -31.12 46.38 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.969 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 94.0 mmm -63.26 -34.48 77.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.319 176.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -67.86 -44.61 76.73 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.5 -40.88 96.47 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.669 0.747 . . . . 0.0 109.34 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -61.57 -42.26 98.59 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.647 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.42 -42.31 98.73 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 177.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 47.7 mt -64.27 -31.8 73.15 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.235 -0.291 . . . . 0.0 110.334 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.4 m -76.18 -36.36 58.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.771 0.796 . . . . 0.0 110.543 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.36 -34.72 77.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.813 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 2.1 p -52.97 -28.09 13.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.479 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.218 -0.59 0 O-C-N 121.066 -1.021 . . . . 0.0 109.26 178.663 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.0 mt . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.66 -35.32 80.46 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.364 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -63.02 -31.76 72.97 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.021 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -63.02 -51.64 65.98 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -64.64 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.294 0.568 . . . . 0.0 111.271 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -56.58 -50.77 70.97 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.264 0.626 . . . . 0.0 111.04 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.385 -0.822 . . . . 0.0 111.71 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -66.3 -42.88 87.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.073 -0.392 . . . . 0.0 110.064 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.426 HD11 HD11 ' A' ' 125' ' ' LEU . 14.8 mm -69.2 -39.54 79.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.35 -44.21 79.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.53 99.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.093 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -46.47 90.41 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.913 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.2 mt -65.01 -46.24 82.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.156 0.503 . . . . 0.0 110.889 -179.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.8 -38.34 82.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.702 -178.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -78.93 -3.5 45.18 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.242 -0.911 . . . . 0.0 112.374 178.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.9 t -96.46 17.44 16.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.058 0.456 . . . . 0.0 110.008 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.89 -0.77 64.87 Favored Glycine 0 CA--C 1.518 0.246 0 N-CA-C 116.257 1.263 . . . . 0.0 116.257 175.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -75.96 135.47 40.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.109 0.955 . . . . 0.0 110.043 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.77 146.48 20.64 Favored Glycine 0 CA--C 1.505 -0.589 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.1 t -90.19 121.25 40.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 117.794 0.797 . . . . 0.0 109.22 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.6 mt -87.98 -45.66 15.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -161.07 147.49 14.79 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 175.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.37 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -177.37 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 CA-C-O 121.513 0.673 . . . . 0.0 112.581 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.66 158.99 38.54 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.6 mt -131.2 131.43 63.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -110.3 129.65 55.7 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.393 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -117.1 133.8 55.55 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.859 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -85.26 124.32 31.76 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.35 120.93 83.53 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.55 -22.87 37.75 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 117.164 -1.424 . . . . 0.0 113.599 -175.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.98 -18.49 55.9 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -176.216 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm 59.76 29.0 18.56 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-O 121.961 0.886 . . . . 0.0 109.509 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 t -65.91 -177.56 0.49 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 113.872 -1.513 . . . . 0.0 110.243 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.1 m -45.53 -44.64 12.82 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -81.68 106.14 13.38 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 170.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -84.86 -24.74 28.42 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -138.38 156.13 47.88 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.345 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 69.9 t -136.74 144.56 32.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 104.81 -2.293 . . . . 0.0 104.81 176.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.02 149.95 46.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 119.047 0.84 . . . . 0.0 111.755 174.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -115.4 132.54 56.59 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.663 -1.977 . . . . 0.0 105.663 179.06 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -136.5 126.81 26.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.206 0.457 . . . . 0.0 112.135 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.15 115.13 27.03 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -150.58 125.26 9.68 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -87.35 111.4 21.04 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.507 HD13 ' HG2' ' A' ' 57' ' ' MET . 4.6 mt -106.5 121.05 43.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -171.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -91.03 -36.03 14.29 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.578 0.704 . . . . 0.0 111.773 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -128.14 147.38 50.55 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.869 -0.52 . . . . 0.0 111.391 -177.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -65.29 -20.37 66.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -63.54 -33.33 75.35 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.05 -30.57 63.82 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 121.659 -0.651 . . . . 0.0 109.263 179.514 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.507 ' HG2' HD13 ' A' ' 51' ' ' LEU . 84.5 mtp -66.32 -51.85 53.19 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.8 m -60.94 -36.42 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.186 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -66.12 -36.82 84.16 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -62.04 -40.21 94.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.977 0.418 . . . . 0.0 110.022 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.406 HD12 ' O ' ' A' ' 57' ' ' MET . 2.5 mp -73.25 -34.2 43.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 121.42 -0.8 . . . . 0.0 111.058 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -58.74 -37.94 77.32 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -74.87 -43.43 54.5 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.603 0.716 . . . . 0.0 109.881 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.451 HE22 ' HB2' ' A' ' 84' ' ' ASN . 47.2 mt-30 -58.79 -39.38 80.91 Favored 'General case' 0 C--O 1.212 -0.872 0 O-C-N 121.765 -0.584 . . . . 0.0 111.409 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.83 -34.41 74.51 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 118.114 0.416 . . . . 0.0 110.505 -178.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -71.62 -42.58 67.48 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -60.15 -42.86 95.8 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.276 0.56 . . . . 0.0 109.508 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -67.46 -39.17 82.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 123.111 0.564 . . . . 0.0 110.336 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.55 -41.87 81.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.107 0.479 . . . . 0.0 110.736 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -65.12 -41.18 95.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.827 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.7 t -68.88 -39.69 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.4 ttp85 -60.09 -40.74 90.66 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.819 -0.55 . . . . 0.0 109.846 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -63.39 -41.11 98.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.906 -0.134 . . . . 0.0 110.845 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.55 -41.38 98.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.061 0.458 . . . . 0.0 110.899 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.82 -15.87 55.24 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.82 15.58 71.51 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-O 121.546 0.526 . . . . 0.0 112.227 -177.284 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -70.2 140.08 52.43 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 122.153 -0.616 . . . . 0.0 110.617 -175.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -64.45 -39.41 93.78 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.446 HH22 ' CD ' ' A' ' 105' ' ' GLU . 11.2 mtp180 -148.35 156.37 42.42 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 177.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.0 mmm -131.97 124.34 29.18 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.145 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -105.35 135.73 46.19 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 175.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -130.61 132.84 45.72 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.9 tp -94.74 123.51 38.24 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.451 ' HB2' HE22 ' A' ' 64' ' ' GLN . 36.6 t30 -120.06 114.47 22.03 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 122.159 0.184 . . . . 0.0 111.389 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.06 116.86 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.989 0.424 . . . . 0.0 111.671 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -80.92 152.81 27.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.514 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -128.09 115.87 19.11 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.508 -2.404 . . . . 0.0 104.508 171.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -136.88 151.87 49.58 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.474 0.484 . . . . 0.0 110.621 -173.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 87.7 m -67.22 -49.85 63.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 168.53 11.12 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -176.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.32 140.61 22.13 Favored Pre-proline 0 C--N 1.313 -0.991 0 N-CA-C 104.818 -2.29 . . . . 0.0 104.818 176.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.1 145.88 83.92 Favored 'Trans proline' 0 C--N 1.345 0.386 0 N-CA-C 114.706 1.002 . . . . 0.0 114.706 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.2 m -76.63 -4.24 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -175.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -120.86 100.46 7.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 119.461 -0.304 . . . . 0.0 111.513 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 22.53 50.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 32.7 p-90 -66.84 -22.84 65.98 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.488 -0.758 . . . . 0.0 112.276 -178.218 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -63.06 -31.25 72.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 121.914 -0.491 . . . . 0.0 110.742 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -63.78 -34.82 78.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.2 mm -63.99 -38.53 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 122.486 0.314 . . . . 0.0 110.283 -177.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.13 -25.78 68.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 111.181 -179.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -90.81 -2.33 57.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -96.0 102.34 14.12 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.957 -0.465 . . . . 0.0 111.749 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -68.4 118.76 11.88 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 103.039 -2.948 . . . . 0.0 103.039 169.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -82.93 110.77 18.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLU . . . . . 0.446 ' CD ' HH22 ' A' ' 79' ' ' ARG . 5.1 mt-10 -107.81 121.12 44.08 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 122.094 0.949 . . . . 0.0 110.257 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -119.62 78.52 1.33 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.62 5.04 Favored Glycine 0 C--O 1.221 -0.694 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.448 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.7 p -76.81 -19.93 56.98 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 122.248 -0.56 . . . . 0.0 112.342 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.5 t -89.12 146.66 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.091 -0.38 . . . . 0.0 110.997 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 57.8 p -137.88 139.91 40.11 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 171.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.8 t -132.48 136.85 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.638 0 CA-C-O 122.021 0.915 . . . . 0.0 109.799 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -106.13 103.09 43.42 Favored Pre-proline 0 N--CA 1.428 -1.56 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.434 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -82.25 152.73 16.11 Favored 'Trans proline' 0 C--N 1.347 0.47 0 N-CA-C 114.129 0.78 . . . . 0.0 114.129 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.57 158.05 39.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 175.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.4 tt -149.66 128.48 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 118.369 0.531 . . . . 0.0 109.873 -178.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.3 t -100.08 116.97 44.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.82 139.96 38.82 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.54 -27.8 68.62 Favored Glycine 0 C--N 1.322 -0.2 0 CA-C-N 116.056 -0.52 . . . . 0.0 114.153 -177.008 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 27.0 p -54.01 -33.82 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -177.278 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.59 30.89 1.88 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.529 0.68 . . . . 0.0 110.107 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.9 tt -44.85 -36.96 3.54 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -175.326 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 18.3 ptp180 -55.61 -51.38 67.37 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.78 -38.56 38.2 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.976 0.893 . . . . 0.0 111.114 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.58 -38.09 86.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.975 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.426 HD11 HD11 ' A' ' 11' ' ' ILE . 2.7 tm? -63.24 -49.43 74.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -72.72 -16.12 61.67 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.391 -177.301 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.05 -34.97 64.25 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 46.6 t -91.35 -42.19 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.245 0.545 . . . . 0.0 110.285 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.9 76.53 66.2 Favored Pre-proline 0 C--N 1.324 -0.512 0 C-N-CA 122.93 0.492 . . . . 0.0 111.734 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.67 -11.92 33.23 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 118.325 -0.65 . . . . 0.0 113.123 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -75.84 -12.82 60.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.905 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -90.85 131.19 36.64 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 . . . . . 0 C--N 1.324 -0.532 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.903 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 44.8 m-20 . . . . . 0 N--CA 1.463 0.212 0 CA-C-O 120.509 0.195 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -37.26 69.3 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -64.97 -43.49 92.46 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 37.3 mtt -64.09 -36.59 84.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.369 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.27 -38.28 89.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.271 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -65.47 -43.04 91.52 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.007 0.432 . . . . 0.0 109.921 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -64.43 -41.98 96.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.472 0.653 . . . . 0.0 109.772 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -42.39 99.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.714 177.562 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -62.74 -43.02 99.88 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 122.82 0.448 . . . . 0.0 112.15 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.35 -37.31 86.79 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.585 -0.697 . . . . 0.0 109.948 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 21.5 m -67.64 -33.39 74.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.688 0.756 . . . . 0.0 110.673 176.145 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.81 -38.56 73.31 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.669 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.2 t -56.14 -42.48 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--N 1.322 -0.614 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.317 -179.22 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.501 0 CA-C-O 121.988 0.899 . . . . 0.0 109.516 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -73.68 -36.51 65.31 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.946 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -39.18 84.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.059 0.39 . . . . 0.0 109.961 177.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -60.03 -53.14 61.27 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.9 m -63.05 -42.92 99.82 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.241 0.544 . . . . 0.0 111.114 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -56.91 -51.28 69.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.496 0.718 . . . . 0.0 112.14 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -71.31 -28.75 64.32 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.605 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -68.74 -36.48 78.45 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.664 -0.647 . . . . 0.0 109.511 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.537 HD11 HD11 ' A' ' 125' ' ' LEU . 22.2 mm -72.88 -36.01 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.62 85.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.02 -41.89 97.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.887 177.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -57.51 -49.87 74.91 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.549 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.24 -49.87 57.8 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.299 -178.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -39.45 82.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.722 -175.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -11.67 61.09 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.263 -0.898 . . . . 0.0 111.855 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.0 m -95.92 11.53 33.51 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 122.559 0.344 . . . . 0.0 110.32 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.25 -3.57 56.78 Favored Glycine 0 C--O 1.228 -0.26 0 N-CA-C 116.176 1.23 . . . . 0.0 116.176 175.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -66.79 126.14 28.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.065 0.932 . . . . 0.0 108.886 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.89 135.71 14.06 Favored Glycine 0 C--O 1.227 -0.318 0 N-CA-C 110.524 -1.031 . . . . 0.0 110.524 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.1 t -79.45 124.08 37.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 117.496 0.648 . . . . 0.0 109.258 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.6 mt -96.08 -45.5 13.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -148.56 141.96 25.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 117.941 0.337 . . . . 0.0 111.088 178.064 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.2 159.46 37.68 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 72.2 mt -132.59 125.89 53.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 105.46 -2.052 . . . . 0.0 105.46 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -99.14 129.63 45.41 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.86 138.27 54.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.914 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -81.59 129.78 34.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.23 118.07 68.68 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -74.37 -21.13 17.74 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 116.862 -1.625 . . . . 0.0 113.894 -175.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -77.44 -22.14 51.89 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 56.54 34.36 24.25 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 123.075 1.417 . . . . 0.0 111.092 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.5 p -74.48 -172.91 1.6 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.438 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.8 m -42.23 -28.24 0.18 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 112.675 0.621 . . . . 0.0 112.675 172.538 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -91.22 129.25 37.23 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 173.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -105.71 -41.46 5.44 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 31.4 mt -132.15 154.67 49.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.13 0.491 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -129.93 139.23 52.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -125.19 120.09 30.35 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.2 mt -96.02 120.54 36.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 104.035 -2.58 . . . . 0.0 104.035 175.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -135.09 127.93 31.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.937 0.789 . . . . 0.0 111.403 -175.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -103.18 105.78 16.16 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.018 0.913 . . . . 0.0 112.208 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -151.56 131.53 13.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.313 178.117 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -82.24 151.29 26.89 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 176.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -134.54 141.97 46.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.827 0.285 . . . . 0.0 110.432 -174.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -94.9 -45.64 7.2 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -128.4 154.62 45.82 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -178.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -64.3 -15.32 60.0 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.989 176.014 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -64.45 -34.93 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.26 178.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -75.81 -41.63 52.21 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -47.75 83.54 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.358 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.08 -34.73 72.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.993 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 83.5 mtt85 -71.14 -32.43 68.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -177.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.85 -42.62 89.75 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.281 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.8 mp -71.49 -37.16 63.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.975 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.07 -33.39 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 119.067 0.849 . . . . 0.0 109.688 -179.032 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -74.29 -44.94 50.65 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -36.21 73.86 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 121.833 -0.542 . . . . 0.0 111.308 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.28 -43.93 72.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.79 -42.68 93.9 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -63.78 -56.93 11.81 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.707 0.765 . . . . 0.0 113.044 178.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.9 p -64.14 -30.41 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.86 -173.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.17 -37.48 64.52 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -64.43 -42.82 95.81 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.837 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 17.7 t -68.28 -37.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.419 0.628 . . . . 0.0 109.734 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -42.73 98.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.703 -178.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.6 m80 -67.53 -35.96 80.1 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.648 178.61 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -30.49 71.42 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.78 -9.6 58.68 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 177.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.22 18.29 71.06 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -76.55 121.96 23.91 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 122.011 -0.7 . . . . 0.0 110.407 -175.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.3 mtp180 -66.53 -35.39 80.12 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -157.58 149.72 22.45 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 172.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -147.34 126.15 12.68 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.958 -173.009 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -88.24 117.39 27.12 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.502 1.047 . . . . 0.0 111.309 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.05 121.91 34.06 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.589 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.2 tp -87.39 100.27 12.61 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -100.28 113.27 25.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.2 t -114.4 111.19 34.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -79.73 144.66 33.44 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.39 116.76 25.39 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 172.086 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.7 p -136.12 152.16 50.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -172.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.9 m -67.18 -48.62 67.4 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -138.55 157.92 45.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 -176.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.59 152.64 63.96 Favored Pre-proline 0 C--N 1.312 -1.048 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.14 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -64.53 149.74 89.41 Favored 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 117.632 -1.112 . . . . 0.0 112.059 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.02 -6.9 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 119.021 2.971 . . . . 0.0 119.021 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -126.91 112.89 15.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.479 1.288 . . . . 0.0 114.479 -173.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 21.07 45.71 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 118.977 2.954 . . . . 0.0 118.977 175.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.437 ' HA ' HG12 ' A' ' 99' ' ' ILE . 52.1 p-90 -72.11 -15.52 61.99 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.133 -0.979 . . . . 0.0 110.796 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.38 -31.3 72.45 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.539 -0.726 . . . . 0.0 111.202 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.89 -37.23 76.11 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 174.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.437 HG12 ' HA ' ' A' ' 96' ' ' TRP . 7.4 mm -67.45 -40.97 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -178.654 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.42 -32.82 73.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.264 0.554 . . . . 0.0 111.881 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -88.48 2.49 52.75 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.251 0.548 . . . . 0.0 110.289 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.8 ttpp -114.51 103.06 10.66 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 123.169 0.587 . . . . 0.0 111.849 -176.735 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 81.9 m -68.35 126.92 31.12 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 174.116 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -83.78 117.73 23.45 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -116.74 135.62 53.62 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.703 0.763 . . . . 0.0 111.072 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -144.41 85.82 1.8 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.66 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.69 5.21 Favored Glycine 0 C--O 1.225 -0.456 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.436 178.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.7 p -82.75 10.21 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.7 t -122.29 144.53 31.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -176.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.56 144.01 43.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 100.826 -3.768 . . . . 0.0 100.826 169.813 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.8 t -138.54 134.44 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.953 0 CA-C-N 119.449 1.022 . . . . 0.0 109.01 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -99.45 114.56 65.67 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -82.16 62.85 8.16 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 121.839 1.692 . . . . 0.0 113.76 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.01 147.2 48.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.7 tt -148.15 138.11 16.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 59.4 t -110.62 114.09 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.8 137.24 35.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -21.14 65.03 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.343 -0.456 . . . . 0.0 114.141 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 119' ' ' THR . 30.6 p -59.65 -31.56 69.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -177.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptm -140.43 34.2 1.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 tt -42.13 -42.86 3.1 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 117.187 2.292 . . . . 0.0 117.187 -172.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -61.04 -51.31 69.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 118.631 0.65 . . . . 0.0 112.255 -176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -74.08 -35.54 64.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.528 0.68 . . . . 0.0 111.798 -179.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -67.84 -36.41 80.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.842 0.83 . . . . 0.0 111.512 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.537 HD11 HD11 ' A' ' 11' ' ' ILE . 3.4 tm? -68.51 -43.38 76.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -70.75 -14.73 62.55 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.133 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.68 -34.04 66.92 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 176.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -94.38 -36.77 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -126.07 77.65 71.12 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 122.232 -0.292 . . . . 0.0 110.924 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -69.45 -9.33 25.93 Favored 'Trans proline' 0 C--N 1.347 0.483 0 N-CA-C 113.704 0.617 . . . . 0.0 113.704 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.0 p -83.5 -9.72 58.79 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 122.73 0.412 . . . . 0.0 111.852 178.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -80.98 141.64 34.24 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.191 0.52 . . . . 0.0 111.434 -177.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 . . . . . 0 CA--C 1.512 -0.502 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 179.951 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 120.222 0.058 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.4 -37.02 84.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.298 0.57 . . . . 0.0 109.483 175.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -73.88 -40.82 62.93 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.1 mtt -65.14 -30.79 71.74 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 120.693 0.282 . . . . 0.0 110.742 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.48 91.29 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -67.63 -44.75 77.23 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.34 -42.85 99.36 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.648 0.737 . . . . 0.0 109.869 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -58.86 -44.83 91.12 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.15 176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.81 -32.27 73.88 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.819 -0.55 . . . . 0.0 109.832 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.94 -35.16 59.82 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.155 0.979 . . . . 0.0 110.538 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.67 -37.55 87.98 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -176.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -60.03 -37.17 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 118.838 0.744 . . . . 0.0 110.946 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 C--N 1.327 -0.395 0 O-C-N 121.196 -0.94 . . . . 0.0 108.64 177.013 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 71.4 mt -54.94 -35.23 64.01 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 47.7 mt-10 -56.81 -26.01 57.02 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -58.37 -49.4 77.37 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 m -71.82 -41.77 67.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.0 0.428 . . . . 0.0 110.934 178.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.478 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 64.1 t80 -56.05 -56.22 23.43 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -67.61 -29.73 69.13 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.853 -0.529 . . . . 0.0 110.766 -178.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -69.12 -39.42 78.92 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.352 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.613 HD11 HD11 ' A' ' 125' ' ' LEU . 8.2 mm -62.24 -46.22 96.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -42.18 79.48 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.37 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -60.83 -46.33 90.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 mt -66.53 -51.44 56.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.936 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.9 t -56.04 -46.74 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.81 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -22.03 66.64 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.756 -0.59 . . . . 0.0 112.431 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.3 m -87.19 1.08 54.21 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.02 -0.94 27.06 Favored Glycine 0 C--O 1.228 -0.277 0 N-CA-C 115.898 1.119 . . . . 0.0 115.898 176.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -68.0 122.66 18.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.377 1.088 . . . . 0.0 108.438 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.79 116.3 4.25 Favored Glycine 0 CA--C 1.507 -0.424 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -178.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -71.81 111.98 6.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.1 mt -75.6 -42.9 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -143.01 116.45 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.904 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.493 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.722 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.442 -0.833 0 CA-C-O 120.01 -0.043 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 45' ' ' ARG . 11.2 pt-20 -139.56 148.52 42.69 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 86.0 mt -140.1 132.26 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -108.3 136.02 48.64 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.059 0.39 . . . . 0.0 109.968 176.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mp -131.16 129.98 42.45 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.346 0.658 . . . . 0.0 109.749 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -79.58 136.41 36.85 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.34 115.29 41.85 Favored Pre-proline 0 CA--C 1.546 0.795 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.48 -25.56 9.51 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 117.334 -1.311 . . . . 0.0 112.668 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.85 59.31 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.883 0.873 . . . . 0.0 111.482 -179.226 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt 57.34 45.49 20.0 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 t -60.13 -177.69 0.07 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 112.433 -2.167 . . . . 0.0 112.955 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 p -55.88 -29.02 59.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.239 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -109.36 136.96 47.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -80.18 -30.54 38.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.725 -175.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.0 mt -137.57 162.45 33.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.186 -176.412 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.3 t -129.59 135.39 61.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 30' ' ' GLU . 59.1 ttt180 -125.01 134.59 52.52 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 175.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.2 129.56 54.23 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 104.427 -2.434 . . . . 0.0 104.427 177.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -136.43 132.56 35.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 117.891 0.314 . . . . 0.0 110.736 -177.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 tmtm? -106.76 110.8 23.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.832 -0.542 . . . . 0.0 109.673 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -151.52 144.91 24.8 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -106.77 101.22 10.67 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.65 135.57 35.53 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -92.29 -37.27 12.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 175.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -126.27 150.86 48.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.009 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -65.02 -15.54 62.44 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.854 -0.529 . . . . 0.0 110.998 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -63.38 -36.33 83.37 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -73.47 -40.52 64.07 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.8 ttm -57.39 -48.75 78.26 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.934 -0.306 . . . . 0.0 111.0 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.33 -31.84 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.832 0.742 . . . . 0.0 112.108 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.0 mtt180 -66.82 -41.21 87.86 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -179.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.28 -36.29 77.49 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.85 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.5 mm -64.38 -30.81 51.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 121.626 -0.671 . . . . 0.0 112.243 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -63.39 -36.87 85.15 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.808 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -72.38 -38.69 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -56.58 -49.89 73.54 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.66 -27.94 68.73 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.349 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.97 -46.06 83.09 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -66.48 -42.59 87.25 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.93 -40.83 88.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 119.034 -0.507 . . . . 0.0 112.116 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.31 -33.34 74.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.014 1.279 . . . . 0.0 109.999 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.3 ttm-85 -64.05 -42.12 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.6 t -68.66 -41.68 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -57.03 -41.37 78.48 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.795 0.438 . . . . 0.0 111.35 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.5 t-80 -62.23 -40.54 96.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.758 0.314 . . . . 0.0 110.883 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -73.27 -41.86 63.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.739 0.304 . . . . 0.0 111.791 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.69 -17.94 59.78 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.291 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.47 7.18 63.71 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.444 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -65.42 140.45 58.63 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 122.068 -0.666 . . . . 0.0 109.356 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.02 -32.45 73.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.613 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.7 ttt85 -150.73 154.04 36.64 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 29.7 mmm -124.38 150.36 45.66 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -127.33 142.43 51.45 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.554 0.534 . . . . 0.0 109.651 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -142.35 124.81 15.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.922 0.391 . . . . 0.0 111.198 -176.339 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.6 tp -90.87 108.08 19.61 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -102.09 111.52 23.82 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 10.8 t -100.98 106.87 20.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.061 0.458 . . . . 0.0 112.002 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -75.69 139.68 42.08 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -118.22 113.23 21.2 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 172.161 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.2 m -128.28 155.0 45.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.6 m -67.16 -48.39 68.15 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.818 0.818 . . . . 0.0 108.908 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.27 170.87 15.17 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 -177.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.93 151.16 43.11 Favored Pre-proline 0 C--N 1.314 -0.966 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -62.16 151.51 81.56 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 122.194 0.576 . . . . 0.0 112.307 176.422 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -63.62 -18.39 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 N-CA-C 121.176 3.769 . . . . 0.0 121.176 -167.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -150.21 137.93 19.96 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 116.241 1.941 . . . . 0.0 116.241 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 t0 37.87 24.1 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 119.179 3.029 . . . . 0.0 119.179 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 30.6 p-90 -67.59 -22.32 65.37 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 120.742 -1.224 . . . . 0.0 110.376 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.25 -31.26 71.06 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.4 . . . . 0.0 111.944 -178.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -59.77 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.8 mm -66.04 -39.58 84.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.911 -175.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.26 -14.7 60.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.35 0.595 . . . . 0.0 111.658 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -100.16 3.28 43.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.789 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -124.2 144.6 49.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.598 0.714 . . . . 0.0 110.979 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.7 m -79.89 147.16 31.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 104.468 -2.419 . . . . 0.0 104.468 172.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -107.61 123.67 48.81 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -125.95 130.94 52.25 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.455 0.645 . . . . 0.0 109.645 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.05 75.52 1.3 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 178.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.36 -112.65 3.7 Favored Glycine 0 C--O 1.224 -0.528 0 C-N-CA 119.722 -1.228 . . . . 0.0 111.15 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.2 p -93.19 22.15 5.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.532 0.682 . . . . 0.0 110.975 -178.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 54.2 t -123.86 141.03 45.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.7 t -127.68 140.92 51.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 104.286 -2.487 . . . . 0.0 104.286 170.498 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.2 t -135.86 138.5 47.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -114.33 114.44 45.45 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.08 157.73 30.4 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 115.955 -2.23 . . . . 0.0 111.122 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.09 149.78 31.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 103.023 -2.954 . . . . 0.0 103.023 175.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -147.88 137.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 118.776 0.716 . . . . 0.0 109.602 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 83.1 t -114.18 117.27 55.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.2 140.42 36.5 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.152 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.52 -22.68 61.78 Favored Glycine 0 C--N 1.322 -0.222 0 C-N-CA 121.06 -0.591 . . . . 0.0 113.823 -176.288 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 37.2 p -61.05 -32.06 71.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 18.0 ptp -142.66 40.69 1.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.5 tt -43.29 -45.98 6.12 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.79 -1.55 . . . . 0.0 114.906 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -61.16 -37.29 82.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -43.73 61.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.354 0.597 . . . . 0.0 110.68 -176.119 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -64.49 -41.16 96.63 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.919 0.866 . . . . 0.0 109.45 179.202 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.613 HD11 HD11 ' A' ' 11' ' ' ILE . 0.6 OUTLIER -63.49 -43.29 97.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.035 -176.55 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -73.7 -18.68 60.98 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.298 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.26 -34.85 61.42 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.2 t -90.03 -41.65 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 121.319 0.581 . . . . 0.0 110.283 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.29 79.48 70.17 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.154 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -66.78 -14.19 42.86 Favored 'Trans proline' 0 N--CA 1.474 0.376 0 N-CA-C 114.233 0.82 . . . . 0.0 114.233 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 7.2 m -83.16 2.62 34.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -68.54 132.02 46.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.51 0.672 . . . . 0.0 111.101 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 . . . . . 0 C--N 1.325 -0.482 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 176.831 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 34.2 m120 . . . . . 0 N--CA 1.464 0.227 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.8 71.85 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.941 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -69.06 -45.05 71.34 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 36.3 mmt -62.75 -28.92 70.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.131 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -61.98 -35.53 78.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.172 -0.33 . . . . 0.0 111.742 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -67.32 -44.48 79.05 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.14 0.495 . . . . 0.0 109.713 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -65.21 -38.58 90.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.732 0.777 . . . . 0.0 109.458 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -58.85 -46.68 87.17 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.377 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -66.98 -45.31 78.05 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.0 -40.5 93.79 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.595 -176.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 33.9 p -71.81 -34.74 69.61 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.203 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.28 -34.64 76.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.726 0.41 . . . . 0.0 111.712 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 71.2 t -56.94 -46.94 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 118.47 0.577 . . . . 0.0 110.675 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 C--N 1.324 -0.509 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.432 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.3 tt . . . . . 0 C--O 1.222 -0.389 0 CA-C-O 121.558 0.694 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.03 -35.25 78.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -60.82 -29.73 69.66 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.5 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -61.2 -51.07 70.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -179.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 m -63.76 -42.0 97.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.489 0.661 . . . . 0.0 110.837 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -59.09 -51.75 68.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.97 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -72.37 -28.66 63.17 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.746 -0.596 . . . . 0.0 111.547 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -64.68 -44.42 90.39 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.1 mm -70.84 -37.67 69.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.23 81.64 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.52 -46.12 89.86 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 116.894 -0.139 . . . . 0.0 111.305 178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -54.73 -47.18 74.1 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.228 0.611 . . . . 0.0 112.037 -177.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.07 -45.82 55.14 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.409 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.6 t -56.97 -41.92 77.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 O-C-N 122.032 -0.417 . . . . 0.0 111.4 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -72.08 -4.78 30.89 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.141 -0.974 . . . . 0.0 112.734 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.4 m -98.31 13.56 31.03 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.68 -3.92 53.4 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.394 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.469 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.0 m-85 -69.67 121.69 17.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.627 0.727 . . . . 0.0 109.694 -178.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.62 129.94 9.59 Favored Glycine 0 N--CA 1.449 -0.495 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.5 t -74.01 126.9 35.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.0 mt -96.2 -44.04 12.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -150.17 133.23 16.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 118.936 0.789 . . . . 0.0 112.404 179.434 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.382 0.611 . . . . 0.0 111.541 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -129.89 159.08 37.7 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 115.1 1.519 . . . . 0.0 115.1 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.6 mt -139.25 131.19 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.86 0.864 . . . . 0.0 109.036 176.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -100.92 135.9 41.62 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 mp -129.46 138.1 51.22 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 122.975 0.51 . . . . 0.0 110.095 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.05 137.78 32.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -88.45 107.47 16.96 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 117.905 0.32 . . . . 0.0 111.513 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 81.9 Cg_endo -70.06 -17.01 36.48 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 120.58 0.854 . . . . 0.0 112.474 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -66.62 -25.26 66.52 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.884 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 60.7 42.96 12.94 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 -174.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.2 t -66.47 -177.52 0.57 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 112.577 -2.102 . . . . 0.0 112.943 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.9 p -55.07 -33.98 63.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 178.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 25.5 p-80 -107.29 143.24 35.83 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -89.73 -29.72 18.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.721 -173.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.69 164.43 28.85 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.479 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.1 t -130.54 138.07 54.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -123.85 113.65 18.81 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tp -94.57 128.56 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -136.46 118.4 15.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.426 0.557 . . . . 0.0 111.607 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -86.47 94.68 9.47 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.383 -0.823 . . . . 0.0 109.084 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.2 t-160 -147.25 135.81 21.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.164 0.506 . . . . 0.0 111.314 -176.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -89.99 151.54 21.63 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 124.951 1.3 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.7 mt -138.32 140.06 39.36 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -176.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -92.86 -44.71 8.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -129.64 160.57 32.92 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.712 -0.618 . . . . 0.0 109.634 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -64.65 -22.42 66.97 Favored 'General case' 0 C--O 1.219 -0.513 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -66.28 -33.36 75.57 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.252 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -69.16 -35.06 75.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 177.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.27 -50.53 67.55 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.327 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.3 m -63.72 -32.79 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 O-C-N 121.452 -0.78 . . . . 0.0 110.297 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.55 -36.92 83.85 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.663 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.78 -46.71 86.72 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.2 mp -69.22 -33.94 60.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.418 -0.801 . . . . 0.0 110.744 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -57.91 -40.81 81.27 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -69.29 -44.74 71.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.477 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.53 -42.92 97.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.1 -31.28 66.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -41.49 98.15 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.214 1.007 . . . . 0.0 109.474 177.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -73.6 -33.93 64.82 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -65.32 -43.34 95.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.92 -33.68 75.16 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.395 0.998 . . . . 0.0 110.556 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.18 -45.36 93.75 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.095 -0.378 . . . . 0.0 110.184 175.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.51 -40.43 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -37.56 69.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.126 -0.359 . . . . 0.0 110.739 178.019 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -63.08 -40.52 97.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.519 0.2 . . . . 0.0 110.787 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -65.91 -39.62 90.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.192 0.52 . . . . 0.0 110.307 179.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -77.28 -9.66 58.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.868 -0.606 . . . . 0.0 112.6 -179.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.69 14.67 60.86 Favored Glycine 0 CA--C 1.52 0.396 0 CA-C-O 121.43 0.461 . . . . 0.0 113.837 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.5 mtp85 -73.51 148.65 42.9 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.955 -0.733 . . . . 0.0 112.665 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.48 -33.75 71.61 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.539 176.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -154.4 151.67 29.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.5 mmm -118.43 141.84 48.15 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 43.4 tttp -120.82 130.75 54.1 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -132.68 125.92 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.901 0.382 . . . . 0.0 111.857 -171.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.3 tp -88.23 123.32 32.73 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 175.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -116.41 127.97 55.09 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.18 116.36 47.57 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 120.991 0.424 . . . . 0.0 110.734 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -83.56 145.4 28.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -121.45 112.0 17.99 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 173.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.5 m -130.28 154.03 48.03 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -170.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.2 m -67.21 -48.28 68.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -141.41 159.59 41.9 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 -177.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.86 157.84 45.59 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.616 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -61.45 146.86 96.7 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 117.715 -1.056 . . . . 0.0 111.168 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.0 m -70.66 -11.71 15.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 118.983 2.957 . . . . 0.0 118.983 -168.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.42 137.41 21.74 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t0 47.17 14.48 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 119.242 3.053 . . . . 0.0 119.242 171.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -69.02 -21.38 64.13 Favored 'General case' 0 C--N 1.318 -0.771 0 O-C-N 121.026 -1.046 . . . . 0.0 113.605 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -59.3 -31.15 68.88 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.019 -0.425 . . . . 0.0 111.473 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.34 -31.07 72.13 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.196 0.522 . . . . 0.0 109.821 177.494 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.7 mm -71.1 -40.73 75.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.028 0.442 . . . . 0.0 110.159 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.97 5.38 8.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.461 0.648 . . . . 0.0 110.569 178.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.34 -2.69 15.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.815 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -125.24 137.9 54.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.776 0.798 . . . . 0.0 112.512 -175.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 28.2 m -83.28 122.79 28.9 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.395 -2.446 . . . . 0.0 104.395 175.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -82.79 118.42 23.38 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -119.78 126.2 50.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.943 0.877 . . . . 0.0 111.287 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -127.46 75.45 1.59 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.228 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.76 -112.74 5.26 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 119.951 -1.119 . . . . 0.0 111.277 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 46.8 p -77.98 17.7 0.56 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 83.0 t -130.47 140.53 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 123.01 0.524 . . . . 0.0 110.663 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.8 m -131.51 132.54 44.28 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 169.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.3 t -132.01 133.43 60.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -114.13 109.04 49.73 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.18 159.57 20.37 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 117.247 -1.369 . . . . 0.0 113.644 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.93 159.17 44.73 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 102.973 -2.973 . . . . 0.0 102.973 176.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.0 tt -149.23 139.76 16.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.72 108.72 26.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.61 136.29 33.35 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.11 -23.43 67.88 Favored Glycine 0 C--O 1.225 -0.45 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.404 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 26.7 p -59.0 -28.62 66.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -143.43 35.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.244 1.021 . . . . 0.0 108.355 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.8 tt -46.03 -40.55 10.78 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 -173.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.6 -37.93 85.74 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 119.227 -0.989 . . . . 0.0 112.606 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -42.45 29.27 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.958 0.885 . . . . 0.0 110.573 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -39.42 92.09 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.404 -174.677 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -68.27 -44.01 76.51 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 122.082 -0.386 . . . . 0.0 110.35 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -73.62 -14.32 61.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.928 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.12 -31.58 62.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 177.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.61 -37.86 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 120.695 0.283 . . . . 0.0 110.964 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -130.16 77.07 77.02 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 122.101 -0.374 . . . . 0.0 111.5 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.64 -13.8 37.99 Favored 'Trans proline' 0 C--N 1.348 0.548 0 N-CA-C 113.819 0.661 . . . . 0.0 113.819 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.9 m -73.26 -10.51 59.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 178.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -102.53 125.64 49.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 . . . . . 0 CA--C 1.513 -0.445 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.33 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 . . . . . 0 C--O 1.223 -0.3 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.33 -36.5 78.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.07 0.462 . . . . 0.0 110.209 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -72.66 -40.92 65.94 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 54.2 mtt -62.09 -37.81 86.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.946 0.403 . . . . 0.0 109.988 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.85 97.47 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 122.178 -0.326 . . . . 0.0 110.247 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -64.58 -44.7 89.84 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.958 0.408 . . . . 0.0 110.121 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -63.38 -43.29 98.02 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.545 0.688 . . . . 0.0 109.953 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 37.6 ttt85 -64.02 -34.68 78.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.786 178.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -63.84 -39.56 94.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.215 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.96 -37.68 88.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.951 0.405 . . . . 0.0 109.995 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 14.5 m -69.74 -35.02 74.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.55 0.69 . . . . 0.0 110.904 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -42.93 74.3 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -62.57 -32.99 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 120.494 -0.483 . . . . 0.0 109.882 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.211 -0.968 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.538 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.468 0.43 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.1 -36.79 82.8 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.193 -0.317 . . . . 0.0 111.138 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -32.36 73.93 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.412 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -62.95 -52.54 62.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.2 m -59.96 -42.09 93.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.766 0.317 . . . . 0.0 110.73 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -56.29 -55.37 34.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 123.063 0.545 . . . . 0.0 112.15 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -71.07 -28.98 64.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 121.725 -0.61 . . . . 0.0 111.94 -178.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -70.51 -35.58 73.28 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.834 -0.541 . . . . 0.0 110.153 176.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' A' ' 11' ' ' ILE . 4.0 mm -69.38 -42.05 81.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.27 81.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.31 92.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.522 178.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -59.47 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.728 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.7 mt -63.87 -50.01 70.5 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.464 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.95 -42.34 89.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.757 0.313 . . . . 0.0 110.569 -177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -4.35 38.12 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.8 m -103.12 7.82 38.73 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.722 0.409 . . . . 0.0 110.655 176.602 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.98 0.33 35.95 Favored Glycine 0 C--O 1.228 -0.246 0 N-CA-C 116.527 1.371 . . . . 0.0 116.527 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.453 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.9 m-85 -72.89 117.96 15.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 118.312 1.056 . . . . 0.0 109.519 177.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.79 134.89 17.01 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.8 t -78.12 126.1 38.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 117.733 0.767 . . . . 0.0 109.481 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.401 HD11 HD22 ' A' ' 43' ' ' LEU . 51.9 mt -98.64 -47.98 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -149.64 138.68 21.18 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 118.847 0.749 . . . . 0.0 112.65 179.897 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 . . . . . 0 C--O 1.237 0.407 0 CA-C-O 121.61 0.719 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.63 154.94 47.36 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.126 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.2 mt -139.4 132.23 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 41.5 m95 -108.58 127.5 54.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.9 mm? -124.01 140.93 52.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.557 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -84.62 126.61 33.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 176.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.73 123.84 88.51 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.4 -29.22 14.0 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 115.56 -2.493 . . . . 0.0 113.12 -178.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -71.3 -31.97 68.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.186 0.517 . . . . 0.0 112.11 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 58.07 38.31 26.57 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.829 1.775 . . . . 0.0 108.68 -176.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.6 t -60.78 -172.63 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.725 171.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.0 m -41.52 -26.13 0.06 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -114.92 139.92 49.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 165.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -86.34 -31.58 21.47 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.843 -0.536 . . . . 0.0 109.786 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.401 HD22 HD11 ' A' ' 23' ' ' ILE . 68.9 mt -140.43 164.62 29.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 -177.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.2 p -135.29 137.36 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -111.83 125.17 53.73 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.13 124.66 39.29 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 104.009 -2.589 . . . . 0.0 104.009 174.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -136.44 125.55 24.51 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -175.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -107.34 99.16 8.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.878 0.847 . . . . 0.0 112.454 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.92 150.1 34.54 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.618 -179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.88 144.44 33.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.72 133.85 55.32 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -85.0 -39.88 17.53 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 122.37 1.081 . . . . 0.0 108.93 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -132.05 157.34 44.41 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -64.35 -19.55 65.54 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -178.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.412 ' HA ' HG22 ' A' ' 58' ' ' VAL . 6.9 pt20 -62.34 -33.24 74.33 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.473 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -69.5 -33.04 72.27 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.412 ' O ' HD12 ' A' ' 61' ' ' ILE . 4.8 ttm -72.65 -48.45 39.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.798 177.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 55' ' ' GLN . 23.6 m -58.05 -36.75 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.251 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.16 -29.8 65.66 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.668 -178.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -64.52 -39.18 93.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.412 HD12 ' O ' ' A' ' 57' ' ' MET . 2.9 mt -74.12 -38.32 48.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 122.004 -0.435 . . . . 0.0 111.857 179.286 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -66.59 -29.66 69.77 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.53 -37.76 56.17 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -56.71 -34.29 67.32 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.535 178.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.01 67.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.04 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -69.3 -46.17 67.8 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.908 0.776 . . . . 0.0 109.097 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 -56.74 -43.78 81.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.4 -34.2 57.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.076 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.84 -42.0 95.28 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.685 1.13 . . . . 0.0 109.636 176.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.43 -46.37 90.39 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.36 -38.95 82.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 178.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.57 -44.2 89.66 Favored 'General case' 0 CA--C 1.511 -0.54 0 O-C-N 121.842 -0.536 . . . . 0.0 110.22 179.443 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -66.06 -45.18 82.29 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -61.3 -41.43 96.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -90.0 -5.78 56.31 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.04 9.0 45.62 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 116.413 1.325 . . . . 0.0 116.413 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -67.22 146.62 54.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.912 -0.758 . . . . 0.0 110.477 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -62.41 -35.59 79.71 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.068 0.461 . . . . 0.0 110.338 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -149.49 148.37 29.33 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 175.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -113.75 139.04 49.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.316 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -116.06 132.06 56.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -134.56 125.57 27.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.514 0.597 . . . . 0.0 111.022 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.8 tp -89.13 124.44 34.33 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 174.737 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -113.89 108.64 17.33 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.53 111.55 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.807 0.337 . . . . 0.0 110.52 -176.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -82.78 133.06 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 176.186 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -111.27 109.47 19.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.0 m -127.31 155.59 43.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.057 0.456 . . . . 0.0 112.108 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.6 m -71.2 -46.92 60.2 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 175.123 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -138.85 158.76 43.63 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -175.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 146.13 39.61 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.862 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.68 150.3 88.41 Favored 'Trans proline' 0 C--N 1.345 0.363 0 O-C-N 121.895 0.418 . . . . 0.0 113.177 178.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -79.46 -7.49 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 116.728 2.121 . . . . 0.0 116.728 -173.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -108.49 97.0 6.73 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 14.96 55.62 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -73.12 -12.83 61.04 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.71 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.62 -31.16 70.36 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.828 -0.545 . . . . 0.0 111.735 -177.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.77 -33.2 74.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.219 0.533 . . . . 0.0 110.249 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.0 mm -67.25 -37.11 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -176.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.21 73.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.383 0.611 . . . . 0.0 110.824 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.76 -9.31 54.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.367 0.603 . . . . 0.0 111.078 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -88.14 95.74 10.27 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.157 -178.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 86.3 m -68.51 124.24 23.02 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 173.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -87.41 108.28 18.93 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -106.18 128.41 53.91 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.516 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -132.15 75.54 1.64 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.524 -1.288 . . . . 0.0 107.524 177.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.68 5.21 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.116 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.1 p -79.32 20.72 0.51 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.2 t -127.68 141.12 47.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.5 t -139.21 112.89 8.42 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.225 -1.769 . . . . 0.0 106.225 173.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.6 t -109.73 129.4 64.67 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 122.561 1.172 . . . . 0.0 110.311 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -102.07 99.73 13.2 Favored Pre-proline 0 N--CA 1.425 -1.699 0 CA-C-N 111.801 -2.454 . . . . 0.0 107.919 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.94 151.87 21.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 115.292 -2.672 . . . . 0.0 113.032 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.54 150.84 31.76 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 175.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -144.15 134.29 20.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.8 m -115.36 127.59 72.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 103.679 -2.711 . . . . 0.0 103.679 175.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.68 136.34 54.87 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -176.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -46.91 -39.03 10.82 Favored Glycine 0 N--CA 1.461 0.304 0 N-CA-C 117.268 1.667 . . . . 0.0 117.268 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -37.34 63.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.4 ptm -136.53 34.38 2.72 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.961 1.362 . . . . 0.0 108.673 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.3 tp -51.0 -38.52 51.76 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 116.966 2.21 . . . . 0.0 116.966 -172.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -64.97 -41.15 95.71 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.656 0.662 . . . . 0.0 111.255 -177.366 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.92 -37.57 70.02 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -65.91 -40.89 91.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.596 0.712 . . . . 0.0 110.811 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.36 -49.03 78.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.161 -177.138 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -71.76 -15.11 62.17 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.432 -177.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.99 -35.66 57.0 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.249 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.0 p -94.81 -37.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 120.853 0.359 . . . . 0.0 111.583 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -130.1 75.51 79.27 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 122.036 -0.415 . . . . 0.0 110.662 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.43 -13.83 40.51 Favored 'Trans proline' 0 C--N 1.349 0.598 0 CA-C-O 121.392 0.497 . . . . 0.0 112.813 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 11.9 p -75.62 -8.3 56.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.074 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -78.3 124.83 28.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.301 0.572 . . . . 0.0 110.704 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 . . . . . 0 C--N 1.322 -0.59 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.004 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 C--O 1.217 -0.618 0 CA-C-O 120.992 0.425 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.7 64.72 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.47 -45.91 85.32 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 75.4 mtm -69.6 -28.93 66.36 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.017 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.97 -31.22 69.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 122.159 -0.338 . . . . 0.0 111.575 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -65.81 -43.72 87.78 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -69.62 -36.63 76.32 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.434 0.635 . . . . 0.0 109.363 -179.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.28 92.55 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.657 177.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -66.78 -40.61 88.24 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.787 0.435 . . . . 0.0 111.86 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.7 mt -64.99 -37.78 88.8 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 121.68 -0.638 . . . . 0.0 110.039 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 38.7 m -69.06 -31.72 70.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.612 0.72 . . . . 0.0 110.282 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.88 -45.49 64.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.943 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.09 -33.06 60.99 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 CA--C 1.536 0.406 0 O-C-N 121.428 -0.795 . . . . 0.0 109.37 176.15 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 pp . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 121.024 0.44 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.32 -36.54 82.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.897 0.379 . . . . 0.0 111.385 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -68.58 -29.58 68.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.332 -0.23 . . . . 0.0 110.679 -179.348 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.97 -50.0 73.84 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.157 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -64.79 -41.48 95.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.529 179.794 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -54.5 -52.34 62.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.986 0.422 . . . . 0.0 110.936 179.548 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -73.3 -29.27 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.005 -0.434 . . . . 0.0 111.977 -179.852 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -68.7 -36.09 78.01 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.546 -0.721 . . . . 0.0 111.304 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.6 mm -70.25 -39.08 76.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.843 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.27 -44.56 84.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.72 -42.32 95.33 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.968 178.347 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -62.2 -43.06 99.69 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.655 0.264 . . . . 0.0 111.371 -179.097 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 mt -69.84 -46.26 66.0 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.173 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 40.9 t -54.56 -42.55 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.956 -0.465 . . . . 0.0 110.857 173.171 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -61.35 -33.82 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 110.839 178.069 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -79.65 9.49 5.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 122.922 0.489 . . . . 0.0 112.271 177.886 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.19 -0.21 61.93 Favored Glycine 0 CA--C 1.517 0.212 0 N-CA-C 116.415 1.326 . . . . 0.0 116.415 175.507 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.8 m-85 -68.27 132.23 46.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.93 0.865 . . . . 0.0 110.075 179.891 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.33 133.4 11.77 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.217 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.9 t -75.38 121.45 27.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.3 mt -85.67 -46.07 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 177.102 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -160.52 132.3 5.94 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 174.731 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.515 -0.373 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -147.68 143.89 27.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -136.69 133.08 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 177.039 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 57.5 m95 -112.25 133.12 54.55 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.142 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.59 131.59 48.16 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 123.426 0.69 . . . . 0.0 109.69 -178.716 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -80.92 132.91 35.46 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.686 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.74 109.59 12.53 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.338 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.2 Cg_endo -74.72 -19.0 19.01 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 117.182 -1.412 . . . . 0.0 112.239 -178.044 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -68.83 -27.88 66.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.908 178.91 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 77.7 mttt 58.74 41.96 20.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 123.175 1.465 . . . . 0.0 107.106 -178.535 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -177.08 0.24 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 111.188 -2.733 . . . . 0.0 113.409 -179.47 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.7 p -51.9 -28.22 15.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.704 175.567 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.532 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 46.8 p-80 -107.36 143.82 35.11 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 173.916 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -85.94 -36.9 19.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.566 -172.276 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -141.66 163.26 33.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.13 -177.766 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.0 t -122.84 134.57 65.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 175.014 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.25 127.7 38.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.759 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.9 mt -97.51 129.81 44.64 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -136.56 150.37 48.58 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.718 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -115.08 131.5 56.91 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 173.575 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.69 140.43 20.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.588 0.233 . . . . 0.0 111.265 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -93.01 125.51 37.64 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 175.085 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -128.49 101.48 6.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.137 -0.352 . . . . 0.0 111.11 -174.563 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.0 -42.15 58.03 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.925 0.869 . . . . 0.0 111.251 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -129.19 156.89 43.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.316 -179.324 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HD2' HD11 ' A' ' 99' ' ' ILE . 25.7 ptt180 -65.82 -20.58 66.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 122.05 -0.406 . . . . 0.0 111.249 -178.355 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -62.34 -33.31 74.45 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.59 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -72.47 -34.65 67.88 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 121.537 -0.727 . . . . 0.0 109.186 178.264 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -65.25 -47.43 76.8 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.005 178.105 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.2 m -64.78 -31.76 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.538 -0.726 . . . . 0.0 111.207 179.442 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -68.13 -36.17 79.29 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.619 179.417 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.39 -44.81 92.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.472 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.4 -30.74 51.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -176.924 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.15 -40.5 96.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -70.59 -41.07 72.83 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.273 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.412 ' O ' HG23 ' A' ' 68' ' ' VAL . 83.2 mm-40 -57.08 -48.22 79.12 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.009 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.36 94.25 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.603 -177.891 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.55 -38.85 88.01 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 121.545 0.688 . . . . 0.0 110.281 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -61.19 -42.78 99.18 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.345 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.486 HG11 HG13 ' A' ' 109' ' ' VAL . 81.9 t -69.06 -38.71 78.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 119.131 -0.461 . . . . 0.0 112.111 -179.448 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -56.55 -41.16 76.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.038 0.835 . . . . 0.0 110.201 179.812 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.3 mtm-85 -63.55 -33.46 75.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.496 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.8 t -76.72 -44.38 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.902 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.4 mmt-85 -61.05 -34.82 75.48 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -58.04 -39.64 78.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.144 0.497 . . . . 0.0 109.884 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -73.41 -38.65 65.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.918 0.389 . . . . 0.0 111.087 179.276 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.28 -18.02 60.78 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -177.261 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.38 -3.08 1.95 Allowed Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.776 1.471 . . . . 0.0 116.776 179.311 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.27 143.39 43.05 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -62.18 -36.58 82.31 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -149.14 157.86 43.71 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.231 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.38 157.76 27.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.532 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 17.5 mmtt -143.41 132.01 22.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 174.509 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tt -142.47 127.41 18.35 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -175.198 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.4 tp -83.12 104.08 13.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 175.309 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -102.62 108.55 19.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.461 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.7 t -100.38 112.32 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.314 -176.24 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -91.41 106.78 18.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.417 0.627 . . . . 0.0 112.045 -179.903 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -79.19 126.89 31.35 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.482 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 92.2 p -141.42 164.04 31.3 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 122.696 0.398 . . . . 0.0 110.669 -174.342 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 74.3 m -69.7 -49.07 56.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 176.231 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -153.54 177.85 10.48 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 -175.429 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.439 ' HB2' ' HD2' ' A' ' 117' ' ' ARG . . . -96.01 151.19 38.12 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.638 -174.873 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.58 149.74 80.42 Favored 'Trans proline' 0 C--N 1.351 0.661 0 O-C-N 122.475 0.724 . . . . 0.0 113.079 174.831 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.0 m -80.26 -10.71 12.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -175.45 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -117.57 74.87 0.95 Allowed 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -172.836 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 53.38 49.16 20.3 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 174.083 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 49.5 p-90 -68.16 -19.71 64.82 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 121.522 -0.736 . . . . 0.0 109.875 175.517 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -63.06 -34.56 77.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.725 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.59 -35.2 70.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 176.273 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.557 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.3 mm -71.12 -44.57 74.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.132 0.491 . . . . 0.0 111.095 -176.341 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 100' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -67.96 -27.89 66.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.645 0.736 . . . . 0.0 111.79 -177.414 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -93.89 6.22 49.14 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.236 -177.049 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -119.89 144.41 47.42 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.407 0.622 . . . . 0.0 111.436 176.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.7 m -88.2 127.77 35.45 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.415 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -85.0 129.77 34.74 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 175.582 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -132.32 128.96 38.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.543 0.687 . . . . 0.0 110.091 178.475 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -149.54 114.78 5.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.251 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 58.01 -127.29 44.71 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.477 -0.868 . . . . 0.0 114.195 177.917 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.8 p -82.46 13.11 3.85 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 122.746 0.419 . . . . 0.0 111.155 -178.95 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.486 HG13 HG11 ' A' ' 68' ' ' VAL . 2.3 t -123.57 149.9 27.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -176.903 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.9 t -138.43 139.75 39.02 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 100.259 -3.978 . . . . 0.0 100.259 171.175 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.6 t -136.31 136.57 48.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 118.42 0.554 . . . . 0.0 109.806 -177.189 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -105.62 113.77 63.73 Favored Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 171.913 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.497 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 69.6 Cg_endo -76.36 158.28 36.88 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 116.158 -2.094 . . . . 0.0 111.638 176.873 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 152.78 37.66 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.35 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.2 tt -145.13 138.01 21.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -177.811 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 96.5 t -118.16 119.97 63.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.016 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.439 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -85.91 156.55 20.46 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 179.687 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.69 -27.67 53.44 Favored Glycine 0 C--N 1.318 -0.456 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 168.75 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 p -67.66 -42.82 81.56 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -177.234 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptp -128.28 37.98 4.06 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.559 1.171 . . . . 0.0 109.281 -179.272 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -45.55 -43.27 11.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.59 -1.641 . . . . 0.0 115.07 -177.233 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.3 mtm180 -69.5 -31.49 69.78 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.495 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -72.31 -41.54 66.44 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.443 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -64.5 -41.5 96.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.495 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.38 -42.14 98.24 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.568 -0.73 . . . . 0.0 112.371 -179.446 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -76.38 -14.34 60.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 119.813 1.188 . . . . 0.0 112.105 -179.07 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -85.09 -40.01 17.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.27 0.557 . . . . 0.0 110.246 178.705 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 42.6 t -91.57 -40.87 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.417 0.627 . . . . 0.0 110.816 -177.523 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -128.44 70.57 79.73 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.876 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.04 -15.69 49.54 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 CA-C-N 118.39 0.461 . . . . 0.0 113.147 179.691 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.7 m -83.37 0.34 46.4 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -73.34 137.02 44.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.327 0.584 . . . . 0.0 109.683 179.376 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 . . . . . 0 C--N 1.325 -0.496 0 CA-C-O 121.592 0.71 . . . . 0.0 109.805 -179.151 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 . . . . . 0 C--O 1.216 -0.689 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.15 90.2 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.854 -0.529 . . . . 0.0 111.496 177.822 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -65.86 -41.98 90.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 179.446 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 63.2 mtt -67.68 -29.01 68.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.397 178.299 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.06 -34.07 75.56 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.048 -0.407 . . . . 0.0 111.803 -179.298 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 76.7 ttt-85 -65.41 -46.68 79.06 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 178.476 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.65 -46.07 91.35 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.356 -0.537 . . . . 0.0 109.881 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -60.7 -35.52 76.49 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.328 -178.364 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -65.76 -41.36 92.18 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.538 0.208 . . . . 0.0 111.004 176.826 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.2 mt -66.07 -35.94 81.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.033 0.444 . . . . 0.0 110.109 -179.523 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.5 t -69.77 -42.94 73.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.483 0.659 . . . . 0.0 109.422 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.32 -46.0 90.7 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -177.818 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -58.68 -39.4 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 118.966 0.803 . . . . 0.0 111.986 -175.739 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--N 1.326 -0.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.165 178.305 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.47 0.559 0 CA-C-O 121.824 0.821 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 36.2 mt -59.9 -35.32 74.6 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.986 -178.853 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 43.4 mt-10 -67.38 -26.0 66.24 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.17 -177.165 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.24 -52.74 63.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.65 -41.89 68.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.899 178.691 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.434 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 77.0 t80 -56.85 -52.16 66.18 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.052 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -73.8 -33.53 64.23 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.653 -0.654 . . . . 0.0 112.269 -179.506 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -69.16 -34.82 75.57 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.417 -0.802 . . . . 0.0 111.034 178.222 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 125' ' ' LEU . 11.8 mm -72.72 -34.05 46.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 177.045 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.09 84.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 175.825 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.81 87.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.568 178.032 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -60.33 -46.06 91.24 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.23 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -64.99 -43.14 93.56 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.523 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.72 -43.01 94.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.28 179.775 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.5 p30 -75.38 -10.56 59.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.3 -0.875 . . . . 0.0 112.079 178.451 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.2 m -89.98 6.05 43.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 173.723 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.92 -0.51 67.1 Favored Glycine 0 CA--C 1.517 0.172 0 N-CA-C 116.353 1.301 . . . . 0.0 116.353 175.623 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -66.39 131.1 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 118.187 0.993 . . . . 0.0 110.0 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.94 131.65 10.56 Favored Glycine 0 N--CA 1.451 -0.357 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 -178.208 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.6 t -74.57 125.82 34.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.363 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 61.3 mt -93.65 -48.43 13.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.58 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -149.49 128.76 12.87 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.302 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 175.119 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 . . . . . 0 C--O 1.222 -0.366 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -133.28 152.07 51.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.262 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 25.8 mt -140.55 134.61 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 175.063 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 m95 -109.04 132.25 54.29 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -125.72 135.38 52.02 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.802 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.447 ' HA ' HD23 ' A' ' 43' ' ' LEU . 25.0 tt0 -94.75 133.59 38.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 175.748 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.75 128.17 93.75 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -77.78 -28.54 5.1 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 116.657 -1.762 . . . . 0.0 114.378 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -77.67 -28.62 51.21 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 123.62 0.768 . . . . 0.0 112.033 -178.39 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 55.09 40.6 31.95 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.4 m -66.09 -173.12 0.17 Allowed 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 164.612 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.7 t -41.25 -39.45 1.36 Allowed 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -75.84 123.8 26.26 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -104.82 -26.32 12.28 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 176.955 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 34' ' ' GLU . 96.4 mt -140.35 155.41 46.79 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -176.488 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.4 t -132.83 136.12 56.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 175.176 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -124.8 129.93 51.4 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.8 mt -102.55 131.43 49.28 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 174.448 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -136.4 103.03 5.14 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -174.912 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.9 96.38 7.02 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 178.019 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -151.69 122.73 7.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.125 -173.634 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.04 151.38 28.42 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.1 mt -138.59 110.46 7.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -173.951 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.26 -40.37 67.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -134.15 155.59 49.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.902 -175.206 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -63.87 -22.92 67.14 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 177.64 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.6 -39.51 88.42 Favored 'General case' 0 C--O 1.211 -0.945 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.424 -179.733 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.26 -37.02 80.32 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.252 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.495 ' O ' HD12 ' A' ' 61' ' ' ILE . 18.1 ttt -60.45 -51.6 68.77 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.379 178.925 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.42 -32.53 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 118.895 0.771 . . . . 0.0 111.116 -179.138 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.1 mtm105 -66.53 -38.1 86.43 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.834 0.349 . . . . 0.0 110.439 -178.823 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -60.34 -39.72 88.12 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.013 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.495 HD12 ' O ' ' A' ' 57' ' ' MET . 2.7 mp -74.18 -34.36 37.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.305 -0.872 . . . . 0.0 111.364 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -63.06 -35.33 79.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -68.7 -43.44 76.03 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 175.66 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -58.42 -40.99 83.97 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 121.663 -0.648 . . . . 0.0 110.539 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.65 -43.4 84.72 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 122.233 -0.292 . . . . 0.0 110.777 -178.962 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -64.64 -47.5 78.3 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.338 0.59 . . . . 0.0 110.017 179.146 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -59.14 -49.41 77.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.955 179.353 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.1 p -72.91 -32.34 39.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.685 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.0 -40.16 94.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 118.984 0.811 . . . . 0.0 111.036 -178.074 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -61.16 -35.3 76.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.232 -178.632 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.08 -50.46 19.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 178.371 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -71.08 -30.35 66.45 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -172.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -56.87 -29.65 63.13 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.613 0.642 . . . . 0.0 110.5 177.24 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.63 -21.19 66.55 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 mp -82.73 -12.35 57.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.912 0.387 . . . . 0.0 110.255 178.592 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.18 11.04 66.74 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.224 -0.513 . . . . 0.0 113.459 -178.437 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -67.26 136.94 55.71 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.258 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -63.18 -35.69 81.15 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -174.682 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.1 ptt85 -153.25 156.55 38.69 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 174.767 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -115.85 154.31 29.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.982 0.513 . . . . 0.0 111.451 -177.823 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -136.51 125.37 24.1 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 167.394 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.59 145.02 42.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.662 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.4 tp -108.64 121.28 44.69 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 172.486 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -115.86 108.69 16.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.035 0.38 . . . . 0.0 110.254 -178.641 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -104.94 107.71 23.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 111.997 -176.433 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -77.17 147.94 36.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.176 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -127.14 114.95 18.38 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 171.038 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -133.55 160.15 38.31 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.34 0.656 . . . . 0.0 109.978 -173.483 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -75.97 -50.14 15.73 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.572 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -124.26 158.39 32.63 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 106.553 -1.647 . . . . 0.0 106.553 -176.231 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.36 150.11 56.63 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 177.229 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -58.2 146.61 87.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 118.152 -0.766 . . . . 0.0 113.353 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.56 -12.43 15.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 115.808 1.781 . . . . 0.0 115.808 -174.035 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -133.34 137.84 46.1 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 121.947 -0.471 . . . . 0.0 112.21 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.9 t0 14.57 59.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 119.087 2.995 . . . . 0.0 119.087 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 22.7 p-90 -87.43 -24.1 24.29 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 121.133 -0.98 . . . . 0.0 109.73 178.413 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -64.17 -35.4 80.67 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 121.392 -0.818 . . . . 0.0 112.905 -174.446 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.8 -20.84 61.08 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.223 178.504 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.7 mm -70.41 -39.09 76.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.557 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.542 0.687 . . . . 0.0 111.153 -179.591 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -89.1 1.17 55.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.174 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -103.31 101.15 11.07 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.8 m -70.19 123.25 21.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 173.967 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -84.22 123.3 29.97 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 178.001 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.82 127.96 48.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.795 0.807 . . . . 0.0 109.302 179.237 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -145.5 122.12 11.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.229 -178.746 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.21 -112.95 5.42 Favored Glycine 0 C--O 1.226 -0.405 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 75.7 p -105.01 -2.9 23.89 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 178.525 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.0 t -96.84 139.47 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.842 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 76.3 p -119.69 140.15 51.11 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.631 -2.359 . . . . 0.0 104.631 168.914 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.32 130.96 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.795 0 CA-C-O 121.984 0.897 . . . . 0.0 110.044 179.106 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -100.59 109.46 57.45 Favored Pre-proline 0 N--CA 1.427 -1.624 0 CA-C-N 113.632 -1.622 . . . . 0.0 109.384 -179.947 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.5 154.61 21.16 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 117.894 -0.937 . . . . 0.0 112.085 178.253 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.89 151.95 30.96 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 175.553 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.7 tt -145.69 132.71 15.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.777 0.799 . . . . 0.0 110.489 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 99.2 t -104.72 126.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 175.696 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.89 142.91 43.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 104.511 -2.403 . . . . 0.0 104.511 176.329 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.5 -20.64 59.27 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.531 -0.366 . . . . 0.0 113.926 -175.555 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 55.6 p -62.49 -27.82 69.4 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.261 0.838 . . . . 0.0 113.261 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 19.5 ptp -146.9 44.46 1.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.71 1.243 . . . . 0.0 107.714 178.231 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tp -42.79 -50.41 5.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.606 -1.634 . . . . 0.0 114.777 -175.473 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -66.99 -36.23 81.7 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.885 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.63 -38.77 64.93 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.876 0.47 . . . . 0.0 110.347 -175.278 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -68.77 -38.97 80.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 176.128 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.447 HD11 HD11 ' A' ' 11' ' ' ILE . 1.8 tm? -59.39 -50.18 74.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.439 -177.615 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -71.92 -14.54 61.96 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.58 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.64 -37.26 50.39 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 122.061 -0.399 . . . . 0.0 109.957 177.123 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.7 p -90.28 -36.99 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -128.67 76.13 79.04 Favored Pre-proline 0 C--N 1.326 -0.44 0 C-N-CA 122.613 0.365 . . . . 0.0 110.657 178.205 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.02 -14.68 41.7 Favored 'Trans proline' 0 C--N 1.349 0.596 0 CA-C-O 121.1 0.375 . . . . 0.0 112.904 178.875 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -76.47 -8.98 58.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.798 177.899 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -72.39 138.54 47.28 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.548 0 CA-C-O 121.738 0.78 . . . . 0.0 112.254 -179.398 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 . . . . . 0 C--O 1.217 -0.648 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.06 88.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.03 0.443 . . . . 0.0 110.681 177.972 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.9 tm0? -68.53 -49.81 56.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.09 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.5 mtt -64.92 -29.74 70.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -178.308 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.92 -33.24 64.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.518 0.192 . . . . 0.0 111.518 -179.158 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -63.98 -47.43 80.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-O 120.959 0.409 . . . . 0.0 109.925 177.878 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -68.18 -38.95 82.57 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.213 0.53 . . . . 0.0 110.573 -177.496 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -66.11 -38.17 87.53 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.153 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -63.9 -44.04 94.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.872 0.368 . . . . 0.0 111.207 176.88 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.18 -33.29 75.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.991 0.425 . . . . 0.0 110.452 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -76.06 -35.77 59.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.576 0.703 . . . . 0.0 110.954 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.2 tt -65.63 -41.23 92.89 Favored 'General case' 0 C--O 1.218 -0.58 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.655 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.5 p -58.08 -39.5 72.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.149 -0.621 . . . . 0.0 111.248 -176.917 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.0 tm? . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.15 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 N--CA 1.464 0.264 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.8 tp -57.61 -43.7 84.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.064 0.459 . . . . 0.0 110.886 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.99 -29.82 70.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.336 -179.61 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -59.56 -55.65 31.86 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 179.785 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.9 m -60.41 -40.68 91.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.164 0.507 . . . . 0.0 111.561 -178.023 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -56.85 -43.55 81.27 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 178.778 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -78.84 -35.15 44.44 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 123.086 1.422 . . . . 0.0 109.151 -177.236 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -64.91 -39.11 93.02 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 113.131 -1.85 . . . . 0.0 111.798 -176.912 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 26.0 mm -70.23 -37.68 72.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.174 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.17 -42.54 91.03 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.318 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.19 -41.89 94.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 177.939 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -58.27 -46.71 85.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -67.85 -49.42 62.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.92 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.21 -43.01 88.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.052 -177.894 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -11.28 60.86 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.73 -0.606 . . . . 0.0 112.478 -179.028 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.9 m -95.49 6.79 48.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.998 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.7 -1.2 52.51 Favored Glycine 0 C--O 1.228 -0.247 0 N-CA-C 115.989 1.156 . . . . 0.0 115.989 176.527 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.03 118.85 11.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 118.519 1.159 . . . . 0.0 109.103 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.66 127.52 16.31 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 108.772 -1.731 . . . . 0.0 108.772 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.48 130.51 35.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.539 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.39 -41.41 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.244 -176.867 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -140.71 140.24 34.86 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 103.881 -2.637 . . . . 0.0 103.881 178.509 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HA ' HG23 ' A' ' 31' ' ' ILE . . . . . . . . 0 C--N 1.327 -0.41 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.206 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.97 158.63 28.67 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.461 HG23 ' HA ' ' A' ' 25' ' ' ALA . 7.2 mt -138.33 127.42 32.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.515 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.51 132.47 55.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.988 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -127.62 131.85 49.84 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 123.542 0.526 . . . . 0.0 109.684 -178.421 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -84.15 134.48 34.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.744 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 114.97 34.88 Favored Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.389 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -73.61 -28.07 12.21 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 117.239 -1.374 . . . . 0.0 114.157 -174.174 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -9.88 59.25 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 122.171 -0.331 . . . . 0.0 111.461 -179.502 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.7 mtmm 62.2 39.68 12.44 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 -175.176 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -177.71 0.63 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 111.519 -2.582 . . . . 0.0 115.726 -176.807 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -44.99 -28.09 0.63 Allowed 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 177.962 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -114.51 141.43 47.72 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 174.053 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.06 -36.85 55.62 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -178.739 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.7 mt -140.65 163.02 33.99 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 87.0 t -128.19 136.56 59.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 105.213 -2.144 . . . . 0.0 105.213 174.569 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -123.48 129.19 50.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.881 0.372 . . . . 0.0 110.23 179.289 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.4 mt -109.87 120.86 43.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 176.407 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -136.45 132.85 35.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 117.95 0.341 . . . . 0.0 110.289 -176.194 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -106.96 118.79 37.62 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.212 0.529 . . . . 0.0 110.41 179.518 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -151.55 150.18 30.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.966 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -86.05 143.27 28.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.023 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.9 mt -143.69 103.58 4.09 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.729 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -79.62 -38.41 33.89 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 121.769 0.795 . . . . 0.0 111.99 -178.824 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.1 152.77 48.33 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.952 -0.468 . . . . 0.0 110.116 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -64.02 -20.9 66.24 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.7 -33.49 76.08 Favored 'General case' 0 C--O 1.213 -0.863 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.875 179.301 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.07 -32.28 64.92 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 28.6 ttm -66.23 -51.02 61.64 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.448 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.4 m -61.91 -34.55 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 118.82 0.736 . . . . 0.0 111.291 178.894 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -64.71 -38.25 90.34 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 120.752 0.311 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.75 -44.07 94.0 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.417 HG21 ' HB2' ' A' ' 104' ' ' PHE . 1.3 mm -66.14 -31.15 52.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.54 -0.464 . . . . 0.0 112.13 -177.474 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.14 -39.77 94.72 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 177.793 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -68.52 -44.9 73.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.145 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -57.97 -44.17 86.91 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.87 -43.85 90.94 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 111.477 0.177 . . . . 0.0 111.477 -176.984 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.08 -36.26 77.41 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.88 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -64.21 -45.74 86.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.548 177.405 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.69 -37.87 81.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.648 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -61.6 -41.65 97.74 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 122.211 -0.306 . . . . 0.0 110.643 178.76 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.8 mtt85 -62.98 -44.72 95.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.426 179.139 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.24 -40.81 90.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.485 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.2 OUTLIER -68.0 -40.54 83.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.249 -0.907 . . . . 0.0 111.619 179.659 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -60.16 -35.96 76.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.926 0.393 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -60.75 -31.11 70.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -179.241 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.81 9.06 10.62 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -177.348 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.09 5.67 21.43 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 121.472 3.349 . . . . 0.0 121.472 171.274 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.44 146.61 53.83 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.877 1.839 . . . . 0.0 107.44 178.763 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.8 tpt85 -62.31 -42.67 99.56 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -174.596 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -147.39 152.31 37.95 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 118.918 0.781 . . . . 0.0 110.307 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' MET . . . . . 0.441 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -100.4 163.83 12.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.37 123.08 12.58 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.775 -3.787 . . . . 0.0 100.775 174.746 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.41 114.27 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.879 0.763 . . . . 0.0 111.803 -173.777 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 62.2 tp -81.46 117.26 21.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.011 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -111.47 109.52 19.51 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.28 112.18 35.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 120.866 0.365 . . . . 0.0 111.955 -176.483 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -85.76 117.78 24.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.11 177.744 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -94.23 111.44 23.18 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 174.948 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.2 p -122.16 155.19 36.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.83 0.348 . . . . 0.0 111.111 -176.038 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 16.4 m -67.24 -48.41 67.86 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 176.397 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -148.72 159.81 43.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 -177.572 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.09 159.12 40.45 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.717 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.34 147.84 65.0 Favored 'Trans proline' 0 C--N 1.351 0.699 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 179.151 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.2 m -84.44 -5.24 9.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.4 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -115.03 97.11 6.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.649 0.38 . . . . 0.0 111.316 -177.325 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 14.55 64.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 117.9 2.555 . . . . 0.0 117.9 176.506 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 54.8 p-90 -83.57 -16.74 44.21 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -37.06 71.54 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -173.957 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -66.06 -23.95 66.63 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.644 -0.66 . . . . 0.0 111.686 178.533 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.1 mm -67.07 -37.3 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -176.908 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.99 -22.9 64.95 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.655 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -92.04 3.27 55.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.217 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -102.72 98.45 8.47 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 122.033 -0.417 . . . . 0.0 111.63 -178.23 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.6 m -68.04 126.54 29.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 174.251 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 104' ' ' PHE . . . . . 0.417 ' HB2' HG21 ' A' ' 61' ' ' ILE . 9.5 t80 -82.72 109.03 16.53 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.86 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -111.07 114.43 27.7 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.327 -176.226 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -134.57 80.48 1.85 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.609 -177.774 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.13 -108.48 2.49 Favored Glycine 0 CA--C 1.517 0.185 0 C-N-CA 118.902 -1.618 . . . . 0.0 112.747 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.0 p -86.92 11.59 13.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.221 0.608 . . . . 0.0 111.062 179.489 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 92.6 t -120.68 141.06 42.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -176.317 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.8 t -141.23 127.4 19.63 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 104.45 -2.426 . . . . 0.0 104.45 169.734 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.1 t -133.64 123.49 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -102.89 115.8 63.59 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.046 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -79.86 157.58 24.21 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 116.033 -2.178 . . . . 0.0 112.975 179.257 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.78 151.83 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.615 -2.735 . . . . 0.0 103.615 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.1 tt -146.18 142.68 21.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.1 m -124.34 138.19 54.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 104.478 -2.415 . . . . 0.0 104.478 174.373 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.38 142.35 43.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 178.569 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.86 -19.48 61.02 Favored Glycine 0 C--N 1.323 -0.194 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.806 -176.925 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.1 p -63.9 -33.38 75.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -178.012 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.4 ptm -138.33 36.63 2.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.738 1.256 . . . . 0.0 108.54 -178.74 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 20.4 tp -49.87 -36.53 27.39 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 -173.238 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.64 -48.2 78.2 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.706 -0.621 . . . . 0.0 110.862 -178.111 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.87 -34.17 66.54 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.294 -177.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.79 -42.64 81.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.961 178.264 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.7 -48.6 81.05 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.703 -177.941 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -68.85 -13.78 62.62 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.529 -177.201 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.05 -32.48 50.91 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.171 -0.33 . . . . 0.0 110.66 176.949 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 6.9 p -95.63 -38.19 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 120.887 0.375 . . . . 0.0 111.078 178.846 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -126.87 76.12 75.55 Favored Pre-proline 0 C--N 1.325 -0.495 0 C-N-CA 122.475 0.31 . . . . 0.0 110.534 178.53 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -13.98 39.59 Favored 'Trans proline' 0 C--N 1.347 0.493 0 CA-C-O 121.195 0.415 . . . . 0.0 112.412 178.443 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.4 m -69.87 -13.71 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.3 177.07 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -105.65 127.88 53.32 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.07 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 . . . . . 0 C--N 1.324 -0.507 0 CA-C-O 121.167 0.508 . . . . 0.0 112.242 -179.478 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 . . . . . 0 C--O 1.216 -0.659 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.29 80.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.979 0.419 . . . . 0.0 110.293 178.535 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -74.26 -45.88 45.03 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.961 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 20.2 mmt -59.14 -31.4 68.93 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.339 179.642 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.2 81.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 122.244 -0.285 . . . . 0.0 111.147 179.453 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -67.85 -47.39 69.08 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.22 -42.86 99.68 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 -176.962 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.39 -34.44 74.53 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.635 178.649 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -66.35 -45.45 80.14 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.075 0.398 . . . . 0.0 110.13 176.963 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.18 -39.72 93.63 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 40.1 m -67.02 -37.47 84.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.675 177.223 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.14 -38.83 91.87 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.278 -179.509 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.3 t -57.75 -47.96 84.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.462 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 C--N 1.325 -0.46 0 O-C-N 121.808 -0.558 . . . . 0.0 110.342 179.928 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.02 -35.28 78.02 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.332 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.64 -33.03 74.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -176.275 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -60.38 -48.59 81.09 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.577 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.0 m -68.84 -40.11 79.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.046 0.45 . . . . 0.0 111.198 179.362 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -54.44 -52.23 62.45 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.99 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -70.14 -27.01 64.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.604 -0.685 . . . . 0.0 111.339 -179.885 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -68.51 -36.75 79.32 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.796 -0.565 . . . . 0.0 110.23 176.452 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.8 mm -67.0 -45.09 87.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 177.421 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.34 77.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.221 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.5 99.28 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -35.71 77.37 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.889 -178.308 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -69.72 -47.25 63.78 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.62 -41.59 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.168 177.809 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -75.05 -6.65 50.58 Favored 'General case' 0 C--O 1.217 -0.618 0 O-C-N 121.026 -1.046 . . . . 0.0 112.34 179.45 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.3 m -92.6 10.3 31.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 173.583 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.62 -3.55 56.25 Favored Glycine 0 C--N 1.329 0.167 0 N-CA-C 116.147 1.219 . . . . 0.0 116.147 175.716 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -67.53 125.23 25.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.649 0.724 . . . . 0.0 110.246 -179.902 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.71 131.24 10.29 Favored Glycine 0 C--O 1.225 -0.437 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.135 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.6 t -73.55 126.69 34.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 179.334 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.491 HD11 HD22 ' A' ' 43' ' ' LEU . 71.8 mt -92.72 -43.12 13.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 177.305 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -149.16 121.03 8.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.607 -176.075 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.617 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 171.501 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.69 129.72 20.75 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -177.896 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 89.1 mt -135.89 131.78 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.077 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.8 m95 -109.17 138.74 45.06 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.046 0.45 . . . . 0.0 110.882 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mp -132.57 137.97 47.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.131 0.972 . . . . 0.0 109.963 -178.31 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -86.57 133.92 33.68 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.375 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 119.76 77.93 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 103.393 -2.818 . . . . 0.0 103.393 174.964 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.55 -23.32 27.32 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 116.356 -1.962 . . . . 0.0 112.807 -173.545 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -71.35 -34.82 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 179.632 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 58.05 41.08 24.66 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.818 1.771 . . . . 0.0 108.652 -169.22 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -75.12 -172.78 1.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 110.939 -2.846 . . . . 0.0 105.681 172.816 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.2 m -41.22 -27.79 0.08 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -108.58 133.84 52.16 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.085 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -87.69 -44.73 10.96 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.185 0.516 . . . . 0.0 111.152 -178.224 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.491 HD22 HD11 ' A' ' 23' ' ' ILE . 76.2 mt -137.07 160.64 38.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.674 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.1 t -130.7 135.61 59.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 177.683 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 135.66 52.54 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 174.588 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -106.04 130.21 54.0 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 -179.591 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -130.27 124.74 33.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.846 0.355 . . . . 0.0 111.54 -176.823 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -103.3 94.52 5.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -149.36 133.85 17.58 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -175.779 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -78.28 144.64 35.95 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.739 -1.119 . . . . 0.0 108.439 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -135.93 110.05 8.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.762 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -81.42 -39.66 24.58 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.661 0.743 . . . . 0.0 111.4 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -127.0 149.78 49.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.567 -178.958 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -66.29 -18.86 65.6 Favored 'General case' 0 CA--C 1.504 -0.803 0 O-C-N 122.341 -0.225 . . . . 0.0 111.378 -178.732 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -62.99 -33.42 75.37 Favored 'General case' 0 C--O 1.211 -0.97 0 C-N-CA 119.616 -0.834 . . . . 0.0 108.874 178.054 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.36 -38.26 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.964 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.5 ttm -59.8 -51.18 70.83 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.802 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 15.1 m -64.55 -31.83 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-O 121.166 0.508 . . . . 0.0 111.496 -178.112 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -70.06 -41.47 74.12 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.55 -177.64 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -58.57 -41.99 86.94 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.9 mm -70.07 -33.69 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 119.776 -0.769 . . . . 0.0 111.788 -178.835 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -31.05 69.98 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.763 -178.772 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -45.33 58.77 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 175.15 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -57.49 -35.05 69.7 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.176 179.525 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.72 -34.48 74.45 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 122.354 -0.216 . . . . 0.0 111.261 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -69.91 -38.97 76.42 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.229 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -61.59 -43.43 98.88 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.679 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.421 HG11 HG13 ' A' ' 109' ' ' VAL . 70.8 t -64.98 -44.24 96.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 179.41 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.41 -46.06 87.2 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.746 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm105 -61.33 -42.3 98.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -177.719 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.3 -38.54 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.695 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -30.21 70.1 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.151 -0.968 . . . . 0.0 111.533 -177.959 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -40.24 78.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.759 0.314 . . . . 0.0 110.415 179.354 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -67.18 -39.38 86.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.917 -178.811 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.11 -8.13 59.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.892 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.38 19.44 68.6 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 114.029 0.372 . . . . 0.0 114.029 179.787 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.2 mtp85 -67.39 141.23 57.13 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 121.761 -0.846 . . . . 0.0 111.936 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.35 -35.14 78.77 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 178.002 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -155.72 147.56 23.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -122.45 139.91 53.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 178.104 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -113.46 121.39 44.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.92 0.39 . . . . 0.0 111.033 177.703 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -110.95 130.54 55.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.363 -178.121 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -93.05 121.13 34.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.607 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -115.89 128.33 55.71 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.742 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.4 t -125.45 113.87 37.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.969 0.414 . . . . 0.0 110.676 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -80.05 146.21 32.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.056 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -123.85 111.85 16.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 173.209 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 46.3 t -135.41 161.08 36.44 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.465 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -75.17 -29.06 60.32 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.799 -0.563 . . . . 0.0 110.042 -177.615 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -152.76 167.35 29.3 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.73 160.76 27.09 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.84 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -55.24 149.77 43.64 Favored 'Trans proline' 0 C--N 1.35 0.626 0 N-CA-C 115.609 1.35 . . . . 0.0 115.609 -179.339 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -76.27 -15.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -176.706 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -119.2 98.44 6.16 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 116.118 1.896 . . . . 0.0 116.118 -175.087 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 45.42 29.1 0.55 Allowed 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 118.549 2.796 . . . . 0.0 118.549 170.967 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -61.73 -22.25 65.22 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 121.089 -1.007 . . . . 0.0 111.283 178.776 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.69 -31.42 72.31 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 121.839 -0.538 . . . . 0.0 111.01 -178.026 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.47 -35.56 76.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.8 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.58 -40.06 83.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -176.627 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.68 -15.85 63.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.56 0.56 50.24 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 122.054 -0.404 . . . . 0.0 110.912 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -123.8 116.01 22.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.791 0.805 . . . . 0.0 111.466 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.1 m -68.19 128.3 36.06 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 176.19 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -82.74 107.81 15.65 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -178.32 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -117.11 137.63 52.17 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.894 0.854 . . . . 0.0 111.926 -176.312 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -137.21 75.29 1.52 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 177.467 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.42 -111.09 3.9 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 119.491 -1.338 . . . . 0.0 112.221 178.767 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.5 p -73.43 8.9 1.53 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.547 1.139 . . . . 0.0 113.39 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.421 HG13 HG11 ' A' ' 68' ' ' VAL . 67.6 t -127.82 143.79 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 C-N-CA 122.793 0.437 . . . . 0.0 111.307 -177.687 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.8 p -143.62 131.32 21.33 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 171.56 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.0 t -136.77 138.9 45.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 122.178 -0.326 . . . . 0.0 110.284 -179.033 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.25 122.62 53.45 Favored Pre-proline 0 CA--C 1.535 0.381 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.672 175.557 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -83.31 65.28 7.73 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 121.829 1.686 . . . . 0.0 113.708 178.151 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -79.26 153.69 29.72 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.862 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 tt -149.37 143.23 18.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.5 t -116.41 112.31 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 173.222 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.413 ' HE ' ' CG ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -94.52 136.18 35.12 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.353 0.597 . . . . 0.0 109.7 178.995 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.94 -37.82 93.22 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -176.699 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.5 t -57.04 -17.77 11.44 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.298 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -146.48 31.97 0.98 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tt -46.71 -40.09 12.73 Favored 'General case' 0 C--O 1.209 -1.073 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -173.496 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -59.24 -50.23 74.81 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.985 -176.756 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -73.76 -39.45 64.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.1 0.953 . . . . 0.0 111.817 179.168 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.413 ' CG ' ' HE ' ' A' ' 117' ' ' ARG . 1.8 t0 -67.11 -35.23 79.3 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.73 0.776 . . . . 0.0 112.136 -176.454 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.23 -43.34 74.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.105 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -69.92 -16.96 63.3 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.92 -175.954 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.25 -25.73 61.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.905 0.383 . . . . 0.0 110.294 177.356 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.06 -41.5 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.203 0.525 . . . . 0.0 110.545 179.735 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -127.05 75.91 76.37 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 123.113 0.565 . . . . 0.0 111.434 -178.635 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.91 -17.49 41.49 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.759 1.023 . . . . 0.0 114.759 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.1 m -85.61 0.99 51.02 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -179.911 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -72.48 134.72 45.46 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.646 0.736 . . . . 0.0 112.877 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 . . . . . 0 CA--C 1.513 -0.442 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.902 177.674 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.238 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.34 -38.22 90.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -42.8 95.07 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.656 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 80.9 mtp -64.2 -28.94 70.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 178.397 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.39 69.38 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.59 -0.694 . . . . 0.0 110.373 178.125 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -68.85 -46.43 68.55 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.06 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.81 -40.95 97.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.764 0.792 . . . . 0.0 109.579 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 58.9 ttt85 -59.14 -45.49 90.81 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.387 176.77 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.21 -41.44 85.79 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.583 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.65 -39.13 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.332 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.1 m -69.58 -38.44 77.37 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.445 176.983 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.69 -49.07 74.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.863 -178.355 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.1 p -62.43 -38.91 82.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 118.343 0.52 . . . . 0.0 110.809 -177.371 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? . . . . . 0 C--N 1.326 -0.419 0 C-N-CA 119.857 -0.737 . . . . 0.0 110.028 179.772 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 72.4 mt . . . . . 0 N--CA 1.47 0.549 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.72 -40.39 92.12 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 114.508 -1.224 . . . . 0.0 110.328 177.247 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -67.84 -38.42 83.17 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.071 0.548 . . . . 0.0 109.988 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -60.27 -46.63 89.14 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.83 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.7 m -68.01 -40.71 82.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.511 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -55.55 -52.14 64.72 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.497 0.719 . . . . 0.0 111.907 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.33 -28.35 67.07 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.661 -0.649 . . . . 0.0 111.571 -178.928 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp -69.71 -38.2 76.84 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.906 -0.496 . . . . 0.0 109.684 176.333 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.662 HD11 HD11 ' A' ' 125' ' ' LEU . 12.4 mm -62.48 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 177.357 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.85 -41.91 75.04 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.132 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.32 96.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 178.518 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -62.84 -45.69 91.41 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.259 -178.874 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.84 -46.92 76.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.277 -176.644 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.4 t -57.38 -43.43 82.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.511 0.672 . . . . 0.0 109.537 178.798 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -78.88 3.75 16.05 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -178.04 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 60.6 m -107.58 11.21 28.85 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.645 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.24 7.06 62.49 Favored Glycine 0 CA--C 1.516 0.148 0 N-CA-C 115.528 0.971 . . . . 0.0 115.528 177.499 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -69.91 129.65 40.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.382 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.77 133.31 15.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 109.139 -1.585 . . . . 0.0 109.139 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -84.44 115.66 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 117.83 0.815 . . . . 0.0 108.999 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 73.9 mt -90.19 -44.54 14.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 178.237 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -149.86 132.43 15.78 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.514 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 172.395 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 . . . . . 0 C--O 1.215 -0.724 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -151.05 124.91 9.15 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 175.181 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -124.65 120.61 59.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 169.131 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -107.28 121.79 45.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -178.615 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -120.47 128.94 53.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.1 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -84.67 126.13 33.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.24 178.443 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.56 135.32 95.71 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -178.839 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.82 -24.85 20.82 Favored 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 115.903 -2.265 . . . . 0.0 112.641 178.08 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -74.94 -29.6 60.99 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.073 0.549 . . . . 0.0 112.124 179.422 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.0 mttm 57.04 39.69 29.09 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.188 0.994 . . . . 0.0 112.641 178.701 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.24 -177.61 0.3 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 113.892 -1.504 . . . . 0.0 110.474 176.322 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -51.87 -34.02 39.11 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 175.306 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -90.63 112.12 23.72 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 103.495 -2.78 . . . . 0.0 103.495 170.069 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -105.49 -35.14 7.57 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.12 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -127.43 154.99 44.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 122.046 -0.409 . . . . 0.0 111.81 -175.939 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.7 p -131.79 137.57 54.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 175.406 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.48 114.19 22.48 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 175.404 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tp -79.37 132.71 36.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -136.46 150.52 48.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -174.745 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -125.76 110.5 13.8 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -151.74 150.32 30.06 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 178.825 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -114.09 134.79 54.64 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 177.601 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.25 134.35 55.18 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -175.312 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -84.21 -36.58 22.67 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.678 0.752 . . . . 0.0 110.912 176.23 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -135.61 164.63 27.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.476 -176.619 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.413 ' HD2' HD11 ' A' ' 99' ' ' ILE . 19.4 ptt-85 -64.38 -22.75 67.06 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.787 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -67.72 -33.15 74.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.007 -177.237 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -65.75 -41.32 92.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 175.794 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.9 ttm -62.22 -51.88 66.01 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.828 -179.407 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.9 m -60.87 -31.85 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.813 0.733 . . . . 0.0 111.099 -178.133 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -68.6 -38.71 80.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.283 -178.02 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -65.77 -35.71 81.48 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.276 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.4 mm -67.27 -34.67 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.864 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.25 -29.09 67.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.481 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -69.75 -42.82 73.37 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.164 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -57.73 -39.7 77.91 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.411 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -37.12 79.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.591 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.49 -44.96 89.33 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.891 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -60.96 -43.09 99.24 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.404 179.09 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.65 -31.25 51.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 122.038 -0.414 . . . . 0.0 110.399 -179.05 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.76 -33.55 75.39 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 121.513 -0.742 . . . . 0.0 109.476 175.825 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -72.4 -46.89 53.18 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 174.096 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.96 -47.29 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.912 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.91 -30.25 67.67 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.815 -0.553 . . . . 0.0 110.804 -179.237 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -73.58 -39.99 64.24 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.111 -0.368 . . . . 0.0 110.636 176.678 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.41 -48.6 72.26 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.977 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.13 5.7 49.78 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.351 0.596 . . . . 0.0 112.124 -178.764 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.55 -3.08 6.58 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 119.297 2.479 . . . . 0.0 119.297 173.331 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.4 mtp180 -64.24 132.87 51.56 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.144 1.472 . . . . 0.0 108.767 -178.807 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -64.71 -24.34 67.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.977 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -147.0 148.89 32.16 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.094 -2.928 . . . . 0.0 103.094 178.841 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 8.9 mmm -136.77 148.48 47.25 Favored 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.47 0.481 . . . . 0.0 111.155 -176.968 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 110' ' ' SER . 85.7 tttt -126.61 133.94 50.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 171.865 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -126.84 133.76 50.67 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.525 0.73 . . . . 0.0 109.039 -176.075 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.9 tp -94.66 126.26 39.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.893 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -116.5 108.7 16.33 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.1 t -105.83 114.87 46.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.237 -176.71 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -83.3 156.08 23.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 176.62 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -128.18 111.48 13.48 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 172.145 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.9 m -130.11 158.72 38.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.576 0.547 . . . . 0.0 111.453 -173.543 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.9 m -67.06 -47.3 71.7 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.71 0.767 . . . . 0.0 109.051 -179.834 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -148.48 174.39 12.13 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.012 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.55 145.32 29.73 Favored Pre-proline 0 C--N 1.313 -0.992 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.798 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 146.25 97.48 Favored 'Trans proline' 0 C--N 1.346 0.43 0 O-C-N 122.246 0.603 . . . . 0.0 112.759 176.714 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.9 m -81.8 -21.61 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -86.68 83.3 7.62 Favored 'General case' 0 C--O 1.216 -0.667 0 O-C-N 121.986 -0.446 . . . . 0.0 110.906 -177.618 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 t0 14.81 78.9 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 116.996 2.221 . . . . 0.0 116.996 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -90.08 -13.63 35.45 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.326 -1.306 . . . . 0.0 109.995 177.752 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -65.49 -31.3 72.3 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 107.535 -1.284 . . . . 0.0 107.535 -179.133 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 tp10 -59.24 -34.76 72.6 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 173.835 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.413 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.0 mm -71.2 -40.09 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.91 -22.2 65.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 111.256 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -87.97 0.47 55.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -125.99 130.27 50.87 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.953 0.882 . . . . 0.0 113.064 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.0 m -74.37 128.88 36.66 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 173.766 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -82.91 124.29 30.21 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.38 129.09 45.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.624 0.726 . . . . 0.0 109.537 178.959 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -143.1 122.74 13.29 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.5 179.868 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.09 -112.7 5.21 Favored Glycine 0 C--O 1.225 -0.418 0 N-CA-C 108.8 -1.72 . . . . 0.0 108.8 -178.813 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 9.7 t -122.87 22.67 9.62 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-O 121.722 0.772 . . . . 0.0 109.641 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.24 156.72 5.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.521 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 31.5 t -138.51 127.96 24.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 103.657 -2.72 . . . . 0.0 103.657 178.114 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.98 136.5 58.72 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-O 122.296 1.046 . . . . 0.0 109.223 179.12 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -112.3 114.96 50.32 Favored Pre-proline 0 N--CA 1.429 -1.5 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.939 -177.677 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -79.56 151.69 22.56 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 116.701 -1.733 . . . . 0.0 112.204 178.269 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 149.74 29.85 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 102.639 -3.097 . . . . 0.0 102.639 174.018 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 tt -149.43 122.29 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 118.431 0.559 . . . . 0.0 109.63 -176.732 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.7 t -95.32 110.36 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 177.704 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.63 136.23 37.44 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 178.778 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.43 -25.46 57.91 Favored Glycine 0 C--O 1.229 -0.211 0 CA-C-N 116.359 -0.382 . . . . 0.0 113.99 -177.396 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -58.0 -30.4 66.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.829 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -139.19 25.14 2.49 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.315 0.579 . . . . 0.0 110.292 -177.837 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.5 tt -44.41 -37.63 3.53 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -174.541 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -56.93 -49.36 75.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.845 0.748 . . . . 0.0 111.772 -178.976 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -78.66 -39.24 37.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 122.362 1.077 . . . . 0.0 111.141 178.735 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -63.35 -38.14 90.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.776 -175.268 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.662 HD11 HD11 ' A' ' 11' ' ' ILE . 1.9 tm? -66.59 -48.36 69.81 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.006 -0.434 . . . . 0.0 110.18 -178.628 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -69.35 -17.04 63.66 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.961 -176.899 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.87 62.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.695 -0.23 . . . . 0.0 110.929 178.723 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 p -109.06 -37.32 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 120.794 0.33 . . . . 0.0 111.137 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.38 80.5 72.04 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 121.954 -0.466 . . . . 0.0 111.247 178.963 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -71.29 0.29 6.98 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 114.294 0.844 . . . . 0.0 114.294 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 42.8 p -82.4 -2.63 53.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.166 0.508 . . . . 0.0 110.942 177.622 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -70.5 120.57 16.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.442 0.639 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.9 ttt85 . . . . . 0 C--N 1.323 -0.55 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.352 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 C--O 1.224 -0.288 0 CA-C-O 120.372 0.13 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.47 -43.74 71.96 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.12 -31.33 65.92 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.698 -179.395 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 76.6 mtp -70.51 -28.93 65.34 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.733 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.01 72.05 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.872 -0.517 . . . . 0.0 110.241 177.556 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -67.07 -44.67 79.52 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -65.06 -40.24 94.41 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.763 0.792 . . . . 0.0 109.57 -178.98 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -58.85 -44.62 91.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.195 177.295 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -68.35 -43.33 77.7 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 178.994 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.3 mt -63.28 -34.88 78.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.865 0.364 . . . . 0.0 110.042 -179.367 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 26.2 m -72.72 -38.57 67.43 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.516 0.674 . . . . 0.0 110.166 175.526 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.6 tt -64.75 -39.11 93.07 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.121 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.88 -42.93 90.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 119.056 0.843 . . . . 0.0 111.561 -177.607 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 C--O 1.217 -0.62 0 O-C-N 121.372 -0.83 . . . . 0.0 108.861 178.323 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 C--O 1.218 -0.572 0 CA-C-O 120.888 0.375 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 78.0 mt -53.74 -35.23 60.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 179.091 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.466 ' HB2' ' HB1' ' A' ' 147' ' ' ALA . 40.0 mt-10 -61.34 -28.89 69.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.662 0.268 . . . . 0.0 110.734 -178.215 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -60.31 -55.1 37.81 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -41.34 68.69 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.921 -179.484 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -56.23 -55.76 29.24 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -177.833 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -69.83 -30.85 68.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -176.747 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -75.43 -25.76 57.76 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.183 -1.007 . . . . 0.0 112.038 178.158 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mm -73.13 -39.13 56.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 174.686 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.64 85.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.043 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.68 80.68 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.472 177.45 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -57.09 -43.88 82.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.582 -179.407 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -65.2 -44.71 87.52 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 0.0 110.133 179.177 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.91 -40.06 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.711 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -66.06 -29.17 69.46 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.636 -0.665 . . . . 0.0 110.346 179.492 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t -76.07 3.71 9.91 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.637 0.375 . . . . 0.0 111.574 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.28 -0.15 59.96 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 115.138 0.815 . . . . 0.0 115.138 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -67.22 125.77 27.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.044 0.922 . . . . 0.0 109.131 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.53 124.46 8.11 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.519 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -75.8 124.52 34.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.098 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.8 mt -90.06 -41.52 13.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -177.447 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -147.82 123.34 10.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.542 -177.475 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 174.198 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 C--O 1.225 -0.214 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.12 138.36 31.58 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 117.937 0.335 . . . . 0.0 110.567 178.687 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -140.12 132.7 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 176.624 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -109.03 135.33 50.37 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 178.602 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -129.43 137.21 50.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 124.067 0.947 . . . . 0.0 109.19 -176.655 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -101.24 137.3 39.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 176.911 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.05 106.42 7.91 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.836 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.45 -28.57 26.57 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 117.049 -1.501 . . . . 0.0 114.646 -176.362 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -78.01 -1.81 34.02 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.579 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.7 mtmt 58.28 43.31 20.38 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.1 m -64.56 -177.63 0.33 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.328 -1.76 . . . . 0.0 113.098 -178.651 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -41.43 -26.98 0.07 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 178.178 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -130.17 135.69 48.45 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.827 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -70.41 -37.7 74.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.412 0.625 . . . . 0.0 110.858 -178.64 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.9 mt -137.68 157.37 46.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.003 -177.607 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.44 137.18 53.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 176.682 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.03 135.95 49.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 173.118 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -102.1 132.88 47.71 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 179.338 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.35 115.78 12.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -179.187 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -86.8 96.37 10.17 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.881 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -147.34 128.79 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.663 0.744 . . . . 0.0 111.67 -176.606 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.13 147.25 36.68 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 125.081 1.352 . . . . 0.0 108.769 175.263 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.6 mt -143.8 118.2 9.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -177.282 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -87.43 -43.73 11.86 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 122.077 0.942 . . . . 0.0 111.467 -179.58 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -127.34 148.76 50.25 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.04 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.574 ' HD2' HD11 ' A' ' 99' ' ' ILE . 38.2 ptt180 -65.05 -16.0 62.97 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.307 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -63.05 -33.55 75.67 Favored 'General case' 0 C--O 1.216 -0.68 0 C-N-CA 119.702 -0.799 . . . . 0.0 109.675 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -77.57 -31.86 53.41 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 121.602 -0.687 . . . . 0.0 109.883 176.335 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.8 ttt -62.44 -51.84 65.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.372 178.008 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.8 m -61.07 -36.3 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-O 120.718 0.294 . . . . 0.0 111.59 179.849 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.5 -38.44 89.89 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.169 -177.147 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -59.47 -45.18 92.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.212 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.443 HG23 HG11 ' A' ' 111' ' ' VAL . 2.6 mp -73.16 -34.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.753 -0.592 . . . . 0.0 111.534 -178.318 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -59.23 -35.8 74.3 Favored 'General case' 0 C--O 1.244 0.803 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -45.64 29.99 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.657 178.825 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -55.2 -41.51 72.07 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.285 179.346 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.5 73.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 122.201 -0.312 . . . . 0.0 111.705 -178.342 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -73.16 -36.09 66.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.742 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -44.76 95.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 175.852 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.61 -36.04 72.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -60.42 -40.18 90.08 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.321 -0.862 . . . . 0.0 109.68 176.994 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -67.64 -33.64 75.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.486 178.4 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.2 t -73.87 -47.97 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 122.299 -0.251 . . . . 0.0 111.431 177.678 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -62.22 -30.36 71.03 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.618 -0.677 . . . . 0.0 111.781 -177.912 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -59.46 -45.62 91.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.632 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -73.3 -42.39 62.46 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 179.563 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.3 mp -78.35 -18.08 55.63 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 -175.256 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.34 9.25 60.68 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 116.751 1.46 . . . . 0.0 116.751 177.176 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -69.99 141.68 52.92 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.202 1.001 . . . . 0.0 109.03 -178.877 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.19 -34.73 77.0 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -174.874 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -144.37 161.86 37.92 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 101.837 -3.394 . . . . 0.0 101.837 176.545 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.3 mmm -135.69 112.54 10.22 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 123.552 0.533 . . . . 0.0 109.799 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -93.72 132.25 38.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.855 177.484 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -128.06 121.83 30.63 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.6 tp -89.52 121.61 31.9 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.469 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -112.04 113.29 25.49 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.0 t -112.76 106.27 20.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-O 121.253 0.549 . . . . 0.0 111.301 -178.724 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -74.6 152.06 39.3 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.597 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -128.48 109.01 11.01 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.436 -1.69 . . . . 0.0 106.436 172.623 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 89.2 p -131.88 164.96 24.94 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.196 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 t -77.48 -29.01 52.42 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.674 -0.641 . . . . 0.0 109.55 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -152.59 165.52 34.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 179.714 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.95 154.61 40.74 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.534 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -57.03 145.31 86.44 Favored 'Trans proline' 0 C--N 1.351 0.66 0 N-CA-C 114.829 1.05 . . . . 0.0 114.829 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.3 m -77.62 -21.37 13.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.223 0.535 . . . . 0.0 111.331 -179.693 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -90.85 99.12 12.21 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.972 179.571 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 14.72 58.8 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 176.804 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -68.34 -18.72 64.56 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.446 0.641 . . . . 0.0 110.486 179.044 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.74 -36.36 82.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.884 -177.467 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -37.67 74.11 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.614 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.574 HD11 ' HD2' ' A' ' 54' ' ' ARG . 5.3 mm -66.55 -39.99 85.27 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.604 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.267 -178.205 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.15 -23.92 65.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.514 0.674 . . . . 0.0 110.987 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.6 mtmt -94.9 6.16 49.83 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.773 179.295 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -118.94 95.94 5.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -176.833 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -68.34 124.97 24.97 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.515 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -85.72 107.44 17.59 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.944 0.878 . . . . 0.0 109.83 -178.501 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -99.53 123.53 43.88 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.824 -1.08 . . . . 0.0 108.662 -178.578 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -130.17 75.4 1.65 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -178.775 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.38 -112.68 3.7 Favored Glycine 0 C--O 1.223 -0.574 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -178.334 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.7 p -83.04 -20.82 34.27 Favored 'General case' 0 C--N 1.322 -0.59 0 O-C-N 122.217 -0.578 . . . . 0.0 110.367 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 53.1 t -74.92 140.62 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.9 m -130.79 112.85 13.42 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 171.081 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.443 HG11 HG23 ' A' ' 61' ' ' ILE . 54.1 t -106.29 129.65 59.26 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.504 0 O-C-N 121.527 -0.733 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.64 104.0 22.01 Favored Pre-proline 0 N--CA 1.435 -1.22 0 CA-C-N 113.995 -1.457 . . . . 0.0 108.039 178.458 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -78.24 142.91 19.48 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 116.721 -1.719 . . . . 0.0 112.13 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 153.28 38.42 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 178.05 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.6 tt -146.86 123.57 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.143 0.497 . . . . 0.0 109.766 -177.334 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 1.9 t -89.87 126.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 104.098 -2.556 . . . . 0.0 104.098 174.592 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.61 136.27 54.45 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 175.907 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -22.44 66.38 Favored Glycine 0 C--O 1.227 -0.298 0 C-N-CA 121.178 -0.534 . . . . 0.0 113.899 -176.445 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.7 p -57.35 -26.74 61.44 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -177.253 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.5 ptm -141.16 30.58 1.78 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.546 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -44.37 -42.45 6.88 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 116.417 2.006 . . . . 0.0 116.417 -171.612 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -58.56 -51.33 70.34 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.685 -0.634 . . . . 0.0 112.395 -178.366 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -75.22 -33.06 61.33 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.582 0.706 . . . . 0.0 111.334 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -72.08 -42.02 66.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.998 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 20.8 tp -64.27 -41.81 96.75 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 121.717 -0.615 . . . . 0.0 111.272 -176.734 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.63 -13.31 60.33 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.648 -178.804 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.317 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.0 t -91.64 -40.35 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 121.33 0.586 . . . . 0.0 110.234 179.096 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -123.02 77.21 50.86 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.602 -179.398 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.25 -13.86 38.94 Favored 'Trans proline' 0 C--N 1.348 0.543 0 N-CA-C 114.127 0.78 . . . . 0.0 114.127 -177.841 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.5 m -77.83 -7.22 56.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.719 0.295 . . . . 0.0 111.57 177.308 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -99.4 132.98 44.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.236 0.541 . . . . 0.0 110.674 -178.736 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 . . . . . 0 C--N 1.327 -0.412 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.824 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 . . . . . 0 N--CA 1.465 0.293 0 CA-C-O 121.524 0.678 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.466 ' HB1' ' HB2' ' A' ' 5' ' ' GLU . . . -63.29 -44.93 93.64 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 179.192 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.76 -31.33 56.99 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.465 -179.42 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.3 mmt -65.3 -28.78 69.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.142 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.89 70.26 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.53 -0.271 . . . . 0.0 111.298 178.401 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -65.52 -51.28 61.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.48 177.694 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.11 -42.12 97.93 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.163 0.982 . . . . 0.0 108.6 -178.211 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -58.9 -40.15 83.64 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.995 178.839 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -64.91 -43.19 93.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.317 0.508 . . . . 0.0 112.063 177.152 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.7 -41.31 98.13 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.346 -179.496 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.6 t -65.86 -38.82 89.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 0.0 110.466 177.423 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.31 -45.92 92.45 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 123.103 0.561 . . . . 0.0 110.908 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 56.0 t -56.79 -50.12 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.782 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.324 -0.512 0 CA-C-O 120.965 0.412 . . . . 0.0 110.497 -178.662 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 C--O 1.224 -0.264 0 CA-C-O 121.577 0.703 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.78 -35.2 64.93 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.306 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -65.78 -29.33 69.81 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.364 0.602 . . . . 0.0 110.272 -176.924 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -62.23 -45.16 94.6 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.196 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 m -70.54 -40.31 73.5 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.302 178.867 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -55.35 -51.15 67.72 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.018 0.927 . . . . 0.0 111.082 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.664 -0.647 . . . . 0.0 111.769 178.659 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 55.6 mttt -66.71 -37.56 84.95 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.855 -0.528 . . . . 0.0 110.955 176.665 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 mm -71.19 -39.35 73.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.009 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.32 -44.58 80.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.51 -47.24 79.61 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.56 178.018 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 34.8 t60 -55.46 -45.56 76.89 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.683 0.393 . . . . 0.0 111.415 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.7 mt -70.44 -47.89 58.57 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.588 -178.839 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.85 -40.29 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-N 118.422 0.556 . . . . 0.0 109.983 175.639 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -64.17 -27.22 68.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.147 -0.346 . . . . 0.0 111.511 179.151 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 m -86.62 10.25 16.14 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 177.971 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.85 0.28 58.98 Favored Glycine 0 C--O 1.229 -0.159 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 175.602 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.408 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 26.0 m-85 -67.81 129.25 39.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.311 1.056 . . . . 0.0 109.748 178.611 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.17 109.41 2.98 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 179.318 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.8 p -70.32 129.15 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.192 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 85.9 mt -94.89 -47.11 13.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.773 -1.103 . . . . 0.0 108.358 -177.321 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -142.36 139.95 31.92 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 -177.226 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 118.111 0.414 . . . . 0.0 110.262 -179.214 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--O 1.234 0.288 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 45' ' ' ARG . 47.8 mt-10 -112.92 144.69 42.04 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.674 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 90.8 mt -135.36 127.78 47.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 172.71 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -110.84 133.11 53.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.068 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 mp -131.72 129.69 41.01 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.213 0.605 . . . . 0.0 109.788 -178.383 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -81.43 132.76 35.34 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.491 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.85 117.77 60.82 Favored Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 177.662 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 79.2 Cg_endo -72.6 -26.12 16.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 115.892 -2.272 . . . . 0.0 112.807 -175.899 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -72.49 -26.5 61.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.701 -179.859 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.8 mttp 59.24 41.95 19.26 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.646 1.688 . . . . 0.0 108.113 -178.83 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 96.4 p -71.09 -177.61 1.73 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 111.042 -2.799 . . . . 0.0 108.39 176.85 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.2 p -45.85 -26.63 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 176.268 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -101.51 127.19 48.31 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 174.367 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -89.8 -37.7 14.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -178.523 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.9 mt -137.36 161.61 35.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.7 t -127.29 134.53 65.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.915 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.402 HH21 ' CD ' ' A' ' 30' ' ' GLU . 31.6 ttt180 -122.46 112.99 18.72 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.176 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.79 131.12 35.2 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 175.069 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -136.36 114.67 11.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.217 0.532 . . . . 0.0 111.416 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -82.56 94.71 7.56 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 178.541 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -151.62 136.59 17.31 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.26 146.11 24.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.234 -178.729 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.26 119.35 26.14 Favored 'General case' 0 C--O 1.22 -0.45 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 -177.236 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -79.12 -43.5 23.92 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 122.661 1.219 . . . . 0.0 109.845 178.316 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -127.83 164.67 21.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.87 -178.592 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -64.21 -15.82 60.75 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.579 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -62.4 -41.37 98.62 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.6 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -66.59 -39.37 88.39 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.7 ttm -63.11 -51.85 64.93 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.396 -178.878 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.87 -31.85 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.641 0.655 . . . . 0.0 112.585 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -68.51 -35.03 76.92 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.667 -178.138 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.72 -41.73 91.5 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.297 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -67.12 -30.88 50.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.077 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -58.45 -40.06 81.58 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.097 179.529 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -76.63 -43.91 36.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.423 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.45 -36.52 69.13 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.934 -178.536 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.478 ' HA ' HG11 ' A' ' 109' ' ' VAL . . . -64.17 -40.43 96.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 O-C-N 121.938 -0.476 . . . . 0.0 111.102 179.463 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -76.02 -29.68 58.21 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.313 -0.867 . . . . 0.0 109.638 178.385 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -60.7 -41.48 95.26 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 173.62 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.456 HG11 HG13 ' A' ' 109' ' ' VAL . 45.9 t -64.83 -39.67 86.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.05 177.275 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -54.56 -37.95 66.06 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.779 0.718 . . . . 0.0 111.69 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -61.68 -48.08 82.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.996 179.579 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.3 t -70.63 -41.41 77.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.564 0.697 . . . . 0.0 110.943 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -41.67 93.54 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.971 -0.456 . . . . 0.0 109.942 179.719 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -64.59 -45.82 85.33 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.106 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -58.64 -42.28 87.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.433 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.75 -3.69 58.02 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -179.489 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.68 20.1 67.83 Favored Glycine 0 C--O 1.242 0.615 0 C-N-CA 121.508 -0.377 . . . . 0.0 113.654 179.656 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -73.04 147.84 44.69 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.825 -0.809 . . . . 0.0 110.944 -176.709 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -69.45 -37.52 77.37 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.47 159.62 39.94 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 171.569 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.9 ttp -134.15 147.19 50.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.745 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 110' ' ' SER . 83.6 tttt -116.0 136.67 52.81 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 179.482 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.4 tp -119.81 134.0 55.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 123.056 0.543 . . . . 0.0 110.699 178.448 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.78 109.85 22.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.066 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -97.71 127.34 43.59 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.053 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.9 t -122.08 109.31 24.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.177 0.513 . . . . 0.0 110.937 179.055 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -81.24 151.83 27.94 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 176.489 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -127.29 107.63 10.16 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 103.61 -2.737 . . . . 0.0 103.61 171.658 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.3 m -127.17 158.65 36.53 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.683 0.614 . . . . 0.0 110.896 -174.039 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.5 m -67.06 -45.21 78.07 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -177.434 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -146.81 176.74 9.65 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.711 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.19 143.39 29.6 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.395 -0.821 . . . . 0.0 108.874 -176.119 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.71 147.06 73.81 Favored 'Trans proline' 0 C--N 1.35 0.622 0 N-CA-C 114.93 1.088 . . . . 0.0 114.93 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 26.9 m -81.17 -10.23 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 N-CA-C 114.525 1.305 . . . . 0.0 114.525 -177.092 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -112.67 95.77 5.61 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 119.339 -0.362 . . . . 0.0 111.559 -178.378 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.9 t0 14.83 67.33 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 176.978 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 56.6 p-90 -83.99 -13.99 51.9 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.195 179.424 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -66.65 -31.48 72.19 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.119 -0.988 . . . . 0.0 111.905 -175.21 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -65.31 -21.74 66.75 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.958 175.615 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.502 HG22 ' HG3' ' A' ' 113' ' ' PRO . 15.5 mm -72.7 -40.48 61.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.3 -5.03 33.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.983 179.22 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -111.35 3.14 18.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.797 -179.383 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -126.74 128.42 46.62 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.88 0.847 . . . . 0.0 112.142 179.068 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 26.5 m -78.46 126.79 31.26 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 176.819 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -82.64 111.44 18.61 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 177.016 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -118.17 120.99 39.39 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.461 0.648 . . . . 0.0 109.76 -178.392 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -116.69 75.31 0.96 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 178.38 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.31 -112.7 4.85 Favored Glycine 0 C--O 1.225 -0.466 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.774 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.0 p -81.96 24.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.561 0.744 . . . . 0.0 112.173 -178.662 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.478 HG11 ' HA ' ' A' ' 65' ' ' ALA . 86.2 t -134.83 140.63 45.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.264 -178.957 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.404 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 33.8 t -130.62 126.49 36.78 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 175.67 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.9 t -136.7 136.42 48.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 176.802 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -125.56 131.33 24.01 Favored Pre-proline 0 C--N 1.317 -0.841 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 175.865 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.502 ' HG3' HG22 ' A' ' 99' ' ' ILE . 47.9 Cg_endo -84.56 154.73 12.05 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 CA-C-O 122.101 0.792 . . . . 0.0 113.774 -177.61 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.78 150.73 39.0 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 174.438 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.7 tt -146.42 124.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -176.774 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 52.1 t -97.44 115.95 38.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 175.057 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.35 138.17 39.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.061 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.86 -25.88 53.48 Favored Glycine 0 C--O 1.223 -0.591 0 N-CA-C 114.728 0.651 . . . . 0.0 114.728 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.7 p -59.66 -27.2 66.17 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.545 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.8 ptm -143.07 18.42 1.94 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.925 0.869 . . . . 0.0 109.906 -177.831 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tt -42.08 -42.41 2.91 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 118.418 2.747 . . . . 0.0 118.418 -170.613 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -60.79 -51.54 68.91 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 119.562 -0.855 . . . . 0.0 112.278 -174.078 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -78.54 -33.27 48.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 176.301 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -58.86 -32.15 69.18 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.432 1.111 . . . . 0.0 110.818 -178.829 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.63 -36.35 73.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.953 -1.021 . . . . 0.0 113.178 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -75.33 -15.0 60.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -176.269 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.55 -28.56 62.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.163 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 22.7 t -95.56 -41.63 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.858 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -126.22 80.19 68.89 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.33 -178.908 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -67.55 -14.53 42.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 118.08 -0.813 . . . . 0.0 112.774 179.752 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.2 m -75.72 -5.71 46.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.923 176.461 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -99.48 135.5 40.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.706 0.765 . . . . 0.0 110.575 -179.022 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.344 179.963 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 . . . . . 0 N--CA 1.454 -0.252 0 CA-C-O 120.566 0.222 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.49 90.69 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.404 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -62.73 -51.08 68.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 21.5 ptp -65.33 -28.84 69.59 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.353 179.419 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.05 -37.37 85.68 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.456 -0.778 . . . . 0.0 110.034 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 44.5 ttt180 -65.64 -45.86 81.39 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.595 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -65.01 -40.31 94.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.843 0.83 . . . . 0.0 110.316 -178.821 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -64.71 -40.0 94.62 Favored 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.872 178.491 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.34 -41.22 98.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.83 0.348 . . . . 0.0 111.639 176.568 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.8 mt -65.17 -33.13 75.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.043 0.449 . . . . 0.0 109.823 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.05 -34.81 61.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.624 0.726 . . . . 0.0 110.571 175.086 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -65.06 -44.15 89.92 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.639 -178.624 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.7 p -62.16 -36.78 76.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.014 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.207 -1.165 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.024 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.25 -35.3 80.61 Favored 'General case' 0 C--O 1.208 -1.084 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.277 178.507 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -65.14 -42.21 94.03 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 178.575 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 177.484 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -59.12 -43.69 91.97 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.613 -178.216 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -57.26 -52.31 65.84 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 123.073 0.549 . . . . 0.0 110.363 179.906 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -69.3 -33.32 73.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.979 -179.268 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.69 -31.48 69.55 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.683 -0.636 . . . . 0.0 111.018 178.803 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.8 mm -77.06 -39.2 28.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.18 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.1 80.94 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.746 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.09 -45.85 86.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.915 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.95 -47.45 77.57 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.454 0.302 . . . . 0.0 110.623 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 34.4 mt -67.1 -51.03 59.29 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -178.64 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.2 t -57.33 -42.71 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.979 178.886 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -19.09 65.7 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.351 -0.843 . . . . 0.0 111.814 -179.642 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.4 t -87.53 8.1 26.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.021 0.439 . . . . 0.0 111.046 177.876 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.59 1.24 56.53 Favored Glycine 0 C--O 1.228 -0.266 0 N-CA-C 116.033 1.173 . . . . 0.0 116.033 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.463 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 38.3 m-85 -71.9 110.52 6.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 118.046 0.923 . . . . 0.0 109.018 178.215 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.41 134.48 30.89 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.945 -177.454 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -75.79 125.81 35.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.717 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.437 HD11 HD22 ' A' ' 43' ' ' LEU . 45.3 mt -92.22 -43.83 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.014 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -153.41 127.55 9.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.793 175.661 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 174.352 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 N--CA 1.457 -0.107 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -136.39 146.97 47.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 178.839 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 83.6 mt -134.92 134.23 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.681 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -110.41 135.57 50.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.0 0.429 . . . . 0.0 111.45 -179.229 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 4.1 mp -132.37 143.02 49.55 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.105 0.962 . . . . 0.0 109.226 -177.58 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -102.47 135.56 43.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.76 115.62 39.73 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.976 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 93.9 Cg_endo -73.56 -24.43 16.09 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 117.373 -1.285 . . . . 0.0 112.547 -177.509 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -76.28 -24.45 54.43 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.971 178.78 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.69 42.72 6.09 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -178.378 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 m -59.87 -177.52 0.06 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 112.559 -2.11 . . . . 0.0 115.078 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.4 m -52.98 -28.84 25.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.652 173.603 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.436 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 14.4 p-80 -100.53 140.48 34.74 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 172.101 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -97.42 -43.83 7.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.032 0.444 . . . . 0.0 111.761 -172.818 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.437 HD22 HD11 ' A' ' 23' ' ' ILE . 51.1 mt -130.5 158.1 40.86 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.959 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.8 t -127.6 136.63 59.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 177.777 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.48 134.26 35.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.871 0.843 . . . . 0.0 109.371 173.032 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -97.55 137.06 37.05 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -178.937 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -136.01 108.81 7.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -175.381 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.22 94.78 6.12 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 179.505 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -151.52 118.88 5.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.342 0.592 . . . . 0.0 111.657 -175.555 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -87.16 151.48 23.15 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.47 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.3 mt -141.19 143.53 34.25 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.856 -172.788 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -98.11 -39.46 8.89 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.102 0.477 . . . . 0.0 110.356 176.628 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -133.77 151.09 51.49 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -176.835 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.411 ' H ' ' HB3' ' A' ' 94' ' ' ASP . 9.3 ptt180 -64.48 -21.13 66.57 Favored 'General case' 0 C--O 1.212 -0.908 0 O-C-N 121.528 -0.733 . . . . 0.0 112.535 179.937 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -33.05 72.78 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.914 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -72.49 -45.51 59.12 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.517 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.0 ttt -55.0 -49.03 72.5 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.591 -178.584 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.6 m -65.06 -35.25 75.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.758 178.529 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -71.13 -32.99 69.66 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.214 -177.106 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.4 -38.02 76.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 175.897 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.1 mm -71.58 -30.91 40.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.745 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.89 -40.18 87.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.873 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -74.55 -42.7 58.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 178.816 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.22 -43.71 87.82 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.012 -0.43 . . . . 0.0 110.683 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.7 -40.27 84.32 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.633 -178.529 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -64.17 -49.37 72.33 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.294 -0.563 . . . . 0.0 109.59 177.883 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -40.61 95.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.89 -33.33 43.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.675 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -66.74 -38.23 86.24 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -60.32 -43.83 96.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.092 -176.398 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.23 -35.82 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.626 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -30.31 66.51 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.888 -1.133 . . . . 0.0 113.552 -178.542 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -58.18 -31.75 67.59 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.554 179.494 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -20.47 65.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.705 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.01 9.37 34.47 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.927 0.394 . . . . 0.0 110.195 177.503 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.79 29.19 71.56 Favored Glycine 0 C--O 1.236 0.24 0 N-CA-C 115.754 1.062 . . . . 0.0 115.754 175.81 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 38.2 ttt85 -69.89 128.29 35.87 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 121.728 -0.866 . . . . 0.0 108.678 -178.819 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.73 -36.16 82.95 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.326 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.22 149.17 29.82 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 176.932 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -120.66 147.98 44.53 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.66 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -134.96 117.47 15.83 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.257 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 tp -112.89 128.31 56.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.13 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -94.26 104.1 16.11 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 174.232 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -101.85 128.48 48.2 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.319 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.6 t -123.48 109.38 23.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.316 176.551 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -72.9 141.91 47.88 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 175.247 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -118.27 103.75 10.12 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 174.261 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 83.5 p -123.07 158.74 29.97 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.991 0.424 . . . . 0.0 110.557 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -75.94 -28.87 58.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 121.482 -0.761 . . . . 0.0 108.999 -179.335 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -155.32 166.61 33.01 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 177.247 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.18 150.31 43.0 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 110.507 -0.183 . . . . 0.0 110.507 -176.008 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.87 145.23 85.49 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 118.03 -0.847 . . . . 0.0 112.046 177.614 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 m -76.25 -19.74 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -172.56 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.411 ' HB3' ' H ' ' A' ' 54' ' ' ARG . 43.7 t0 -84.31 87.43 7.2 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-O 119.484 -0.293 . . . . 0.0 111.333 -177.526 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 27.56 48.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 118.041 2.608 . . . . 0.0 118.041 176.221 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 34.1 p-90 -62.06 -20.21 63.74 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.03 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -61.03 -31.23 70.86 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.841 -0.537 . . . . 0.0 110.356 -179.253 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -60.03 -35.19 74.56 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.744 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.7 mm -72.45 -43.52 63.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.94 -176.06 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.33 64.52 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.755 -0.591 . . . . 0.0 112.244 -178.525 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -101.92 17.06 24.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -131.02 104.25 7.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.601 -176.507 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.0 m -68.25 125.9 27.87 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.355 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -82.71 127.79 33.75 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 179.255 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -126.03 133.06 51.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.795 0.807 . . . . 0.0 111.311 179.351 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -142.26 111.47 6.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.441 -1.254 . . . . 0.0 108.08 178.354 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.75 -115.94 8.26 Favored Glycine 0 C--N 1.322 -0.195 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.091 179.102 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 60.7 p -87.46 -12.61 45.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.442 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.6 t -94.1 141.33 15.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -174.163 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.3 m -120.76 138.45 54.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 167.234 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 25.2 t -132.39 134.03 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -96.09 114.48 64.28 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 176.818 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -84.28 59.63 5.97 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 121.987 1.792 . . . . 0.0 114.209 -177.555 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.33 153.01 44.27 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.88 -178.328 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.7 tt -147.46 135.43 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.0 m -112.18 132.72 60.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.2 141.17 50.16 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -176.307 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.1 -26.44 55.82 Favored Glycine 0 C--O 1.227 -0.283 0 N-CA-C 114.808 0.683 . . . . 0.0 114.808 -176.559 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.0 p -55.3 -29.6 58.54 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -179.345 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.7 ptm -141.63 26.49 1.93 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.348 0.594 . . . . 0.0 110.298 -178.025 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 12.1 tp -45.35 -37.75 5.2 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 119.328 3.084 . . . . 0.0 119.328 -169.301 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -65.98 -43.37 88.01 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.301 0.955 . . . . 0.0 110.778 -179.235 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -73.7 -36.0 65.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 122.218 1.009 . . . . 0.0 109.495 178.562 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -62.81 -42.72 99.84 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 11.2 mt -62.13 -43.93 97.76 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -75.07 -15.24 60.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.355 -177.311 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.61 -40.85 48.13 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.232 -0.292 . . . . 0.0 110.716 178.123 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 128' ' ' VAL . . . . . 0.422 HG13 ' CD2' ' A' ' 129' ' ' PHE . 12.2 p -92.25 -32.91 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 120.995 0.426 . . . . 0.0 111.252 179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 129' ' ' PHE . . . . . 0.422 ' CD2' HG13 ' A' ' 128' ' ' VAL . 38.5 m-85 -127.24 80.67 71.29 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.396 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -65.5 -11.84 32.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 N-CA-C 114.694 0.998 . . . . 0.0 114.694 -177.704 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.9 m -77.97 -2.85 38.97 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.123 -0.361 . . . . 0.0 111.666 176.332 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -77.0 127.43 32.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.596 0.712 . . . . 0.0 111.85 -179.1 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 59.9 mtt180 . . . . . 0 C--N 1.322 -0.6 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.701 178.795 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 31.5 m120 . . . . . 0 C--O 1.22 -0.471 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -32.49 57.53 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.96 -0.463 . . . . 0.0 111.759 178.43 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -62.99 -41.05 99.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.635 0.731 . . . . 0.0 109.41 177.959 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtp -70.84 -29.01 65.03 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.567 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.36 -40.42 95.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.164 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.2 ttt180 -63.43 -46.63 85.45 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.94 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -59.43 -42.7 92.47 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.301 0.572 . . . . 0.0 110.317 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -58.73 -44.68 90.52 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.951 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -65.9 -46.2 79.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 179.171 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.7 -41.51 86.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.219 0.533 . . . . 0.0 109.667 -178.156 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.7 m -69.76 -35.73 75.18 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.418 178.585 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.7 tt -65.47 -39.44 91.97 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -177.126 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 88.7 t -53.68 -54.01 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.586 0.63 . . . . 0.0 112.696 -174.715 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.326 -0.445 0 CA-C-O 121.342 0.592 . . . . 0.0 109.833 -179.555 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.8 tt . . . . . 0 C--O 1.218 -0.573 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.79 -35.3 80.31 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.315 179.255 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.14 -32.15 70.75 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.149 0.5 . . . . 0.0 109.793 -179.817 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.78 -54.47 38.54 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.6 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.8 m -64.17 -38.13 89.96 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.196 0.522 . . . . 0.0 111.381 -179.646 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -56.23 -52.98 62.47 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.46 0.704 . . . . 0.0 110.538 178.234 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -70.72 -28.09 64.46 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.211 -0.931 . . . . 0.0 111.744 179.094 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -65.26 -43.43 91.33 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 176.557 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.403 HD11 HD11 ' A' ' 125' ' ' LEU . 18.0 mm -69.28 -38.55 77.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.835 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 -45.18 80.08 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.15 -42.5 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.954 0.407 . . . . 0.0 111.382 178.98 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -60.15 -46.81 88.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.399 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 mt -65.1 -53.52 44.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.86 0.362 . . . . 0.0 111.132 -179.911 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.6 t -59.41 -43.57 90.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.465 -175.226 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -14.2 62.71 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.513 -0.742 . . . . 0.0 112.592 -179.385 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.9 m -89.71 1.49 56.0 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 177.914 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.05 -3.0 27.04 Favored Glycine 0 C--O 1.224 -0.48 0 N-CA-C 115.588 0.995 . . . . 0.0 115.588 176.806 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -67.35 118.33 10.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 118.284 1.042 . . . . 0.0 109.427 178.571 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.64 133.95 14.52 Favored Glycine 0 C--O 1.226 -0.403 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -177.727 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.4 t -77.1 132.62 32.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.34 0.591 . . . . 0.0 110.154 179.457 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 53.7 mt -105.5 -48.51 9.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 174.436 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -141.64 116.2 9.63 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 118.25 0.477 . . . . 0.0 111.597 178.19 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -116.66 151.9 35.36 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.365 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.8 mt -137.62 126.48 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 104.597 -2.372 . . . . 0.0 104.597 165.082 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -108.09 125.48 51.63 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.427 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.71 135.24 54.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.821 -177.874 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -84.88 132.95 34.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 175.238 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.11 124.95 91.87 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.259 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -74.52 -23.67 14.68 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 116.591 -1.806 . . . . 0.0 112.486 -179.79 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -67.96 -37.24 81.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.792 -178.633 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.7 mttt 59.07 28.13 17.3 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 123.548 1.642 . . . . 0.0 109.858 -176.073 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -77.38 -173.13 2.75 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 110.871 -2.877 . . . . 0.0 108.5 173.802 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.48 -28.84 0.14 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 117.418 2.377 . . . . 0.0 117.418 -174.576 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.553 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 11.6 p80 -107.69 131.54 54.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.004 1.275 . . . . 0.0 108.709 169.871 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -87.12 -39.79 15.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.837 -1.529 . . . . 0.0 111.582 -172.267 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.3 mt -135.37 164.08 28.58 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.333 -178.6 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 96.6 t -128.68 136.76 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 175.678 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -120.95 116.48 25.19 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.002 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -93.68 130.08 39.76 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 175.459 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -136.2 124.39 23.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -174.92 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.87 94.87 5.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.213 0.53 . . . . 0.0 110.076 -179.315 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -144.16 141.64 30.07 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.561 -0.904 . . . . 0.0 108.561 178.188 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -99.17 137.0 38.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 -177.939 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.84 145.59 47.92 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 -174.903 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -107.36 -39.69 5.59 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.172 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -122.47 161.26 23.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.878 179.411 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -66.19 -15.47 63.17 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.095 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.74 -43.15 94.38 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.53 -46.8 88.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.367 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.424 ' O ' HD12 ' A' ' 61' ' ' ILE . 81.0 mtp -56.64 -51.96 66.7 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.34 -179.426 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.9 m -67.08 -31.84 55.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.325 -175.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.0 mtt-85 -67.53 -43.77 79.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.478 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -58.37 -45.22 88.67 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.602 -179.378 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.424 HD12 ' O ' ' A' ' 57' ' ' MET . 2.5 mt -74.12 -34.2 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.313 -0.867 . . . . 0.0 112.067 -177.446 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.33 -37.68 72.92 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 177.321 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -76.62 -46.22 26.91 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.925 179.219 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.428 ' O ' HG23 ' A' ' 68' ' ' VAL . 50.7 mt-30 -55.29 -43.8 75.12 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.244 -178.557 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.72 -39.68 81.53 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.382 0.537 . . . . 0.0 111.312 -177.518 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.411 ' HB3' HH21 ' A' ' 70' ' ' ARG . 26.1 mt-10 -73.42 -30.23 63.1 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 121.436 -0.79 . . . . 0.0 111.094 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -40.03 78.55 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 174.918 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 64' ' ' GLN . 73.0 t -65.9 -36.45 77.54 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.731 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -54.35 -38.72 66.4 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.902 0.774 . . . . 0.0 111.69 178.726 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.411 HH21 ' HB3' ' A' ' 66' ' ' GLU . 6.8 mmt180 -67.31 -43.27 82.1 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.847 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.76 -42.89 90.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.78 -44.34 86.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 123.101 0.56 . . . . 0.0 109.999 178.573 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -65.61 -42.22 91.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.656 0.265 . . . . 0.0 110.467 179.605 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -62.54 -40.59 97.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 0.0 111.161 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.94 0.97 41.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -179.929 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.31 22.59 71.17 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 114.24 0.456 . . . . 0.0 114.24 178.761 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -76.68 140.25 40.82 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.972 -0.722 . . . . 0.0 110.8 -176.931 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.64 -35.72 62.88 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 178.869 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -150.65 162.37 40.79 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 102.631 -3.1 . . . . 0.0 102.631 176.399 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.6 mtp -137.31 152.93 50.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.496 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.553 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 7.0 tttp -129.75 133.7 47.17 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 176.588 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.23 125.44 34.88 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.387 0.43 . . . . 0.0 110.588 -174.571 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.8 tp -88.04 107.81 18.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 176.601 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -101.96 128.65 48.28 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.3 t -121.31 110.0 26.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 117.945 0.338 . . . . 0.0 111.232 178.443 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -75.04 149.41 39.22 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.785 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -128.79 103.67 7.19 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 174.351 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 88.8 p -130.24 150.57 51.43 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.84 0.352 . . . . 0.0 111.823 -175.946 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -67.08 -29.36 69.11 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -178.083 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -138.61 167.4 22.02 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 -178.099 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.13 144.02 27.37 Favored Pre-proline 0 C--N 1.318 -0.787 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 177.609 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.47 149.47 66.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 114.802 1.039 . . . . 0.0 114.802 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 15.1 m -76.64 -15.34 14.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 117.209 2.3 . . . . 0.0 117.209 -174.71 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -123.73 98.31 5.76 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -176.857 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.4 t0 38.07 50.02 1.3 Allowed 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 170.924 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 96' ' ' TRP . . . . . 0.427 ' HA ' HG12 ' A' ' 99' ' ' ILE . 53.0 p-90 -80.03 -14.39 58.59 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 176.849 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -66.84 -31.79 72.63 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 121.489 -0.757 . . . . 0.0 110.625 -177.439 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.12 -20.66 66.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 109.99 173.951 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.427 HG12 ' HA ' ' A' ' 96' ' ' TRP . 12.3 mm -79.27 -45.52 23.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.897 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 -179.299 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.03 -24.42 67.48 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.74 0.781 . . . . 0.0 110.184 178.09 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -77.6 -16.11 58.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.373 -179.29 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -113.1 126.58 55.62 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -176.039 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 46.5 m -70.44 126.41 29.57 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 103.496 -2.779 . . . . 0.0 103.496 171.545 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -82.82 119.31 24.21 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.012 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -121.73 122.68 40.1 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.912 0.863 . . . . 0.0 109.51 178.913 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -143.79 129.25 19.01 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.81 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.11 -127.0 32.21 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 107.899 -2.08 . . . . 0.0 107.899 -176.962 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -104.46 7.89 35.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.171 0.51 . . . . 0.0 110.228 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.9 t -97.72 147.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -176.088 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 m -125.22 138.78 54.12 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 171.196 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.1 t -137.29 134.61 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -99.63 114.27 65.51 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.769 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -81.52 77.18 4.04 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.515 2.143 . . . . 0.0 114.644 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -86.15 155.25 20.83 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 115' ' ' ILE . . . . . 0.411 HG21 ' CZ3' ' A' ' 96' ' ' TRP . 11.6 tt -147.83 146.16 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -176.617 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 72.7 t -114.48 118.16 57.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.85 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -73.4 143.27 46.84 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.01 175.42 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.42 -41.96 8.14 Favored Glycine 0 C--O 1.223 -0.548 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 169.666 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.9 t -57.74 -23.9 54.33 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -178.278 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.8 ptm -139.94 40.35 1.98 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 122.151 0.977 . . . . 0.0 109.721 177.759 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.79 -45.79 59.41 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -172.615 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 23.3 mtm105 -57.06 -51.31 69.8 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.967 0.803 . . . . 0.0 111.686 -178.301 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -73.79 -35.22 64.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.551 -175.8 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.7 -38.23 54.75 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -178.5 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.403 HD11 HD11 ' A' ' 11' ' ' ILE . 3.2 tm? -63.35 -41.98 98.89 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.745 -0.597 . . . . 0.0 110.964 -177.381 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -69.72 -13.38 62.26 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.235 -177.961 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.42 49.94 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.684 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -93.01 -36.57 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 120.872 0.367 . . . . 0.0 110.373 179.383 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -127.83 75.67 77.94 Favored Pre-proline 0 C--N 1.326 -0.434 0 O-C-N 122.149 -0.344 . . . . 0.0 111.246 178.229 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 -15.04 42.14 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-O 121.276 0.448 . . . . 0.0 112.953 178.881 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.5 m -79.99 -7.14 58.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 178.771 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -75.87 132.91 40.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.451 0.643 . . . . 0.0 110.72 -179.461 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 . . . . . 0 C--N 1.323 -0.574 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 175.353 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 3.5 t30 . . . . . 0 C--O 1.224 -0.256 0 CA-C-O 120.502 0.191 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.88 -37.62 79.87 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.71 0.29 . . . . 0.0 110.682 175.304 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.5 -42.29 68.23 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.527 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 23.9 mmt -60.28 -33.8 72.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 0.0 110.137 178.424 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.69 -38.64 87.18 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.056 -0.403 . . . . 0.0 110.328 178.003 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.25 -43.89 85.23 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.023 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.05 -41.59 97.33 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.2 0.524 . . . . 0.0 109.886 -178.517 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -63.01 -42.31 99.78 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.881 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -62.15 -41.53 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.168 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.0 mt -63.58 -37.68 88.25 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.098 0.475 . . . . 0.0 110.034 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.9 m -69.83 -35.16 74.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.695 0.76 . . . . 0.0 110.505 176.146 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.85 -47.32 69.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.621 -178.728 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.1 p -64.99 -40.3 88.6 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.639 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.226 -178.623 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.913 -179.418 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 3' ' ' LEU . 10.7 tp . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.813 0.34 . . . . 25.0 110.834 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 88' ' ' SER . 3.5 mm? -73.73 -55.25 6.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.442 . . . . 25.0 110.958 179.877 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.04 -35.45 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 25.0 110.851 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.68 ' HB2' ' HB2' ' A' ' 147' ' ' ALA . 14.7 t80 -52.46 -46.1 66.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 25.0 110.948 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.497 ' CG2' HD11 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -71.22 -54.32 11.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.093 -179.977 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -51.19 -38.94 55.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.421 . . . . 25.0 110.926 -179.893 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -75.63 -48.26 22.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -48.3 74.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.84 -48.09 81.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 25.0 111.138 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.49 -44.15 62.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.552 ' HB1' HD13 ' A' ' 157' ' ' LEU . . . -72.0 -33.09 67.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.087 179.941 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -64.85 -51.86 59.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.484 ' CB ' HD13 ' A' ' 33' ' ' LEU . 3.8 mt -56.66 -56.13 25.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 25.0 110.903 -179.947 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -56.57 -33.0 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 25.0 111.134 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.97 -17.88 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.283 -0.417 . . . . 25.0 110.891 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.0 33.87 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.86 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.82 94.86 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.713 -0.756 . . . . 25.0 112.457 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -103.4 104.06 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.857 0.36 . . . . 25.0 110.878 -179.764 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -50.9 111.42 1.26 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.798 -0.715 . . . . 25.0 112.438 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.548 HG11 ' HB2' ' A' ' 25' ' ' ALA . 21.7 t -69.98 106.53 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.763 0.316 . . . . 25.0 111.078 -179.926 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.56 HD11 HD22 ' A' ' 43' ' ' LEU . 3.9 mt -69.12 -34.77 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.138 -0.483 . . . . 25.0 111.106 179.905 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -169.28 116.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.863 179.957 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.548 ' HB2' HG11 ' A' ' 22' ' ' VAL . . . . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.079 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.778 0.323 . . . . 25.0 110.869 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.57 173.12 15.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.916 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.9 mt -103.65 130.24 54.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.18 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -109.76 135.73 50.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.124 -0.489 . . . . 25.0 110.918 179.94 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.484 HD13 ' CB ' ' A' ' 15' ' ' LEU . 11.3 mt -146.03 124.51 12.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 25.0 110.942 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.24 133.64 42.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 25.0 110.9 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.4 104.04 38.97 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.594 0.711 . . . . 25.0 111.112 179.907 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -32.35 18.68 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.627 2.218 . . . . 25.0 112.328 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -25.63 60.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 25.0 110.823 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 66.27 39.7 4.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.93 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.07 -176.52 1.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 25.0 110.843 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.07 -34.54 13.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 25.0 110.945 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -105.51 122.8 46.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 25.0 110.909 179.848 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.12 -56.03 5.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.56 HD22 HD11 ' A' ' 23' ' ' ILE . 63.0 mt -119.59 155.26 32.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 25.0 110.895 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.9 148.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 25.0 111.169 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.634 ' HG3' HD11 ' A' ' 82' ' ' LEU . 1.3 mtt180 -132.23 140.15 48.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 25.0 110.827 -179.909 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.522 HD12 ' O ' ' A' ' 45' ' ' ARG . 4.5 mp -134.35 126.56 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.891 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -126.71 150.01 49.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 25.0 110.987 -179.967 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 94.84 4.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.164 -0.471 . . . . 25.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -151.57 148.95 28.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 25.0 110.875 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -92.99 140.06 29.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 25.0 110.874 179.958 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.34 152.09 35.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 25.0 110.871 -179.878 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.32 -36.25 7.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 25.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -135.97 -175.13 3.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 25.0 110.932 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt85 -80.38 -30.54 37.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 25.0 110.796 -179.894 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -35.1 62.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 25.0 110.917 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -34.87 61.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 25.0 110.905 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' MET . . . . . 0.568 ' O ' HD12 ' A' ' 61' ' ' ILE . 1.8 tpp -72.57 -52.28 16.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.877 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.502 ' CG1' HD12 ' A' ' 99' ' ' ILE . 34.2 m -58.95 -34.26 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.268 -0.424 . . . . 25.0 111.154 179.911 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 mtm-85 -66.51 -37.68 85.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.165 -0.47 . . . . 25.0 110.868 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -54.13 46.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 25.0 110.879 179.949 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.568 HD12 ' O ' ' A' ' 57' ' ' MET . 2.4 mp -60.73 -37.85 77.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.288 -0.414 . . . . 25.0 111.139 179.948 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -51.43 -34.89 37.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 25.0 110.942 179.944 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -76.78 -35.67 57.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 25.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.74 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.8 mp0 -54.42 -59.72 4.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 25.0 110.924 -179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.507 ' HB1' ' CB ' ' A' ' 106' ' ' LYS . . . -52.22 -38.35 57.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.083 179.924 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.89 -42.04 97.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 25.0 110.886 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.48 -37.2 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.884 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 68' ' ' VAL . . . . . 0.744 HG11 HG13 ' A' ' 109' ' ' VAL . 68.1 t -52.85 -35.74 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 25.0 111.124 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -53.93 -36.69 63.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.813 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -72.29 -37.12 69.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.176 -0.466 . . . . 25.0 110.842 -179.891 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 86.5 t -70.87 -52.8 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 25.0 111.166 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -36.36 75.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.806 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -58.25 -45.27 88.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.818 -179.924 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -72.54 -37.55 68.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 25.0 110.9 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mp -70.98 -19.63 62.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.896 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.32 33.34 58.2 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.773 -0.727 . . . . 25.0 112.501 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.03 175.34 6.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 25.0 110.897 -179.89 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -71.27 -52.83 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -148.74 163.86 36.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 25.0 110.859 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 mmm -134.9 130.97 36.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 25.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.7 120.12 39.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 25.0 110.901 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.661 ' O ' HG13 ' A' ' 111' ' ' VAL . 0.6 OUTLIER -111.57 130.99 55.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.314 -0.403 . . . . 25.0 110.967 179.878 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.62 ' N ' HD13 ' A' ' 82' ' ' LEU . 2.3 tp -104.08 97.72 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.917 179.856 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -100.21 126.68 46.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 25.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.544 HG23 ' CB ' ' A' ' 114' ' ' ALA . 7.0 p -129.6 154.87 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 25.0 111.133 179.971 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -122.56 127.4 49.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.866 -179.953 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -98.39 114.61 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.865 -179.938 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.598 ' O ' HD11 ' A' ' 4' ' ' LEU . 60.2 p -143.76 169.52 17.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.862 -179.778 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.8 m -89.86 -51.22 5.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 25.0 111.157 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -120.58 135.24 55.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.837 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.773 ' HB2' ' HD2' ' A' ' 117' ' ' ARG . . . -69.24 160.15 80.1 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.54 0.686 . . . . 25.0 111.092 179.959 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.571 ' HD2' ' HB1' ' A' ' 91' ' ' ALA . 54.3 Cg_endo -69.58 -170.48 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.753 2.302 . . . . 25.0 112.383 -179.997 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.6 m -145.79 80.67 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 25.0 111.151 179.83 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -172.98 45.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.786 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.9 t70 63.51 55.85 1.7 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.858 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 24.3 p-90 -84.39 -29.63 26.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 25.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -50.7 -48.2 58.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.199 -0.455 . . . . 25.0 110.846 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.92 -33.57 37.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.847 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 99' ' ' ILE . . . . . 0.557 HG22 ' HG3' ' A' ' 113' ' ' PRO . 21.6 mm -59.99 -46.4 94.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 25.0 111.098 -179.98 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.82 -31.11 71.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.02 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -73.0 -38.07 66.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 25.0 110.932 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt -89.08 156.54 18.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.881 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.3 m -122.81 143.98 49.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.445 . . . . 25.0 111.161 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -90.75 104.16 16.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -112.43 101.09 9.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 25.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 106' ' ' LYS . . . . . 0.507 ' CB ' ' HB1' ' A' ' 65' ' ' ALA . 0.2 OUTLIER -98.01 103.28 15.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 25.0 110.823 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 52.75 -112.41 2.14 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.725 . . . . 25.0 112.437 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.1 p -95.08 29.81 2.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 25.0 111.125 -179.824 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.744 HG13 HG11 ' A' ' 68' ' ' VAL . 17.5 t -122.46 151.61 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 25.0 111.096 179.917 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.8 t -137.73 112.5 8.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 25.0 110.893 -179.818 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 111' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 82' ' ' LEU . 18.9 t -140.94 138.9 34.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 25.0 111.082 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.04 141.86 38.21 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.648 0.737 . . . . 25.0 110.885 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 113' ' ' PRO . . . . . 0.557 ' HG3' HG22 ' A' ' 99' ' ' ILE . 54.6 Cg_endo -69.65 135.61 31.16 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.669 2.246 . . . . 25.0 112.351 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 114' ' ' ALA . . . . . 0.544 ' CB ' HG23 ' A' ' 85' ' ' VAL . . . -134.26 135.14 42.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 25.0 111.111 179.875 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.98 137.93 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 25.0 111.165 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 116' ' ' VAL . . . . . 0.695 HG12 ' HB3' ' A' ' 124' ' ' ASP . 4.7 m -130.74 101.85 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 25.0 111.203 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.773 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -95.2 154.73 17.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.889 -179.961 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.65 -29.46 18.37 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.765 -0.731 . . . . 25.0 112.482 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.1 p -57.51 -45.37 85.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 25.0 111.172 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 1.7 mtm -134.59 46.93 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.819 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.453 ' CD1' HD12 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -61.31 -59.19 5.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 25.0 110.85 -179.963 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.72 -35.58 80.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.91 179.908 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.57 -41.09 89.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 25.0 110.8 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 124' ' ' ASP . . . . . 0.695 ' HB3' HG12 ' A' ' 116' ' ' VAL . 1.1 m-20 -77.43 -33.25 54.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 25.0 110.897 -179.964 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 125' ' ' LEU . . . . . 0.497 HD11 ' CG2' ' A' ' 7' ' ' THR . 0.2 OUTLIER -52.66 -33.8 48.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.495 . . . . 25.0 110.932 -179.954 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -75.36 -30.2 60.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 25.0 110.846 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.54 -37.83 65.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 25.0 111.17 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -90.34 -60.63 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.441 . . . . 25.0 111.108 179.979 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 129' ' ' PHE . . . . . 0.478 ' HZ ' HD11 ' A' ' 46' ' ' LEU . 31.0 m-85 -112.44 77.54 2.32 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.586 0.708 . . . . 25.0 110.881 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 -29.45 23.44 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.643 2.229 . . . . 25.0 112.321 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 43.3 t -69.44 -16.04 63.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 25.0 110.799 -179.813 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -54.24 146.17 15.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.854 -179.877 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.854 -179.93 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.458 -0.051 0 CA-C-O 120.854 0.359 . . . . 25.0 110.969 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 147' ' ' ALA . . . . . 0.68 ' HB2' ' HB2' ' A' ' 6' ' ' TYR . . . -53.88 -35.39 61.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 25.0 111.154 179.763 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -61.47 -44.76 96.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.852 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.2 mmt -76.93 -35.73 57.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.437 . . . . 25.0 110.852 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.65 66.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.252 -0.431 . . . . 25.0 111.132 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.3 ttt180 -65.13 -53.81 39.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -43.79 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 25.0 110.877 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -39.5 93.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.959 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 154' ' ' PHE . . . . . 0.588 ' O ' HG23 ' A' ' 158' ' ' VAL . 38.9 t80 -53.57 -44.23 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.861 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -51.93 -46.12 64.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 25.0 110.884 -179.908 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.5 m -76.15 -36.22 58.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.869 -179.933 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 157' ' ' LEU . . . . . 0.552 HD13 ' HB1' ' A' ' 13' ' ' ALA . 10.5 tt -57.17 -34.99 69.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.89 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 158' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 154' ' ' PHE . 84.1 t -52.63 -54.5 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.101 179.795 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 159' ' ' LEU . . . . . 0.653 HD13 ' O ' ' A' ' 159' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 25.0 110.886 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -133.59 156.96 46.9 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 122.32 -0.238 . . . . 0.0 110.675 -177.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -64.14 -43.81 94.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.312 0.577 . . . . 0.0 109.996 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.68 -34.63 78.3 Favored 'General case' 0 C--O 1.215 -0.763 0 O-C-N 122.017 -0.427 . . . . 0.0 110.976 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -61.62 -32.95 73.12 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.602 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -63.15 -52.44 62.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.2 m -59.38 -40.82 87.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.371 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -55.26 -48.35 74.12 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.425 0.69 . . . . 0.0 110.983 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -70.49 -34.08 71.96 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.718 -0.614 . . . . 0.0 111.749 178.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -67.97 -34.88 77.4 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.095 -0.378 . . . . 0.0 111.397 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 24.2 mm -71.85 -41.1 69.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.86 78.04 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.51 -49.8 73.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.519 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -37.92 89.26 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.28 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.47 -48.79 63.56 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.2 p -65.22 -30.61 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.202 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -78.17 -8.56 58.45 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.971 -0.455 . . . . 0.0 111.312 178.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 55.4 m -101.25 9.94 41.27 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.95 0.83 61.76 Favored Glycine 0 N--CA 1.452 -0.282 0 N-CA-C 116.836 1.494 . . . . 0.0 116.836 176.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.42 132.08 46.41 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.13 131.29 10.28 Favored Glycine 0 C--O 1.22 -0.753 0 N-CA-C 110.271 -1.132 . . . . 0.0 110.271 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.44 106.23 7.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 118.332 1.066 . . . . 0.0 109.329 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 74.3 mt -72.78 -42.46 61.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -148.7 116.34 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.32 116.4 10.47 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 123.189 0.306 . . . . 0.0 111.035 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 168.12 -31.93 0.18 Allowed Glycine 0 C--N 1.319 -0.406 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.228 175.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -66.45 154.69 39.59 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 m -95.7 0.56 52.72 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 121.985 -0.447 . . . . 0.0 111.554 -176.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -126.78 -27.42 3.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -178.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -131.6 131.68 43.45 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.8 mt -136.6 132.79 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 175.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -108.17 129.2 55.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.88 126.26 48.28 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 123.434 0.694 . . . . 0.0 109.565 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -76.32 132.26 39.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.29 116.62 50.93 Favored Pre-proline 0 CA--C 1.546 0.809 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.28 -23.58 20.7 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 117.592 -1.139 . . . . 0.0 113.812 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.9 -27.49 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.654 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.7 mttt 54.83 39.54 31.5 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.952 1.834 . . . . 0.0 108.353 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 t -73.95 -176.26 2.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 110.816 -2.902 . . . . 0.0 107.927 176.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.2 m -47.22 -30.62 3.1 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -90.03 129.9 36.28 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 172.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -89.15 -37.36 15.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.956 0.408 . . . . 0.0 111.891 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.49 166.42 30.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.257 0.551 . . . . 0.0 111.534 -175.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 49.1 t -127.16 136.39 60.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -114.98 126.35 54.66 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mp -95.87 129.46 43.11 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 102.98 -2.97 . . . . 0.0 102.98 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -136.45 113.43 10.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.644 0.735 . . . . 0.0 112.478 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -87.67 96.88 10.59 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.82 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -151.62 139.19 19.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -93.68 137.82 32.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -121.81 120.1 33.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.353 0.121 . . . . 0.0 111.115 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -80.09 -48.63 12.94 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.559 0.695 . . . . 0.0 111.297 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -120.2 156.33 31.36 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.256 0.551 . . . . 0.0 112.4 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HE ' ' CB ' ' A' ' 95' ' ' ASP . 8.4 ptt85 -64.33 -15.52 60.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.249 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -65.11 -45.66 84.2 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -72.52 -36.29 68.29 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -178.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 20.5 ttt -57.46 -48.08 80.12 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -72.29 -31.81 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.744 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.48 -36.43 84.16 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -60.81 -41.23 95.28 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -66.34 -30.93 51.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 O-C-N 122.12 -0.363 . . . . 0.0 111.527 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -61.04 -39.44 89.81 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -76.55 -41.83 45.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.019 0.437 . . . . 0.0 110.168 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -55.99 -43.23 77.45 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.79 88.68 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -71.78 -34.18 69.2 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 121.72 -0.613 . . . . 0.0 109.989 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -63.28 -42.16 99.07 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.44 HG11 HG13 ' A' ' 109' ' ' VAL . 45.5 t -67.17 -32.24 56.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.782 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.9 -33.56 68.87 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.239 -0.913 . . . . 0.0 110.447 177.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.87 -40.45 79.26 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.99 0.424 . . . . 0.0 109.97 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.73 -36.75 75.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.082 0.468 . . . . 0.0 109.746 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -55.79 -39.44 71.28 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.113 -0.367 . . . . 0.0 110.668 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -59.28 -50.86 72.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.048 -178.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -73.37 -22.45 60.27 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -82.59 -18.06 42.61 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 122.015 -0.428 . . . . 0.0 112.032 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.09 2.06 12.05 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -75.58 152.71 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 118.108 0.954 . . . . 0.0 112.976 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.5 ttt85 -69.11 -22.84 63.95 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.903 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 -147.35 151.85 37.23 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 104.16 -2.533 . . . . 0.0 104.16 177.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -119.99 135.79 54.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.882 -1.895 . . . . 0.0 105.882 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -126.13 126.13 43.65 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 53.8 tp -114.13 134.47 54.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.817 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.6 tp -95.08 120.43 35.28 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 169.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -114.24 114.79 26.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.312 0.505 . . . . 0.0 110.362 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.5 t -109.08 111.01 34.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.004 0.431 . . . . 0.0 112.048 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -77.21 141.69 39.94 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -116.11 103.68 10.8 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.7 m -128.36 150.62 50.02 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.546 0.529 . . . . 0.0 111.141 -174.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.3 t -70.61 -29.0 65.27 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.511 -0.743 . . . . 0.0 110.458 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -148.54 164.06 35.35 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.64 157.51 49.37 Favored Pre-proline 0 C--N 1.319 -0.718 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.87 147.33 62.8 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.44 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 19.8 m -65.84 -14.16 16.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -152.0 146.64 25.73 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -177.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.48 ' CB ' ' HE ' ' A' ' 54' ' ' ARG . 60.1 m-20 47.22 6.28 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 120.243 3.423 . . . . 0.0 120.243 176.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -58.95 -25.89 63.93 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.86 -1.15 . . . . 0.0 112.61 -175.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.67 -32.24 73.27 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.996 -0.44 . . . . 0.0 112.18 -177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.07 -33.49 75.54 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.853 0.835 . . . . 0.0 109.187 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.3 mm -69.21 -41.14 81.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.483 -173.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.87 -12.55 61.02 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.082 0.468 . . . . 0.0 111.469 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -98.56 0.24 44.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.416 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -121.88 135.75 54.9 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.479 0.656 . . . . 0.0 112.346 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.8 m -82.59 126.95 32.88 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -85.42 119.0 25.29 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 176.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -123.45 131.79 53.75 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -139.31 103.6 4.78 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.738 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.96 -112.7 4.35 Favored Glycine 0 C--O 1.224 -0.497 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.0 p -108.59 8.31 27.06 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.171 0.51 . . . . 0.0 110.578 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.44 HG13 HG11 ' A' ' 68' ' ' VAL . 86.1 t -95.38 141.49 15.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.6 t -127.35 135.67 50.84 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 175.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.4 t -134.25 134.94 54.88 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.603 0 CA-C-O 122.107 0.956 . . . . 0.0 109.284 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -103.18 101.88 24.94 Favored Pre-proline 0 N--CA 1.427 -1.582 0 CA-C-N 113.26 -1.791 . . . . 0.0 108.207 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.31 145.43 24.02 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 116.941 -1.573 . . . . 0.0 112.451 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.36 154.57 40.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 tt -147.33 128.78 6.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.36 121.53 60.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.45 140.03 42.34 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -175.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.56 -32.54 53.42 Favored Glycine 0 C--O 1.229 -0.176 0 CA-C-N 115.568 -0.742 . . . . 0.0 114.188 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 32.9 p -53.35 -30.19 38.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 115.718 1.747 . . . . 0.0 115.718 -178.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.5 ptm -140.94 26.92 2.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.86 0.838 . . . . 0.0 109.44 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.7 tp -47.86 -40.88 22.69 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 118.263 2.69 . . . . 0.0 118.263 -168.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -41.75 94.93 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.675 1.125 . . . . 0.0 112.028 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.55 -40.25 35.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.981 0.896 . . . . 0.0 110.878 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -61.69 -41.86 98.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.589 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.96 -42.48 89.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.44 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -76.64 -15.09 59.91 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.626 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.35 -34.63 63.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.4 t -90.18 -43.17 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 109.903 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -120.49 78.89 28.78 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.773 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -69.68 -9.12 25.36 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 117.669 -1.087 . . . . 0.0 112.515 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 p -74.28 -14.92 60.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.396 176.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -96.72 134.17 40.34 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 -90.04 130.03 36.28 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 77.1 p -66.3 -23.15 66.33 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.107 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -64.46 -26.69 68.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.022 0.439 . . . . 0.0 111.078 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -76.43 -11.65 59.92 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.962 0.887 . . . . 0.0 110.176 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 17.0 t -118.74 44.58 2.25 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.83 143.77 46.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.958 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -59.33 -34.48 72.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.155 0.502 . . . . 0.0 112.209 -176.128 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -69.78 -11.61 60.99 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -116.77 -26.62 6.9 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.278 0.561 . . . . 0.0 111.27 -177.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -81.94 88.82 6.36 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 121.86 -0.525 . . . . 0.0 110.643 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 24.5 p -130.94 164.6 24.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.333 0.587 . . . . 0.0 111.089 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -59.93 -38.46 82.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.195 -178.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -72.55 -37.84 68.14 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.014 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -62.59 -24.38 67.53 Favored 'General case' 0 C--O 1.214 -0.797 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.506 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -31.72 55.91 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.112 -0.368 . . . . 0.0 111.662 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -64.58 -48.31 75.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.0 mmt -66.4 -35.64 80.83 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.913 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.55 -38.33 77.57 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.33 -0.231 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -65.34 -45.9 82.41 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.29 -43.43 98.88 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.148 0.499 . . . . 0.0 111.029 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.9 mmt-85 -63.17 -44.01 96.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.14 -41.56 88.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 177.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 80.2 mt -65.48 -35.8 81.96 Favored 'General case' 0 C--N 1.321 -0.657 0 O-C-N 121.646 -0.658 . . . . 0.0 111.2 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 87.6 p -75.81 -27.81 58.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.487 -0.758 . . . . 0.0 110.53 175.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.69 -43.68 65.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.474 -177.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.3 -33.07 57.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -73.84 -41.27 62.51 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 121.719 -0.613 . . . . 0.0 109.584 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -61.71 -32.35 72.56 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.464 -0.772 . . . . 0.0 111.059 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.77 -28.58 61.51 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 122.729 0.411 . . . . 0.0 110.689 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -62.37 -39.52 93.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.295 0.569 . . . . 0.0 109.739 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -76.03 -38.55 57.11 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.358 0.599 . . . . 0.0 109.729 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -59.65 -43.19 94.0 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 -66.39 -17.84 65.01 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -72.59 -48.57 38.68 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 43.9 p -72.43 -25.75 61.59 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -58.37 -28.98 65.64 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.531 0.732 . . . . 0.0 112.342 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.02 -26.97 51.09 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -84.19 62.54 7.18 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 177.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 31.6 m -60.59 140.89 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.592 0.71 . . . . 0.0 110.835 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -145.29 3.7 1.03 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -176.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -148.97 149.58 31.42 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 122.222 -0.299 . . . . 0.0 110.671 -175.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -146.88 160.69 42.0 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 178.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -170.06 171.88 43.63 Favored Glycine 0 C--O 1.228 -0.257 0 N-CA-C 109.123 -1.591 . . . . 0.0 109.123 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -158.06 169.79 23.76 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 39.4 tp -123.48 -35.46 2.93 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.159 0.799 . . . . 0.0 113.159 -178.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 55.39 33.61 21.23 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -73.03 110.75 7.55 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.49 150.8 50.0 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -152.35 -57.98 0.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.52 ' HG ' ' H ' ' A' ' 183' ' ' TYR . 10.4 tp 58.35 -161.52 0.24 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 123.975 0.797 . . . . 0.0 109.687 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 183' ' ' TYR . . . . . 0.52 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 49.6 p90 -159.68 159.94 33.57 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 104.224 -2.509 . . . . 0.0 104.224 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -160.93 169.44 22.6 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 105.709 -1.96 . . . . 0.0 105.709 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 . . . . . 0 C--O 1.253 1.265 0 N-CA-C 104.14 -2.541 . . . . 0.0 104.14 179.971 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.797 -0.62 . . . . 0.0 109.509 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -132.52 -51.31 0.93 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -64.33 -34.61 78.54 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 23.8 tp -63.08 -42.19 99.59 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.448 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -64.63 -41.05 96.43 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -58.59 -48.14 81.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.9 m -66.12 -43.46 87.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.352 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -55.09 -51.63 65.78 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.622 0.369 . . . . 0.0 110.984 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -72.3 -29.95 64.34 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.728 -0.607 . . . . 0.0 112.143 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -71.1 -35.54 71.84 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.557 -0.715 . . . . 0.0 111.166 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.1 mm -71.29 -37.83 67.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.14 -45.15 87.87 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 176.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.66 -40.8 96.07 Favored 'General case' 0 C--O 1.208 -1.123 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -58.94 -49.81 76.44 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.2 mp -68.35 -45.42 72.9 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.089 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.76 -42.77 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.937 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -61.97 -26.53 68.26 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 121.915 -0.491 . . . . 0.0 111.72 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -82.53 5.24 21.44 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 122.575 0.35 . . . . 0.0 111.763 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.12 -1.51 44.06 Favored Glycine 0 CA--C 1.517 0.164 0 N-CA-C 115.483 0.953 . . . . 0.0 115.483 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.01 123.05 19.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.817 0.808 . . . . 0.0 109.393 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.01 129.39 9.66 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.31 133.99 29.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.07 -41.94 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -149.2 142.24 24.87 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 104.804 -2.295 . . . . 0.0 104.804 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.2 105.2 4.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.02 41.68 26.73 Favored Glycine 0 C--O 1.225 -0.434 0 C-N-CA 120.784 -0.722 . . . . 0.0 113.128 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -60.43 -35.8 76.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 122.369 1.08 . . . . 0.0 108.773 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 m -158.4 -69.43 0.09 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 174.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -135.42 14.12 3.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.67 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -133.18 152.28 51.95 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 93.2 mt -135.21 133.48 52.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -114.44 136.11 53.37 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.14 0.576 . . . . 0.0 109.654 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mp -132.91 137.97 46.8 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.349 0.66 . . . . 0.0 109.923 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -93.86 135.82 34.78 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.77 111.93 15.38 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -73.59 -24.96 15.48 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.523 -1.184 . . . . 0.0 114.173 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.19 -8.3 55.72 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt 58.15 43.95 19.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -68.19 -177.66 0.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 113.273 -1.785 . . . . 0.0 110.915 -177.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 p -56.27 -27.64 55.97 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.484 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -105.76 133.4 50.55 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -80.11 -39.81 28.77 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 120.96 0.409 . . . . 0.0 109.933 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.4 mt -137.38 160.35 39.32 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.716 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 58.5 t -131.51 137.43 55.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -123.35 132.27 53.93 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.2 124.08 47.92 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 174.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -136.54 150.0 48.4 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -125.81 119.91 29.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 118.181 0.446 . . . . 0.0 112.019 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.71 140.43 20.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -92.61 111.98 23.76 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.7 mt -104.09 125.19 50.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -87.22 -34.7 18.89 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.18 0.514 . . . . 0.0 110.708 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -130.29 148.01 52.07 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -177.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 95' ' ' ASP . 14.1 ptt180 -67.38 -21.05 65.63 Favored 'General case' 0 CA--C 1.505 -0.768 0 O-C-N 121.088 -1.008 . . . . 0.0 111.803 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -62.11 -28.52 69.69 Favored 'General case' 0 C--O 1.213 -0.865 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.69 -45.07 25.95 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 175.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.4 ttm -54.56 -49.97 69.07 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.484 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.17 -31.87 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.25 -34.57 76.45 Favored 'General case' 0 CA--C 1.506 -0.745 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.238 -176.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -42.24 89.71 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -74.18 -34.43 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 122.019 -0.426 . . . . 0.0 111.355 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -41.54 92.05 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -76.3 -33.73 59.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.948 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -58.2 -46.62 85.51 Favored 'General case' 0 C--O 1.219 -0.52 0 O-C-N 121.966 -0.459 . . . . 0.0 109.798 176.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.05 -32.68 74.11 Favored 'General case' 0 N--CA 1.444 -0.755 0 O-C-N 122.403 -0.185 . . . . 0.0 110.623 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -46.54 85.35 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -61.67 -41.31 97.38 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.422 HG11 HG13 ' A' ' 109' ' ' VAL . 86.7 t -61.31 -35.34 65.56 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.74 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.986 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -55.48 -38.99 69.85 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.493 1.042 . . . . 0.0 110.597 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -73.93 -45.79 48.3 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.705 0.288 . . . . 0.0 111.118 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.06 -44.33 95.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.652 0.263 . . . . 0.0 111.698 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -30.1 70.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.151 -0.968 . . . . 0.0 110.167 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -68.89 -43.15 75.86 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.12 -30.99 70.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.879 0.371 . . . . 0.0 111.246 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -83.33 -14.0 53.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.489 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.98 -3.09 30.63 Favored Glycine 0 CA--C 1.522 0.469 0 N-CA-C 114.191 0.437 . . . . 0.0 114.191 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -71.0 136.02 48.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -64.24 -45.79 86.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 122.124 -0.36 . . . . 0.0 111.785 -176.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -119.98 162.26 19.52 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 178.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.4 ttp -145.31 138.84 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.363 174.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -113.63 143.46 44.53 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 123.647 0.592 . . . . 0.0 109.863 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.1 tt -139.47 136.85 35.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.0 tp -99.22 106.35 18.49 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -97.31 108.52 21.26 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.41 116.31 46.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -175.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -85.98 151.37 23.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -126.3 129.43 48.85 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 172.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.5 p -147.62 163.02 37.94 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.017 0.198 . . . . 0.0 110.784 -174.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.0 m -67.09 -48.96 66.59 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 173.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -151.41 165.99 32.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 105.188 -2.153 . . . . 0.0 105.188 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.16 158.14 36.5 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.14 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -54.48 146.01 54.7 Favored 'Trans proline' 0 C--N 1.349 0.571 0 N-CA-C 116.902 1.847 . . . . 0.0 116.902 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.6 m -77.18 -19.51 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.01 177.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -87.71 87.22 7.31 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.755 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 54' ' ' ARG . 68.8 m-20 19.84 51.25 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 119.054 2.983 . . . . 0.0 119.054 176.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -63.05 -20.59 65.48 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.519 -0.738 . . . . 0.0 112.875 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.35 -31.29 69.06 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 122.246 -0.284 . . . . 0.0 111.451 -177.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.73 -30.35 71.46 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.685 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.4 HD11 ' HD2' ' A' ' 54' ' ' ARG . 9.4 mm -73.46 -38.51 53.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.86 0.362 . . . . 0.0 110.3 -176.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.07 -25.3 67.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.101 0.953 . . . . 0.0 110.441 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -97.69 21.71 10.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.215 -177.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.3 ttmm -139.36 98.02 3.41 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.574 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 65.1 m -68.24 127.07 31.58 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.266 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -86.39 112.12 21.16 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -108.4 131.98 54.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.809 0.814 . . . . 0.0 110.103 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -128.86 84.51 2.24 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.94 -110.44 3.15 Favored Glycine 0 C--O 1.22 -0.78 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 71.7 p -98.09 -1.32 42.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.422 HG13 HG11 ' A' ' 68' ' ' VAL . 95.9 t -89.52 138.55 19.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.0 m -133.98 112.72 11.46 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 173.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.9 t -121.53 130.58 74.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -113.58 133.0 22.28 Favored Pre-proline 0 C--O 1.244 0.808 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -81.58 160.88 19.4 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 O-C-N 122.253 0.607 . . . . 0.0 112.446 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.86 152.59 36.72 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 102.444 -3.169 . . . . 0.0 102.444 174.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 tt -147.76 135.46 14.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 51.7 t -108.98 117.32 54.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.41 146.91 42.54 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.295 177.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.49 -41.5 8.35 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 172.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.3 t -65.51 -19.75 66.06 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -177.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 24.4 ptm -136.63 32.0 2.78 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 122.095 0.95 . . . . 0.0 109.355 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -49.19 -43.83 42.58 Favored 'General case' 0 C--O 1.213 -0.821 0 N-CA-C 116.545 2.054 . . . . 0.0 116.545 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.4 ptt-85 -54.69 -51.35 65.82 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.309 0.504 . . . . 0.0 112.052 -177.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -75.05 -39.66 60.81 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.951 -177.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -70.37 -32.12 69.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -175.586 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.45 -41.22 93.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.721 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.11 -21.23 66.77 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.7 -22.69 60.86 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.648 0.261 . . . . 0.0 110.91 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.0 t -109.06 -42.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.167 0.508 . . . . 0.0 111.554 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -125.54 73.88 68.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.366 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.83 -12.38 32.65 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 117.991 -0.873 . . . . 0.0 113.362 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.0 m -80.39 -5.08 55.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -103.6 132.95 49.41 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 39.5 mtp85 -70.51 102.97 2.34 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 3.7 t -68.26 -18.04 64.44 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 135' ' ' GLU . 18.5 mp0 -74.31 -12.05 60.43 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 123.241 0.617 . . . . 0.0 111.416 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -82.34 7.4 14.13 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 19.8 t -128.49 137.09 51.63 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 36.4 t -138.45 132.26 31.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.545 0.688 . . . . 0.0 112.564 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 57.1 tt0 -68.28 -37.31 80.55 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.513 -1.222 . . . . 0.0 109.285 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -64.62 -27.94 69.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.967 -177.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -93.54 -9.4 38.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.017 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 63.25 -44.73 0.22 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 -178.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.6 m 54.51 25.68 6.44 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -64.72 -50.52 66.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.771 0.319 . . . . 0.0 111.565 -177.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -72.45 -28.8 63.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.892 0.853 . . . . 0.0 109.841 178.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -66.26 -23.54 66.42 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.688 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -39.85 72.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.731 0.3 . . . . 0.0 111.524 177.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -68.67 -41.94 78.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.531 0.681 . . . . 0.0 109.266 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 46.3 mtt -64.41 -37.0 86.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.84 -37.55 87.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.447 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -64.61 -52.6 56.64 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -63.85 -36.02 82.55 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.373 0.606 . . . . 0.0 111.148 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -63.86 -39.67 94.75 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -66.95 -42.14 85.74 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.129 0.171 . . . . 0.0 111.289 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.37 -34.84 75.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.177 0.513 . . . . 0.0 109.822 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 24.0 m -75.97 -35.69 59.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.392 0.615 . . . . 0.0 111.477 176.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 5.7 tt -65.56 -43.16 90.74 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.5 p -57.72 -40.76 77.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.739 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -67.91 -40.51 83.39 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.539 . . . . 0.0 110.265 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -67.44 -31.1 71.04 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 121.677 -0.639 . . . . 0.0 111.452 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -59.1 -28.48 66.56 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.953 -0.467 . . . . 0.0 111.835 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -57.36 -37.19 72.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.089 0.471 . . . . 0.0 110.095 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -76.98 -45.91 25.84 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.482 0.658 . . . . 0.0 109.864 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -60.23 -51.62 68.79 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 34.0 ptt-85 -64.96 -22.11 66.95 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.59 1.086 . . . . 0.0 113.38 -175.425 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -70.9 -39.3 72.83 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 21.5 m -72.41 -46.44 55.18 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.92 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -66.61 -24.24 66.29 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -177.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -59.96 -23.11 63.32 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.519 0.199 . . . . 0.0 111.523 177.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -81.96 69.18 8.61 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 176.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 30.0 m -65.93 143.71 15.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -158.91 -42.97 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.008 -0.997 . . . . 0.0 109.548 175.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 40.08 -145.15 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.838 1.255 . . . . 0.0 113.81 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -154.42 166.4 33.36 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -82.09 102.04 2.25 Favored Glycine 0 C--N 1.323 -0.185 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.54 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -152.43 166.1 32.98 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 176.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -154.71 162.45 41.12 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 105.373 -2.084 . . . . 0.0 105.373 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -138.6 164.18 30.15 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 53.7 ptt85 -157.99 148.17 20.34 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -154.96 171.41 19.75 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 103.975 -2.602 . . . . 0.0 103.975 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -147.83 138.5 23.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.838 0.744 . . . . 0.0 111.171 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 4.0 tt -111.18 -25.25 9.82 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 123.913 0.758 . . . . 0.0 110.698 177.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -80.72 106.76 12.97 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.778 0.799 . . . . 0.0 113.033 -175.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -127.46 114.55 17.62 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 176.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.111 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -175.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 ttt . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 119.258 -0.401 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -123.55 160.59 26.7 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.638 0.654 . . . . 0.0 109.639 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tt -67.83 -44.67 76.68 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -176.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -60.99 -32.41 71.98 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.649 0.737 . . . . 0.0 112.052 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -56.98 -27.15 61.13 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -61.29 -52.3 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 178.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 m -69.45 -40.22 77.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.141 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -52.82 -58.03 8.24 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -68.01 -28.07 67.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.476 -0.765 . . . . 0.0 111.905 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -73.18 -29.87 63.14 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 122.09 -0.381 . . . . 0.0 111.455 178.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.424 HD11 HD11 ' A' ' 125' ' ' LEU . 12.9 mm -69.87 -41.88 79.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.56 80.28 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.42 98.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.094 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -39.32 86.33 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.644 -0.423 . . . . 0.0 111.27 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.45 -44.23 83.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.84 -42.58 89.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.027 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -77.96 -2.41 36.79 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.358 -0.839 . . . . 0.0 112.692 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -98.37 7.96 45.5 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 173.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.54 -1.32 57.02 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 116.694 1.437 . . . . 0.0 116.694 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.445 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 12.8 m-85 -69.69 125.32 26.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 118.336 1.068 . . . . 0.0 110.442 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.46 133.67 13.1 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.6 t -78.25 117.09 22.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.465 HD11 HD22 ' A' ' 43' ' ' LEU . 75.3 mt -87.24 -44.74 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -149.56 123.26 9.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.827 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 127.62 21.4 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.115 -2.55 . . . . 0.0 104.115 172.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 167.22 -38.57 0.24 Allowed Glycine 0 CA--C 1.503 -0.658 0 N-CA-C 108.898 -1.681 . . . . 0.0 108.898 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -67.93 146.87 53.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 106.298 -1.742 . . . . 0.0 106.298 175.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.3 m -79.34 -14.94 58.66 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -178.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.88 -18.04 10.84 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -173.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -135.53 141.02 45.17 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 42.3 mt -136.1 131.69 49.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -106.83 128.74 54.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.09 133.45 53.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.564 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -87.52 137.03 32.69 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.03 107.25 11.03 Favored Pre-proline 0 CA--C 1.549 0.921 0 O-C-N 123.034 0.209 . . . . 0.0 111.554 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 90.2 Cg_endo -73.49 -20.23 20.92 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 118.009 -0.861 . . . . 0.0 112.418 -178.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.88 -25.45 66.4 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.708 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mttt 59.59 40.75 19.86 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 -173.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.0 p -75.79 -177.52 3.82 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 112.498 -2.137 . . . . 0.0 108.728 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.2 -1.56 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -136.08 133.57 37.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -76.91 -35.75 57.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.449 0.643 . . . . 0.0 109.898 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.465 HD22 HD11 ' A' ' 23' ' ' ILE . 54.8 mt -136.24 162.62 32.47 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.0 t -126.4 133.7 68.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -118.47 115.67 25.1 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 tp -90.24 123.31 33.93 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -136.35 141.9 43.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 117.902 0.319 . . . . 0.0 111.548 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -111.39 119.73 39.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 t-160 -151.71 123.62 8.06 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.21 121.0 26.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.42 108.3 18.28 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -176.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -70.29 -46.84 63.49 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 122.458 1.123 . . . . 0.0 109.856 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -119.78 155.46 32.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.051 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -62.56 -22.29 66.23 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -65.58 -32.26 73.75 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -69.96 -49.12 54.94 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.534 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -66.48 -32.07 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -71.24 -27.65 63.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.303 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -68.5 -37.52 80.14 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.84 -30.64 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.334 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.88 -42.13 98.69 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -70.05 -41.8 73.71 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.029 0.919 . . . . 0.0 109.187 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.59 -37.11 77.67 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.005 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.34 -41.92 96.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.853 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -64.26 -39.95 94.99 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.95 -44.52 97.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.3 t -67.08 -40.86 86.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.666 0 CA-C-O 119.737 -0.173 . . . . 0.0 110.57 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -35.01 72.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.262 0.553 . . . . 0.0 109.932 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -73.6 -45.73 51.29 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.803 -0.561 . . . . 0.0 110.786 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.68 -42.69 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -59.36 -30.23 68.26 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.341 -0.849 . . . . 0.0 110.729 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -66.16 -36.73 83.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -70.27 -39.66 74.82 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 121.315 0.579 . . . . 0.0 109.689 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.6 mt -75.38 -7.79 54.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.264 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.53 10.53 63.64 Favored Glycine 0 CA--C 1.522 0.485 0 CA-C-O 121.316 0.398 . . . . 0.0 113.368 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -76.23 137.67 40.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.366 0.603 . . . . 0.0 110.333 -176.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -72.0 -30.53 65.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.994 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -151.46 149.34 29.14 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 103.791 -2.67 . . . . 0.0 103.791 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.7 ttp -131.42 143.15 50.24 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 118.913 0.779 . . . . 0.0 109.901 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.1 mtpt -107.57 136.94 46.49 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.0 tp -125.75 137.31 53.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.3 tp -94.81 121.27 36.23 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.36 135.53 42.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.0 t -132.79 111.62 17.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -82.75 150.58 26.59 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.584 0.553 . . . . 0.0 110.541 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -128.94 115.87 18.5 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 173.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 96.2 p -137.06 160.8 37.88 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 123.478 0.486 . . . . 0.0 110.6 -177.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.7 t -70.55 -30.89 67.74 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.909 -0.495 . . . . 0.0 110.992 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -152.93 170.82 19.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.85 154.8 61.45 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -58.73 148.41 83.06 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 117.469 -1.221 . . . . 0.0 111.902 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 25.6 m -61.41 -22.22 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -155.49 147.2 23.14 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 48.4 9.24 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 120.027 3.343 . . . . 0.0 120.027 172.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.2 p-90 -63.46 -23.11 67.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 114.252 1.205 . . . . 0.0 114.252 -176.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -60.58 -31.35 70.49 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.927 -0.483 . . . . 0.0 112.006 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -58.47 -32.93 69.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.622 0.725 . . . . 0.0 109.873 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.6 mm -69.85 -39.37 77.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.91 -8.02 53.7 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -112.0 2.82 17.06 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.439 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -112.73 133.68 54.63 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.405 0.621 . . . . 0.0 111.426 -178.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 54.2 m -79.39 125.0 28.96 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -86.34 121.05 28.37 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -128.07 139.89 52.27 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 122.024 0.916 . . . . 0.0 113.448 -177.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -140.34 75.27 1.5 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.056 -1.429 . . . . 0.0 108.831 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.13 -110.8 3.6 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 119.575 -1.298 . . . . 0.0 112.331 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.3 p -73.82 10.53 1.11 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.164 0.985 . . . . 0.0 112.941 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.8 t -130.46 142.94 42.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 121.869 -0.52 . . . . 0.0 111.079 -177.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.0 t -142.22 131.52 23.54 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 173.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.8 t -134.02 138.83 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.111 0 CA-C-O 121.942 0.877 . . . . 0.0 110.27 -177.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -111.89 110.07 54.67 Favored Pre-proline 0 N--CA 1.435 -1.178 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.485 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.19 157.68 20.08 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 115.878 -2.281 . . . . 0.0 113.345 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.1 156.76 37.85 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.2 tt -146.88 132.88 12.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.47 0.653 . . . . 0.0 111.517 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.1 119.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.6 136.36 53.12 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.09 -35.95 42.62 Favored Glycine 0 C--O 1.221 -0.669 0 N-CA-C 117.182 1.633 . . . . 0.0 117.182 -174.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -22.54 57.18 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -147.58 40.66 1.01 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.735 1.255 . . . . 0.0 108.631 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.2 tt -48.48 -54.17 15.24 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.0 ttt180 -57.32 -36.19 70.82 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.785 1.175 . . . . 0.0 113.931 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.06 -41.23 64.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.069 0.462 . . . . 0.0 110.425 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -66.04 -39.09 89.89 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.396 1.093 . . . . 0.0 109.362 178.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.424 HD11 HD11 ' A' ' 11' ' ' ILE . 1.1 tm? -62.77 -48.66 78.19 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.316 -176.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -72.33 -16.07 61.88 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.432 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.1 -36.2 55.85 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.407 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.05 -44.08 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.435 0.635 . . . . 0.0 110.443 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -128.5 77.16 77.67 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.931 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -66.69 -16.04 49.25 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 118.195 -0.736 . . . . 0.0 112.896 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.5 m -74.8 -10.52 59.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 178.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -71.35 129.31 38.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.892 0.853 . . . . 0.0 110.868 -178.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -83.95 86.5 7.17 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.704 -177.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 21.6 p -67.24 -13.59 62.12 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.748 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -73.58 -29.43 62.41 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.404 0.621 . . . . 0.0 110.441 176.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -88.47 -29.17 20.36 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.054 0.931 . . . . 0.0 109.412 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 88.5 m -129.17 66.63 1.44 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.224 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.6 m -65.03 144.23 57.41 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -67.24 -24.0 65.76 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.837 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -59.33 -22.38 61.19 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.666 0.746 . . . . 0.0 110.971 176.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -106.97 11.42 29.84 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.342 -177.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -77.87 117.89 19.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 15.2 m -144.02 153.11 41.88 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 34.2 p90 -66.23 -30.07 70.44 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -72.65 -44.95 61.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.617 0.723 . . . . 0.0 110.084 175.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -61.77 -24.3 66.75 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.99 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.36 -30.86 69.82 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -68.28 -39.54 82.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.4 mtt -68.16 -28.92 67.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.71 -35.21 79.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.342 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -65.27 -49.54 69.19 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 178.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -60.38 -42.15 95.24 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.492 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -61.46 -40.72 95.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.66 -43.46 93.55 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 70.4 mt -65.02 -37.94 89.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.164 0.507 . . . . 0.0 110.148 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 35.4 m -69.25 -34.67 75.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.409 0.623 . . . . 0.0 110.382 177.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.28 -45.88 78.93 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.353 -178.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.7 p -63.78 -34.04 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.068 0.849 . . . . 0.0 110.959 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -65.38 -46.97 78.01 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -66.33 -29.89 70.17 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.12 0.486 . . . . 0.0 111.431 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 39.2 tp60 -58.35 -28.37 65.04 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 121.185 -0.947 . . . . 0.0 109.463 177.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.26 -36.08 76.75 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.865 -0.522 . . . . 0.0 111.021 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' GLU . . . . . 0.412 ' HA ' ' HE2' ' A' ' 166' ' ' LYS . 16.9 pt-20 -76.78 -33.6 58.03 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -66.59 -31.49 72.23 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.389 176.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.403 ' HE ' ' CD ' ' A' ' 168' ' ' GLU . 0.0 OUTLIER -53.22 -28.72 28.53 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -177.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 163' ' ' GLU . 15.1 mttm -67.27 -45.94 75.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.464 -179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 36.5 p -77.28 -28.42 53.4 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 122.24 -0.288 . . . . 0.0 111.762 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.403 ' CD ' ' HE ' ' A' ' 165' ' ' ARG . 35.0 tt0 -60.32 -24.2 64.82 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.911 0.885 . . . . 0.0 112.54 -178.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.93 -14.22 59.31 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -75.2 125.13 28.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.061 0.457 . . . . 0.0 110.087 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 48.8 t -68.94 123.72 23.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.2 167.79 26.7 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -138.36 152.65 48.63 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 38.1 t-20 -140.26 80.07 1.74 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.186 0.517 . . . . 0.0 111.103 -178.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 77.15 -168.73 54.77 Favored Glycine 0 CA--C 1.518 0.225 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.513 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -153.62 174.26 14.7 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.88 136.89 52.95 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 104.464 -2.421 . . . . 0.0 104.464 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -145.52 143.83 30.19 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -142.98 134.79 26.75 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -117.31 148.91 41.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -154.43 134.79 13.33 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.601 0.223 . . . . 0.0 111.601 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -162.72 167.24 23.33 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 104.477 -2.416 . . . . 0.0 104.477 176.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -115.93 -33.54 5.06 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.57 150.8 0.07 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.068 1.347 . . . . 0.0 113.81 -177.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 . . . . . 0 C--O 1.253 1.242 0 N-CA-C 104.473 -2.417 . . . . 0.0 104.473 179.828 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpt? . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -150.83 167.36 27.73 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.1 tp -55.73 -46.38 77.78 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.62 -37.96 80.04 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.905 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -62.52 -35.9 80.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.545 -175.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -62.52 -48.28 80.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 21.0 m -69.35 -37.33 77.6 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.412 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -57.17 -51.3 69.86 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.518 0.727 . . . . 0.0 110.296 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -69.29 -29.75 67.69 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.625 -0.672 . . . . 0.0 111.098 178.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -68.48 -36.06 78.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.814 -0.554 . . . . 0.0 111.044 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.491 HD11 HD11 ' A' ' 125' ' ' LEU . 13.9 mm -72.34 -38.88 62.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.86 84.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.0 95.41 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.612 178.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -60.67 -45.6 93.52 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 122.708 0.403 . . . . 0.0 110.619 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.11 -46.32 78.03 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.711 0.291 . . . . 0.0 110.562 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.57 -37.91 80.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.951 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -63.98 -31.87 73.21 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.997 -0.439 . . . . 0.0 110.479 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.2 t -79.17 9.42 4.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 122.883 0.473 . . . . 0.0 111.52 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 92.17 1.05 70.07 Favored Glycine 0 N--CA 1.453 -0.189 0 N-CA-C 116.295 1.278 . . . . 0.0 116.295 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -64.74 126.08 26.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.278 1.039 . . . . 0.0 109.454 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.93 132.11 11.58 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.8 t -77.34 117.51 22.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.45 HD11 HD22 ' A' ' 43' ' ' LEU . 63.4 mt -87.02 -47.01 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -149.78 123.15 9.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.297 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.23 105.27 4.99 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 104.137 -2.542 . . . . 0.0 104.137 173.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -125.79 -79.54 0.35 Allowed Glycine 0 CA--C 1.504 -0.595 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -87.59 174.5 8.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.239 0.543 . . . . 0.0 110.641 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.7 m -83.65 12.03 6.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.685 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -95.14 -43.86 7.91 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -176.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -141.92 150.36 41.38 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -178.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.3 mt -138.19 127.65 33.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -103.6 130.0 50.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.51 138.13 54.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 123.626 0.77 . . . . 0.0 110.239 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -92.37 134.72 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 112.12 15.42 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 122.133 0.173 . . . . 0.0 110.74 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.81 -26.98 9.14 Favored 'Trans proline' 0 C--N 1.352 0.759 0 N-CA-C 114.932 1.089 . . . . 0.0 114.932 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -73.77 -5.02 38.22 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 57.62 42.19 24.38 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -176.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 p -70.0 -177.68 1.4 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 113.338 -1.755 . . . . 0.0 112.367 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.1 m -56.18 -30.36 62.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.091 176.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' A' ' 81' ' ' LYS . 84.3 m-70 -92.78 134.54 34.95 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -78.53 -45.45 21.88 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.45 HD22 HD11 ' A' ' 23' ' ' ILE . 84.6 mt -141.84 164.74 29.37 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.548 -174.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 85.6 t -133.59 138.88 50.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -121.91 128.15 51.23 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -98.17 131.97 44.09 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -136.19 141.31 44.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 118.134 0.425 . . . . 0.0 110.204 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.8 95.59 4.48 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -176.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -151.67 146.26 25.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 178.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -86.7 151.57 23.29 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.3 mt -138.73 129.12 25.86 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 122.251 0.22 . . . . 0.0 110.645 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -91.51 -37.3 13.22 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.974 0.416 . . . . 0.0 110.302 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -129.56 147.79 51.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.422 ' HD2' HD11 ' A' ' 99' ' ' ILE . 24.2 ptt-85 -65.38 -22.16 66.76 Favored 'General case' 0 CA--C 1.507 -0.708 0 O-C-N 121.645 -0.659 . . . . 0.0 111.945 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -62.09 -31.04 71.43 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.01 -39.35 63.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.7 ttm -62.51 -50.48 71.24 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.489 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.9 m -60.36 -31.97 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.39 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -69.16 -34.0 74.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.664 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -63.99 -40.7 96.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.403 0.62 . . . . 0.0 109.669 177.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.431 HG23 HG11 ' A' ' 111' ' ' VAL . 3.1 mt -70.88 -33.3 51.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.777 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -62.61 -32.75 73.82 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 176.21 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -67.91 -49.88 59.35 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.42 -39.25 70.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.231 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.97 -37.28 81.88 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.06 -42.22 80.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.602 0.715 . . . . 0.0 109.186 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -62.43 -42.49 99.49 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.407 0.622 . . . . 0.0 109.738 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.73 -42.96 83.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.953 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -66.99 -33.47 75.64 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.101 -179.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -41.78 86.81 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 176.366 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 95.3 t -73.02 -38.76 56.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.49 -35.33 77.37 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.288 -0.882 . . . . 0.0 111.595 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 -58.33 -39.94 80.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 109.87 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -73.41 -20.67 60.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.0 mp -106.01 -15.73 14.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.09 4.43 42.46 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.778 1.071 . . . . 0.0 115.778 178.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -76.89 135.63 38.83 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.632 -0.922 . . . . 0.0 109.338 -178.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -66.84 -20.66 65.97 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 -175.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.424 HH21 ' CD ' ' A' ' 105' ' ' GLU . 40.6 ttt180 -152.06 154.08 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.6 151.39 50.25 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 177.038 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.429 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 85.7 mttt -126.11 117.46 23.21 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 170.309 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -116.81 126.75 53.53 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.69 123.92 34.68 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 176.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -119.26 109.64 16.07 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.83 112.84 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -176.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.16 133.03 35.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 122.87 0.468 . . . . 0.0 110.066 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -108.38 110.12 21.6 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 95.0 p -130.89 152.75 49.88 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 24.1 m -67.22 -46.51 73.6 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.864 0.84 . . . . 0.0 109.226 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -147.24 161.11 41.6 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.96 158.65 34.63 Favored Pre-proline 0 C--N 1.312 -1.058 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.797 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -54.02 150.84 29.54 Favored 'Trans proline' 0 C--N 1.349 0.563 0 N-CA-C 116.254 1.598 . . . . 0.0 116.254 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.5 m -76.5 -11.96 14.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.88 101.66 8.03 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 40.14 27.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 119.442 3.127 . . . . 0.0 119.442 172.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.4 p-90 -59.72 -20.97 59.86 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.47 -0.769 . . . . 0.0 112.88 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -60.08 -31.29 69.88 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -175.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -66.15 -34.63 78.48 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.422 HD11 ' HD2' ' A' ' 54' ' ' ARG . 11.7 mm -65.37 -43.89 94.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.502 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.33 -1.27 20.08 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -111.98 -2.82 14.99 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -103.31 115.23 30.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.91 -175.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.1 m -68.24 126.59 30.03 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 172.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -88.32 128.05 35.49 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.424 ' CD ' HH21 ' A' ' 79' ' ' ARG . 8.0 mt-10 -126.91 140.65 52.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.453 0.644 . . . . 0.0 111.433 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -140.87 75.49 1.51 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.179 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.89 -111.97 4.14 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 119.897 -1.144 . . . . 0.0 111.609 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 41.1 p -80.23 13.21 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.83 137.97 55.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.0 m -133.58 133.6 42.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.431 HG11 HG23 ' A' ' 61' ' ' ILE . 84.2 t -123.59 138.58 52.93 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.875 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -102.46 99.64 13.62 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.84 120.01 2.99 Favored 'Trans proline' 0 C--N 1.349 0.597 0 CA-C-O 121.395 0.498 . . . . 0.0 113.035 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -127.22 145.4 50.78 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.5 tt -138.72 139.16 41.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.3 m -116.83 133.71 62.68 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-O 122.109 0.957 . . . . 0.0 108.484 174.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.46 152.64 27.27 Favored 'General case' 0 C--O 1.207 -1.152 0 CA-C-N 114.363 -1.289 . . . . 0.0 108.456 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.4 -41.21 8.55 Favored Glycine 0 C--N 1.317 -0.509 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.8 t -61.74 -26.19 67.91 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 27.0 ptm -131.41 32.87 4.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.201 1.001 . . . . 0.0 110.573 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 28.1 tp -51.3 -41.49 60.53 Favored 'General case' 0 C--O 1.211 -0.959 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -174.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.744 -176.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -78.37 -40.14 37.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.618 0.723 . . . . 0.0 111.936 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.49 -39.06 85.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.5 0.667 . . . . 0.0 112.508 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.491 HD11 HD11 ' A' ' 11' ' ' ILE . 3.0 tm? -63.47 -43.32 97.66 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.061 -0.399 . . . . 0.0 111.268 -177.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -72.58 -14.7 61.68 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.678 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.2 -32.09 62.91 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.3 t -92.08 -43.65 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-O 121.245 0.545 . . . . 0.0 110.264 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -124.66 78.05 63.73 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.187 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.11 -11.17 31.03 Favored 'Trans proline' 0 C--N 1.346 0.446 0 N-CA-C 114.197 0.807 . . . . 0.0 114.197 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 19.3 t -78.0 -14.85 59.37 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.278 0.561 . . . . 0.0 110.426 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -80.88 124.93 29.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.314 0.578 . . . . 0.0 110.254 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 38.3 mtp-105 -78.31 130.41 36.16 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 26.2 p -66.5 -20.14 65.96 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.019 0.438 . . . . 0.0 111.607 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -58.76 -30.26 67.4 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 123.408 0.683 . . . . 0.0 111.203 178.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.79 -16.96 64.62 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 96.7 m -128.0 70.49 1.35 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -178.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.2 m -75.15 144.44 42.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.1 -31.62 72.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.124 0.488 . . . . 0.0 111.635 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -62.45 -28.46 69.83 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.687 0.756 . . . . 0.0 111.103 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -86.01 -11.69 52.25 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.936 -179.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -76.28 91.56 3.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.643 0.735 . . . . 0.0 112.334 -176.019 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.8 t -131.2 152.08 50.84 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -58.5 -38.96 78.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.007 0.432 . . . . 0.0 111.155 -177.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.417 ' H ' ' HG2' ' A' ' 145' ' ' GLU . 3.8 pt-20 -72.58 -41.06 66.09 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 122.312 -0.243 . . . . 0.0 110.981 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 52.7 m-20 -62.59 -30.83 71.62 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.791 0.329 . . . . 0.0 110.667 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.19 90.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.81 0.338 . . . . 0.0 110.608 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.37 -43.46 70.08 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 74.4 mtp -61.35 -27.61 68.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.265 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.859 -0.526 . . . . 0.0 110.683 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -64.41 -45.95 85.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.08 -42.54 94.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.42 0.628 . . . . 0.0 110.184 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 70.5 mmt-85 -66.5 -40.16 89.1 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.814 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -62.68 -42.52 99.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.229 0.468 . . . . 0.0 111.262 176.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.34 -39.42 94.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 84.8 p -71.58 -27.84 63.42 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.744 -0.598 . . . . 0.0 110.804 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.1 tt -72.33 -43.29 64.33 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.838 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 8.8 p -63.62 -36.19 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 118.935 0.789 . . . . 0.0 108.883 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.18 -40.91 90.83 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm -66.98 -36.5 82.32 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.698 -0.627 . . . . 0.0 111.487 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.14 -28.64 69.9 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -35.66 80.68 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -76.87 -42.99 37.8 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.794 -0.566 . . . . 0.0 110.431 176.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -60.73 -40.39 92.17 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.465 ' HA ' ' HB2' ' A' ' 168' ' ' GLU . 8.6 ptm180 -62.98 -17.81 62.53 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -68.6 -43.53 76.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 38.9 p -76.01 -33.6 59.69 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.84 0.352 . . . . 0.0 110.618 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 165' ' ' ARG . 0.7 OUTLIER -61.92 -24.08 66.74 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 179.376 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.34 -14.06 35.64 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.62 150.8 48.51 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.622 0.725 . . . . 0.0 109.704 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 23.1 t -87.4 88.97 2.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 O-C-N 121.683 -0.636 . . . . 0.0 110.724 -178.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -129.73 -25.21 2.62 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 64.3 -56.09 0.25 Allowed 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 50.2 t30 56.88 36.45 27.76 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 113.496 0.925 . . . . 0.0 113.496 -177.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 89.54 -172.69 39.55 Favored Glycine 0 C--O 1.221 -0.698 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.096 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -152.57 142.71 22.35 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 122.056 -0.673 . . . . 0.0 110.697 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 65.6 tp -104.04 129.52 51.67 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 103.596 -2.742 . . . . 0.0 103.596 172.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -147.39 146.44 29.62 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.046 0.384 . . . . 0.0 111.092 -176.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.32 133.38 24.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 177.334 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -122.68 167.91 12.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 60.61 119.86 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 117.786 2.513 . . . . 0.0 117.786 176.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 63.2 tp -135.72 144.17 45.74 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 103.971 -2.604 . . . . 0.0 103.971 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 35.8 p90 -83.57 156.94 22.51 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 -178.298 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -145.26 64.42 1.27 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 . . . . . 0 C--O 1.241 0.632 0 N-CA-C 104.652 -2.351 . . . . 0.0 104.652 -176.249 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.496 1.847 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -64.07 -27.74 69.31 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 -175.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.89 -31.03 68.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.129 0.49 . . . . 0.0 111.041 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.62 -46.94 80.47 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.55 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.483 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 8.2 pt-20 -73.81 -29.14 61.99 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.698 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -56.93 -45.46 82.72 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.211 -1.404 . . . . 0.0 107.211 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.9 m -71.66 -44.52 64.15 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.292 0.568 . . . . 0.0 111.519 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.483 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 73.0 t80 -55.51 -51.25 67.65 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 123.873 0.869 . . . . 0.0 113.15 -178.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -68.64 -31.28 70.31 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.98 -0.45 . . . . 0.0 110.341 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -70.84 -35.14 72.32 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.902 -0.499 . . . . 0.0 111.259 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 mm -69.06 -40.75 81.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 176.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.7 90.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.17 84.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.002 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -57.06 -47.28 81.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -68.69 -46.18 69.72 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.544 0.202 . . . . 0.0 111.544 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.11 -44.49 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-O 121.319 0.58 . . . . 0.0 110.153 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -72.44 -7.62 50.78 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -97.97 9.05 43.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.49 -6.17 45.16 Favored Glycine 0 CA--C 1.517 0.202 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 175.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -66.6 133.74 50.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 118.091 0.945 . . . . 0.0 109.598 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.5 115.65 4.36 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 107.47 -2.252 . . . . 0.0 107.47 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.5 p -71.08 130.13 34.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.9 mt -94.34 -42.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 -178.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -147.57 138.48 23.47 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.2 105.1 9.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.92 53.64 5.22 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.385 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.16 -36.76 73.48 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.6 m -166.67 -73.24 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 103.72 -2.696 . . . . 0.0 103.72 173.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -127.33 16.7 7.13 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.84 -1.073 . . . . 0.0 108.536 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -125.64 139.31 53.67 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.857 -1.065 . . . . 0.0 112.919 -172.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 80.8 mt -135.03 133.81 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -112.14 135.61 52.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -131.14 129.95 42.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -83.92 132.73 34.75 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.26 118.85 71.02 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -76.81 -23.99 10.44 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 117.408 -1.261 . . . . 0.0 115.089 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -75.49 -17.95 59.97 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -177.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt 61.03 37.77 17.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.484 1.135 . . . . 0.0 110.266 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -173.34 0.07 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 112.754 -2.021 . . . . 0.0 110.653 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.8 p -49.88 -42.61 48.21 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 89.1 m-70 -78.8 138.25 38.11 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.068 0.461 . . . . 0.0 111.168 174.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -101.71 -37.2 8.43 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.058 176.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.4 mt -139.78 163.79 31.67 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -172.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -131.52 134.95 60.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 174.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -119.57 113.72 21.15 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 84.9 mt -95.61 125.0 39.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -136.35 130.47 32.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.624 0.193 . . . . 0.0 110.598 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -107.95 114.18 27.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.072 0.463 . . . . 0.0 109.959 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -151.64 142.71 23.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.105 -176.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -93.05 98.72 11.51 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -87.06 103.31 15.25 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.946 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -68.49 -42.6 78.42 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.784 0.802 . . . . 0.0 111.958 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -121.71 156.4 33.17 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.859 -0.525 . . . . 0.0 111.478 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -66.73 -16.06 63.98 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.147 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -63.74 -40.16 96.06 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -69.96 -36.73 75.48 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 55.7 ttm -61.33 -50.24 73.74 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.86 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.7 m -70.09 -31.95 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.243 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 -66.9 -34.65 78.25 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.206 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -64.56 -33.97 77.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mm -71.84 -30.89 39.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 O-C-N 121.634 -0.666 . . . . 0.0 110.956 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -64.23 -40.34 95.85 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.38 -44.25 91.95 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 121.935 0.874 . . . . 0.0 109.21 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -62.68 -39.67 94.69 Favored 'General case' 0 C--O 1.206 -1.222 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.233 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.49 -40.44 82.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 118.998 0.817 . . . . 0.0 111.518 -177.124 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -66.8 -41.47 87.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.565 0.697 . . . . 0.0 109.832 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.78 -47.29 84.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.522 0.677 . . . . 0.0 110.141 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.86 -42.64 97.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.258 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.42 -31.7 72.07 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 119.97 1.259 . . . . 0.0 111.401 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -64.72 -44.1 91.31 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.2 t -68.99 -36.03 71.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.185 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ttp-105 -59.24 -35.2 73.24 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.801 -0.562 . . . . 0.0 110.687 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -62.11 -39.04 91.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -73.4 -39.86 64.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.378 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.28 -17.96 61.26 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.17 -2.98 32.82 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 116.163 1.225 . . . . 0.0 116.163 177.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -71.39 152.6 43.0 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.384 1.092 . . . . 0.0 108.681 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.62 -27.19 61.99 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.795 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -142.03 159.43 42.24 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -122.19 141.78 51.11 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 53.5 tttp -123.35 127.95 49.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.4 tp -129.3 123.71 32.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -86.46 109.43 19.06 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -98.84 127.54 44.79 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 22.7 t -124.21 113.5 36.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-O 121.169 0.509 . . . . 0.0 111.469 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -84.18 142.81 30.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.78 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.55 109.82 16.16 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 173.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.0 p -125.59 161.09 27.99 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -173.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.3 m -67.17 -49.28 65.29 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -148.72 156.88 42.97 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 101.798 -3.408 . . . . 0.0 101.798 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.29 159.19 86.05 Favored Pre-proline 0 C--N 1.313 -0.989 0 O-C-N 124.268 0.98 . . . . 0.0 109.294 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.16 154.12 29.82 Favored 'Trans proline' 0 C--N 1.353 0.765 0 N-CA-C 115.081 1.147 . . . . 0.0 115.081 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.1 m -63.26 -24.48 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 118.089 2.626 . . . . 0.0 118.089 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -155.44 145.03 21.2 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 t0 45.88 19.48 0.06 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 117.896 2.554 . . . . 0.0 117.896 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 29.9 p-90 -76.08 -23.54 55.01 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 120.864 -1.147 . . . . 0.0 111.967 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.65 -37.7 76.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -18.4 64.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 111.832 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.7 mm -72.93 -40.17 59.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.88 0.61 17.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.153 0.501 . . . . 0.0 111.566 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -111.85 3.13 17.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.426 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -122.17 155.87 34.89 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.293 0.568 . . . . 0.0 111.396 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -102.0 126.04 48.82 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -83.46 112.56 20.07 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -118.29 123.14 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.518 0.675 . . . . 0.0 112.337 -176.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -124.24 75.49 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.57 -112.32 4.89 Favored Glycine 0 C--O 1.226 -0.401 0 C-N-CA 119.912 -1.137 . . . . 0.0 111.504 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 50.9 p -72.85 11.92 0.6 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 87.5 t -127.83 140.51 48.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 -178.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.2 p -138.05 125.39 21.8 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 105.77 -1.937 . . . . 0.0 105.77 169.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -128.85 133.4 66.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -113.45 116.74 45.94 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.74 156.13 27.47 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 118.109 -0.794 . . . . 0.0 112.892 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -147.54 155.05 41.48 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 102.889 -3.004 . . . . 0.0 102.889 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 16.3 tt -145.98 138.58 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.262 0.553 . . . . 0.0 109.733 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 8.2 m -115.9 142.06 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.868 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 172.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.95 150.72 40.05 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.593 -2.373 . . . . 0.0 104.593 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.98 -22.68 64.99 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.339 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.0 p -72.83 -30.05 63.72 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -176.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 mtm -129.25 20.84 5.75 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.378 0.609 . . . . 0.0 110.593 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.4 tt -42.18 -42.49 3.02 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 116.817 2.154 . . . . 0.0 116.817 -173.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 52.4 ptt85 -62.82 -40.53 97.68 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.632 -0.667 . . . . 0.0 111.934 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -78.66 -40.11 35.0 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.705 0.764 . . . . 0.0 109.867 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -59.22 -42.72 91.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.484 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.3 mt -62.22 -43.5 98.68 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -75.35 -14.14 60.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.965 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.59 -39.74 62.03 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.417 HG13 ' CD1' ' A' ' 129' ' ' PHE . 5.7 p -95.8 -38.54 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' PHE . . . . . 0.417 ' CD1' HG13 ' A' ' 128' ' ' VAL . 49.1 m-85 -125.21 77.32 67.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 123.14 0.576 . . . . 0.0 110.393 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.49 -7.45 20.31 Favored 'Trans proline' 0 C--N 1.345 0.393 0 N-CA-C 114.211 0.812 . . . . 0.0 114.211 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.4 m -92.67 1.68 57.13 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -81.45 140.37 34.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.061 0.458 . . . . 0.0 110.237 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -84.06 94.81 8.4 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.3 p -62.93 -21.25 65.92 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -61.75 -27.18 68.55 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.075 0.465 . . . . 0.0 111.282 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -68.66 -16.15 63.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.571 0.7 . . . . 0.0 110.222 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 72.4 m -113.87 25.77 10.91 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.003 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 59.7 m -62.74 155.99 25.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.62 -28.45 67.22 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -66.22 -15.95 63.6 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 177.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -119.1 -1.84 10.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.996 0.427 . . . . 0.0 110.981 -177.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -86.09 34.85 0.62 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -173.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 43.3 t -65.06 144.06 57.51 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 177.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -66.75 -28.93 68.81 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -68.97 -26.39 65.02 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.711 0.767 . . . . 0.0 109.983 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -65.53 -19.67 66.02 Favored 'General case' 0 C--O 1.216 -0.672 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.164 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.19 81.4 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 122.057 -0.402 . . . . 0.0 110.188 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.43 -43.99 84.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 38.0 mmt -62.63 -36.7 83.64 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.412 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.25 -41.98 85.42 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.101 -0.374 . . . . 0.0 110.288 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -65.2 -50.41 66.0 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.791 0.329 . . . . 0.0 110.311 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -61.18 -41.86 97.54 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.378 0.608 . . . . 0.0 111.669 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -67.49 -36.49 81.2 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.84 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -62.33 -44.67 95.96 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.253 0.933 . . . . 0.0 111.365 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.61 -38.51 87.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 19.5 m -69.98 -35.2 74.25 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.448 0.642 . . . . 0.0 111.428 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.92 -37.7 86.76 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 123.794 0.838 . . . . 0.0 110.514 -178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.2 t -57.45 -47.29 85.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.51 -38.41 80.9 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.487 0.66 . . . . 0.0 109.914 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -63.27 -30.59 71.7 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.908 -0.495 . . . . 0.0 112.271 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -26.66 66.01 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 117.983 0.356 . . . . 0.0 111.768 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -61.81 -39.97 93.63 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.515 0.674 . . . . 0.0 110.221 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 -67.32 -35.32 79.18 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 57.3 mm-40 -70.88 -31.49 68.17 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -50.56 -40.16 51.31 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -175.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -63.09 -17.78 62.68 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 81.8 p -68.85 -16.54 63.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.13 -24.33 67.09 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.829 0.347 . . . . 0.0 111.082 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -59.25 -14.02 9.69 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -79.52 -1.34 37.21 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.8 t 50.93 57.17 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 173.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -144.81 151.23 38.48 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 121.61 -0.681 . . . . 0.0 110.217 176.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -164.31 167.88 19.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -108.7 8.43 26.88 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.811 0.339 . . . . 0.0 111.019 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 79.61 -169.28 53.35 Favored Glycine 0 N--CA 1.454 -0.142 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 -176.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 23.7 pttp -148.29 165.07 32.11 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -128.26 160.12 33.12 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 104.708 -2.33 . . . . 0.0 104.708 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -143.69 163.55 32.95 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -121.11 21.09 11.36 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -65.89 121.15 14.41 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -138.47 98.64 3.63 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.305 0.574 . . . . 0.0 110.301 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 61.97 -160.05 0.31 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -176.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -158.39 160.17 36.6 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -143.82 152.04 40.69 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 . . . . . 0 C--O 1.249 1.044 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -177.355 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 ptp . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 120.738 0.304 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -136.74 158.06 45.32 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.41 -40.63 89.7 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.57 -33.22 75.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.359 0.599 . . . . 0.0 111.82 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.28 -30.07 71.28 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -62.06 -41.07 97.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.482 ' HA ' ' HE3' ' A' ' 10' ' ' LYS . 44.6 m -69.41 -44.11 72.06 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.461 -0.149 . . . . 0.0 110.973 176.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -52.35 -47.4 66.11 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.588 0.355 . . . . 0.0 110.557 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -67.8 -43.47 79.58 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 7' ' ' THR . 19.9 pttp -73.51 -25.31 60.37 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.029 -1.044 . . . . 0.0 112.243 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.0 mm -72.31 -38.6 61.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 174.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.23 -40.91 78.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.5 -42.67 99.14 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.504 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -34.18 75.92 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.745 -0.597 . . . . 0.0 112.45 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.8 -44.46 63.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.9 t -53.64 -42.73 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.149 171.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.51 -31.07 70.14 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.72 -0.613 . . . . 0.0 110.66 178.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.3 m -82.56 9.31 9.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.17 1.26 62.9 Favored Glycine 0 CA--C 1.517 0.173 0 N-CA-C 115.827 1.091 . . . . 0.0 115.827 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.429 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 32.7 m-85 -71.04 126.6 30.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.773 0.787 . . . . 0.0 109.662 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.23 113.72 3.78 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 107.338 -2.305 . . . . 0.0 107.338 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.9 p -70.31 128.67 33.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 75.8 mt -86.78 -38.84 12.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -144.16 134.64 24.68 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.29 140.91 35.79 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.38 -30.08 6.4 Favored Glycine 0 CA--C 1.506 -0.516 0 N-CA-C 107.75 -2.14 . . . . 0.0 107.75 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.476 ' HG3' ' H ' ' A' ' 30' ' ' GLU . 10.9 tp10 -68.3 136.27 53.21 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 174.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.6 m -98.5 -18.26 18.3 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -87.37 -47.93 8.39 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.502 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' A' ' 27' ' ' GLU . 15.5 pt-20 -135.11 137.18 42.56 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -178.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.4 mt -125.3 131.5 72.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -111.38 139.57 46.68 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.01 129.73 42.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.997 0.919 . . . . 0.0 108.742 -177.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -82.05 130.61 35.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.72 113.03 22.91 Favored Pre-proline 0 CA--C 1.549 0.904 0 CA-C-N 117.715 0.234 . . . . 0.0 110.486 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 88.0 Cg_endo -74.7 -18.71 19.32 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 117.825 -0.983 . . . . 0.0 113.36 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.84 -23.34 60.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.851 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.0 mttt 60.42 38.84 19.11 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.2 p -71.7 -177.63 1.98 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 112.963 -1.926 . . . . 0.0 112.103 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.9 m -61.26 -10.01 6.09 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.345 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.68 132.32 54.29 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.33 -40.56 10.85 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -174.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -139.16 162.12 35.73 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.59 135.47 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 35.0 ttt-85 -124.66 116.31 22.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.519 0.728 . . . . 0.0 109.828 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.31 132.15 36.35 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 103.39 -2.818 . . . . 0.0 103.39 175.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -136.53 136.03 39.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.826 0.285 . . . . 0.0 110.901 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.53 113.55 27.19 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.787 -0.571 . . . . 0.0 110.543 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -151.62 149.88 29.65 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -108.34 131.42 54.75 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.5 mt -124.1 120.62 32.9 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -171.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -88.49 -37.81 15.48 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.887 0.851 . . . . 0.0 111.585 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -129.67 144.71 51.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.727 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -64.33 -17.54 63.78 Favored 'General case' 0 C--O 1.215 -0.736 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -60.75 -33.33 72.77 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.518 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -77.65 -34.91 52.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.065 0.459 . . . . 0.0 110.209 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.0 ttt -60.81 -48.83 80.0 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.559 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.2 m -66.31 -31.84 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.433 0.635 . . . . 0.0 110.086 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -38.21 87.15 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.198 -177.278 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -62.36 -38.99 91.68 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.3 mm -68.66 -31.81 52.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.949 -0.47 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -61.66 -39.48 91.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -44.32 58.17 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.689 0.757 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -59.53 -39.74 84.92 Favored 'General case' 0 C--O 1.21 -0.989 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.097 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.86 90.65 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.576 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -70.92 -35.95 72.46 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 119.887 -0.725 . . . . 0.0 109.759 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.83 -44.77 96.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.2 t -66.9 -39.76 84.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -62.21 -33.53 74.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 119.654 1.116 . . . . 0.0 111.187 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.8 ttt-85 -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -69.03 -37.41 77.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.935 0.398 . . . . 0.0 110.014 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -41.35 88.13 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.855 -0.528 . . . . 0.0 111.052 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -66.79 -40.11 88.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -63.48 -40.19 96.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.022 0.439 . . . . 0.0 110.861 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -78.02 -13.96 59.68 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.65 1.47 38.06 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -68.36 156.28 38.1 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.008 -0.701 . . . . 0.0 110.082 -177.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -39.35 93.85 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -149.41 167.99 24.65 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 103.453 -2.795 . . . . 0.0 103.453 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 ttp -129.18 147.97 51.08 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 118.746 0.703 . . . . 0.0 109.979 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -116.33 123.7 48.27 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 123.521 0.513 . . . . 0.0 110.559 177.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.4 tp -116.87 128.12 54.94 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.253 0.346 . . . . 0.0 111.405 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -91.32 110.83 22.13 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -102.54 129.12 48.99 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 32.6 t -121.05 109.38 25.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -76.84 142.95 40.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -119.35 107.62 13.59 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 172.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 97.7 p -126.74 155.65 42.41 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.33 -171.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 18.2 m -67.09 -47.91 69.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -147.0 158.19 43.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.813 -2.662 . . . . 0.0 103.813 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.92 157.14 39.83 Favored Pre-proline 0 C--N 1.312 -1.025 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.087 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -55.08 143.73 72.53 Favored 'Trans proline' 0 C--N 1.347 0.46 0 N-CA-C 116.374 1.644 . . . . 0.0 116.374 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.47 -21.72 15.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.638 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -90.81 91.98 8.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.872 178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.9 t0 14.88 70.98 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 117.773 2.509 . . . . 0.0 117.773 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -74.01 -16.85 61.04 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.608 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.75 -35.22 79.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.224 -0.298 . . . . 0.0 110.553 -175.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -60.81 -23.54 65.14 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.825 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.1 mm -79.04 -44.46 24.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 -176.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.04 -1.58 23.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.256 0.55 . . . . 0.0 111.917 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -108.59 5.35 24.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.503 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -124.72 132.27 53.39 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.153 0.502 . . . . 0.0 110.872 178.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -77.68 125.2 28.98 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 173.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -82.71 120.6 25.79 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -126.23 127.64 45.97 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.793 0.806 . . . . 0.0 110.008 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -139.3 114.71 9.79 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 60.21 -126.45 41.49 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 119.968 -1.11 . . . . 0.0 111.439 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.0 p -96.3 29.05 2.98 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.11 -0.641 . . . . 0.0 111.065 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 48.5 t -124.61 145.52 31.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.852 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.9 m -132.6 134.95 45.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.66 138.95 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.786 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 109.06 60.48 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -87.94 63.95 3.55 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.151 2.567 . . . . 0.0 117.171 -175.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 156.68 38.98 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.819 -0.551 . . . . 0.0 110.589 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -147.91 142.36 19.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 O-C-N 121.887 -0.508 . . . . 0.0 110.116 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.4 t -117.69 120.84 65.93 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.29 136.22 40.52 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.303 0.573 . . . . 0.0 109.857 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.45 -34.93 91.23 Favored Glycine 0 CA--C 1.51 -0.232 0 N-CA-C 114.868 0.707 . . . . 0.0 114.868 -176.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.2 t -53.16 -26.8 18.31 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.9 ptm -140.56 32.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.634 0.73 . . . . 0.0 109.808 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -46.64 -36.55 7.13 Favored 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 mtm180 -58.36 -46.99 85.23 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 121.496 -0.752 . . . . 0.0 111.175 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -78.65 -38.66 38.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.103 0.954 . . . . 0.0 111.922 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.63 -35.43 72.93 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.37 -41.05 73.61 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.887 -0.508 . . . . 0.0 110.684 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -69.3 -16.14 63.5 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.629 -177.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.82 65.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.067 0.461 . . . . 0.0 109.836 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.8 t -97.57 -43.84 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.457 0.646 . . . . 0.0 110.643 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -129.47 78.14 76.15 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.113 -178.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.05 -12.67 34.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 CA-C-O 121.381 0.492 . . . . 0.0 112.998 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -11.59 59.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -94.92 124.93 39.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.215 0.531 . . . . 0.0 111.164 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 -86.39 117.96 25.52 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 24.2 p -66.97 -24.12 66.02 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.161 -0.337 . . . . 0.0 110.985 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -65.04 -31.63 72.94 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 178.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -59.69 -35.17 73.94 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.283 0.563 . . . . 0.0 109.987 -177.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -169.97 116.44 0.55 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 175.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.4 t -115.05 158.52 22.0 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -68.23 -19.72 64.76 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.302 0.572 . . . . 0.0 109.744 177.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -66.11 -12.13 53.55 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.242 177.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -119.22 24.42 10.75 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -133.52 175.93 8.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 122.065 0.936 . . . . 0.0 112.264 -176.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.3 t -144.75 173.28 11.98 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 102.259 -3.237 . . . . 0.0 102.259 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -62.38 -28.81 70.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 118.016 0.371 . . . . 0.0 111.566 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -68.41 -31.21 70.38 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.435 0.636 . . . . 0.0 111.89 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -63.01 -24.53 67.96 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.935 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.21 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.625 0.25 . . . . 0.0 110.567 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -66.38 -35.53 80.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.499 0.666 . . . . 0.0 109.348 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 77.0 mtp -71.04 -30.8 67.08 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.787 -0.571 . . . . 0.0 109.998 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -70.95 -30.41 66.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -61.19 -52.22 65.73 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.4 -37.2 86.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.536 0.684 . . . . 0.0 110.449 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -60.01 -46.87 88.06 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.036 176.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -65.88 -41.86 91.07 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.97 -36.88 82.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 29.3 m -76.12 -32.94 59.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.56 0.695 . . . . 0.0 112.21 176.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -62.31 -42.78 99.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -176.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.5 p -57.73 -39.18 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.829 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -74.02 -42.6 60.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 110.027 176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -59.96 -32.1 70.49 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -56.61 -28.2 59.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.32 -39.39 75.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.026 0.441 . . . . 0.0 110.497 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -76.85 -36.26 56.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.179 0.514 . . . . 0.0 110.924 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -66.04 -49.8 66.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.979 0.419 . . . . 0.0 111.224 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -17.72 63.74 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.492 -0.483 . . . . 0.0 111.144 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -69.17 -46.81 66.59 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 23.6 p -72.55 -33.06 66.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.966 -0.293 . . . . 0.0 111.539 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -67.27 -24.32 65.77 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.042 0.448 . . . . 0.0 111.752 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.92 -14.14 51.16 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.48 149.39 34.48 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 24.6 t -78.58 96.24 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.43 0.633 . . . . 0.0 112.059 -176.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -151.03 165.23 34.41 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 174.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -158.07 164.73 36.4 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -156.74 164.6 37.94 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 177.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -78.31 146.29 30.25 Favored Glycine 0 N--CA 1.452 -0.274 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -153.21 163.49 39.79 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 104.861 -2.274 . . . . 0.0 104.861 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 45.6 tp -130.68 -97.43 0.34 Allowed 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 174.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 51.05 34.57 11.08 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 177.083 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -136.07 135.64 39.52 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.084 -0.385 . . . . 0.0 110.104 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -142.8 156.19 44.93 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 175.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -154.48 103.09 2.46 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -179.009 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 27.3 tp -130.9 144.43 51.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.238 0.542 . . . . 0.0 110.11 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -106.03 84.91 2.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.193 -173.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -69.05 -37.67 78.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 31.0 mm100 . . . . . 0 C--O 1.246 0.873 0 CA-C-O 117.558 -1.211 . . . . 0.0 113.195 178.745 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 C--O 1.204 -1.29 0 CA-C-O 118.485 -0.769 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 69.67 141.31 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.633 1.173 . . . . 0.0 112.57 -176.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp -68.43 -35.0 76.99 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.86 -0.525 . . . . 0.0 110.537 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.29 -35.35 78.75 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.81 -27.44 68.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.073 0.464 . . . . 0.0 110.222 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -65.13 -50.67 65.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -64.47 -39.79 94.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.256 0.551 . . . . 0.0 110.309 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -55.42 -52.44 63.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.318 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -71.54 -27.1 62.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.346 -0.846 . . . . 0.0 111.964 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -64.97 -39.52 93.6 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 22.2 mm -71.85 -38.2 64.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 178.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.49 -44.89 81.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 176.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.73 93.23 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.674 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -59.32 -47.03 86.94 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 122.747 0.419 . . . . 0.0 111.585 -179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.7 mt -68.39 -47.31 67.66 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.698 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -57.84 -39.77 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.886 -0.509 . . . . 0.0 110.519 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.32 -25.56 67.95 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 121.871 -0.518 . . . . 0.0 111.276 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -84.77 4.89 30.75 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.796 0.438 . . . . 0.0 111.366 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.14 -1.68 47.38 Favored Glycine 0 CA--C 1.518 0.249 0 N-CA-C 115.939 1.135 . . . . 0.0 115.939 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.452 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.3 m-85 -65.78 129.17 38.84 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 117.736 0.768 . . . . 0.0 110.864 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.3 134.88 13.69 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.6 t -79.38 122.4 34.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 76.7 mt -90.73 -44.96 14.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 176.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -155.0 146.24 22.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 177.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.16 105.17 4.98 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 178.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.85 43.35 7.25 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.993 176.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -57.29 -40.24 77.41 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 p -154.37 -74.74 0.12 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.966 -2.235 . . . . 0.0 104.966 176.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -132.06 15.72 4.67 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.393 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -129.09 151.75 49.43 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.2 mt -134.54 134.78 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -115.1 131.58 56.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -127.62 132.93 49.7 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.655 0.782 . . . . 0.0 109.908 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -86.22 134.84 33.75 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.13 109.75 13.67 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.5 Cg_endo -74.38 -24.41 14.25 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 117.889 -0.941 . . . . 0.0 114.054 -174.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -74.88 -4.45 37.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.859 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt 44.02 40.4 3.35 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 122.948 1.356 . . . . 0.0 111.875 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.3 m -67.21 -172.96 0.24 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 112.621 -2.081 . . . . 0.0 110.613 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.9 t -50.35 -35.72 29.12 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -83.3 138.95 33.34 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 173.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -98.04 -37.84 9.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -142.39 161.59 37.65 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.853 -175.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.5 t -132.55 136.25 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -122.11 130.18 53.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 176.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.06 128.72 54.62 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -136.43 143.56 43.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.87 99.81 6.32 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -151.69 149.47 29.13 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.49 151.56 20.72 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -133.18 124.54 27.63 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.275 0.23 . . . . 0.0 111.468 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -75.96 -42.7 47.7 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -136.04 151.03 49.43 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.203 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -63.98 -18.72 64.57 Favored 'General case' 0 C--O 1.212 -0.881 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -60.61 -33.17 72.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -77.22 -40.92 43.26 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.65 -40.88 89.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.0 -31.85 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 O-C-N 121.79 -0.569 . . . . 0.0 111.256 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -70.65 -34.62 72.24 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.628 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -59.32 -38.66 80.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mm -71.63 -31.31 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 121.99 -0.444 . . . . 0.0 111.457 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -63.07 -39.61 95.22 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -68.19 -45.41 73.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.705 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -58.05 -45.11 87.55 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.189 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.79 -31.18 69.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.56 -45.43 68.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.339 0.59 . . . . 0.0 109.454 177.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -61.51 -44.06 97.74 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.83 0.824 . . . . 0.0 109.299 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 73.6 t -65.73 -32.81 59.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.427 -178.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 121.764 -0.585 . . . . 0.0 109.434 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -62.16 -46.03 90.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.96 0.41 . . . . 0.0 110.273 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 79.7 t -61.74 -40.43 86.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.888 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.412 HH21 ' HB2' ' A' ' 75' ' ' LEU . 2.7 tpm_? -66.48 -40.26 89.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.16 -0.963 . . . . 0.0 111.877 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -55.47 -46.07 76.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -73.41 -18.79 61.11 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.412 ' HB2' HH21 ' A' ' 72' ' ' ARG . 97.3 mt -99.27 -10.04 22.88 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -177.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.81 -1.53 5.71 Favored Glycine 0 CA--C 1.531 1.052 0 N-CA-C 120.935 3.134 . . . . 0.0 120.935 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -67.9 154.19 42.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.161 1.481 . . . . 0.0 108.107 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -65.44 -29.51 70.2 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 ttt85 -151.41 147.92 27.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.48 150.32 23.5 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -134.43 122.22 22.21 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 168.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -124.0 129.74 51.42 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.8 tp -92.29 121.84 34.19 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -115.81 108.57 16.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 5.4 t -108.45 117.34 53.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -84.68 150.58 25.03 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -129.05 116.77 19.81 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -139.59 158.24 44.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.97 0.414 . . . . 0.0 111.887 -174.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 55.0 m -69.23 -49.23 58.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -128.28 170.43 13.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.67 154.17 43.3 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.75 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.15 146.17 89.43 Favored 'Trans proline' 0 C--N 1.348 0.551 0 N-CA-C 114.579 0.953 . . . . 0.0 114.579 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.9 m -82.17 -6.01 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -113.14 100.43 8.59 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.438 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.4 t0 14.43 60.41 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 117.981 2.585 . . . . 0.0 117.981 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 p-90 -73.1 -17.45 61.4 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.99 -32.45 73.99 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.03 -28.38 67.7 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.178 0.514 . . . . 0.0 110.137 175.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.1 mm -75.37 -40.66 42.7 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 O-C-N 122.013 -0.429 . . . . 0.0 110.588 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.11 62.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 122.138 0.97 . . . . 0.0 109.306 177.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -88.6 -3.02 58.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.849 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -126.38 130.39 50.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.754 0.788 . . . . 0.0 112.296 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.3 m -76.41 125.62 29.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -83.3 123.08 29.27 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 176.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -127.65 139.19 52.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.774 0.797 . . . . 0.0 111.649 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -139.97 82.06 1.85 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.627 -1.17 . . . . 0.0 108.928 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.06 -112.66 5.02 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 119.698 -1.239 . . . . 0.0 111.726 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 p -86.2 8.69 20.13 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.76 0.424 . . . . 0.0 111.281 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -110.0 141.37 25.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 122.574 0.35 . . . . 0.0 110.637 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.0 t -135.46 137.4 42.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.104 -2.924 . . . . 0.0 103.104 171.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 99.8 t -133.77 136.5 53.99 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -105.03 104.18 45.51 Favored Pre-proline 0 N--CA 1.433 -1.321 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.467 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.99 147.71 24.2 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 117.387 -1.275 . . . . 0.0 112.191 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 155.91 39.9 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.9 tt -149.81 142.16 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.093 -1.817 . . . . 0.0 106.093 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.35 103.84 15.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.64 138.47 31.44 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.43 -22.92 66.14 Favored Glycine 0 C--N 1.321 -0.29 0 CA-C-N 116.072 -0.513 . . . . 0.0 113.977 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 119' ' ' THR . 22.0 p -59.21 -29.27 67.37 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -177.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.4 ptm -144.65 36.52 1.18 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 109.261 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -44.61 -40.35 5.72 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -173.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -58.24 -51.45 69.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 118.387 0.54 . . . . 0.0 111.411 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -76.99 -34.88 57.49 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.327 0.584 . . . . 0.0 112.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -67.43 -36.27 80.91 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.596 0.712 . . . . 0.0 111.707 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.85 -44.1 77.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.169 -179.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -71.88 -14.29 61.9 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.321 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.23 -26.42 62.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.442 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.1 p -108.73 -37.83 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 120.635 0.255 . . . . 0.0 111.465 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -125.19 75.29 67.92 Favored Pre-proline 0 CA--C 1.536 0.421 0 O-C-N 121.863 -0.523 . . . . 0.0 111.289 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.22 -7.42 21.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 N-CA-C 114.724 1.009 . . . . 0.0 114.724 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 20.3 t -85.85 -5.82 59.18 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.971 -0.456 . . . . 0.0 111.039 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -89.37 130.86 35.67 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 71.8 mtm-85 -86.67 143.31 27.66 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 20.5 p -66.53 -22.99 66.16 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -59.53 -37.27 77.92 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.128 175.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -66.4 -23.57 66.33 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.865 0.364 . . . . 0.0 110.359 -177.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 17.9 t -122.15 54.6 1.17 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.69 132.21 35.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.063 -178.173 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -66.28 -30.69 71.17 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.71 -26.16 66.88 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.662 0.744 . . . . 0.0 110.888 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -96.91 -10.23 26.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.019 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -74.06 121.57 21.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.287 0.565 . . . . 0.0 110.926 -177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 29.6 t -152.82 152.25 31.38 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -66.71 -29.31 69.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.878 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -74.89 -35.4 62.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.117 0.96 . . . . 0.0 110.168 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -61.39 -24.28 66.39 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.911 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.78 -35.86 64.28 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 111.905 176.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.61 -43.09 73.45 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 121.954 -0.466 . . . . 0.0 109.816 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 33.3 mmt -64.56 -33.24 75.44 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.87 79.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.222 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -68.06 -43.83 77.75 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -65.89 -39.43 90.63 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.5 0.667 . . . . 0.0 110.372 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -62.92 -38.8 92.43 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -64.71 -40.33 95.17 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 0.0 111.86 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 30.3 mt -64.54 -36.58 84.68 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 122.12 -0.363 . . . . 0.0 111.059 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 7.6 p -76.06 -32.17 59.17 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.585 -0.697 . . . . 0.0 111.281 174.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -42.62 98.09 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 p -58.99 -39.2 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.413 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.92 -40.37 63.18 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 121.473 -0.767 . . . . 0.0 110.192 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 47.8 tttp -59.95 -29.43 68.4 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.906 -0.496 . . . . 0.0 110.739 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -55.54 -29.84 59.66 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -64.73 -39.87 94.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.591 0.632 . . . . 0.0 110.905 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -67.98 -32.78 73.43 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 24.7 mm100 -69.13 -42.19 76.36 Favored 'General case' 0 C--O 1.214 -0.791 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.144 177.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 7.4 mtp85 -59.02 -39.8 83.01 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 36.7 tttm -66.64 -44.84 80.9 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.098 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 33.1 m -72.48 -49.77 30.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.69 -21.2 66.27 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.23 -17.72 8.31 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.41 100.6 3.26 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 175.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 32.5 t -56.64 132.65 20.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.012 -178.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.39 -176.2 4.94 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -174.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -146.72 171.74 14.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.247 -177.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 64.79 -119.92 0.42 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.235 1.014 . . . . 0.0 111.21 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 84.36 20.71 58.25 Favored Glycine 0 C--O 1.222 -0.628 0 CA-C-N 118.993 0.815 . . . . 0.0 114.156 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 49.1 tttp 56.4 46.95 19.92 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.875 0.845 . . . . 0.0 111.714 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 5.2 mp -84.48 50.13 1.82 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 122.686 1.231 . . . . 0.0 110.568 178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -83.82 159.05 21.47 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.247 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -159.17 141.23 13.62 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 -177.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -137.99 124.03 20.24 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -165.79 138.55 4.18 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 178.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 2.7 tp -156.47 138.46 14.46 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -161.29 165.0 29.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 -178.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -142.07 152.27 43.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 . . . . . 0 C--O 1.255 1.35 0 N-CA-C 103.544 -2.762 . . . . 0.0 103.544 -179.943 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.6 mtm . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 120.543 0.211 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -39.42 -51.31 2.12 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 118.925 2.935 . . . . 0.0 118.925 -172.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.5 tp -57.19 -45.76 83.44 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.677 0.751 . . . . 0.0 111.239 -177.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.9 mt -73.67 -37.06 65.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.39 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.69 -34.03 77.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.631 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -59.33 -50.58 73.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 m -66.0 -41.9 90.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.89 0.376 . . . . 0.0 111.283 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -57.21 -52.13 66.57 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.113 0.565 . . . . 0.0 111.95 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.402 ' CZ3' HD11 ' A' ' 31' ' ' ILE . 92.6 m95 -70.8 -30.98 67.58 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.807 -0.558 . . . . 0.0 110.656 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -69.59 -38.15 77.21 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.874 -0.516 . . . . 0.0 111.693 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.4 HD11 HD11 ' A' ' 125' ' ' LEU . 12.0 mm -70.39 -36.51 67.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.33 -43.03 83.02 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.83 -44.82 84.4 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -59.08 -45.05 91.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.228 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.6 mt -69.23 -47.61 64.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.0 p -62.4 -29.03 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.362 177.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.4 -24.94 61.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 177.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 t -87.84 8.83 24.15 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.501 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.74 2.41 61.37 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 116.79 1.476 . . . . 0.0 116.79 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.411 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 6.9 m-85 -72.48 113.05 9.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 118.182 0.991 . . . . 0.0 109.458 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.54 126.0 24.15 Favored Glycine 0 C--O 1.226 -0.39 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.538 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 70.9 t -76.42 121.95 29.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.6 mt -91.39 -42.09 13.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -153.11 145.0 23.61 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.21 117.21 11.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 118.273 0.488 . . . . 0.0 112.31 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 78.3 40.75 18.81 Favored Glycine 0 C--O 1.223 -0.592 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.481 178.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.54 -40.52 91.84 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.228 1.013 . . . . 0.0 108.66 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 m -165.15 -75.12 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 103.842 -2.651 . . . . 0.0 103.842 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -121.31 7.94 10.22 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -113.43 147.07 38.5 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.402 HD11 ' CZ3' ' A' ' 9' ' ' TRP . 96.6 mt -132.76 129.57 58.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 103.069 -2.938 . . . . 0.0 103.069 169.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -108.16 129.3 55.18 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.411 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -130.1 134.72 47.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -179.358 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -84.23 136.87 33.77 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -90.97 105.76 13.41 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 118.005 0.366 . . . . 0.0 111.194 -178.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -72.06 -17.31 28.4 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 118.402 -0.599 . . . . 0.0 112.892 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.33 -15.85 62.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.0 mtmt 58.12 38.95 26.51 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -175.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -62.57 -177.43 0.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 112.945 -1.934 . . . . 0.0 112.377 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.9 m -57.21 -10.66 1.33 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.034 0.534 . . . . 0.0 111.828 175.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -127.93 151.26 49.32 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -96.9 -31.2 12.69 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.083 0.468 . . . . 0.0 109.952 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -135.33 161.91 34.07 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.5 t -123.17 133.58 68.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 ttt-85 -117.31 108.78 16.02 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 174.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.7 mt -85.89 130.53 34.52 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 103.777 -2.675 . . . . 0.0 103.777 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -134.65 123.09 23.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 117.993 0.361 . . . . 0.0 111.267 -176.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -102.69 94.55 5.68 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.04 0.447 . . . . 0.0 111.582 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -151.24 139.73 20.53 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -92.65 151.6 20.01 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -134.64 119.85 18.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.68 -173.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -86.48 -37.58 18.13 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.71 0.767 . . . . 0.0 110.52 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.5 145.79 51.41 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.135 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.66 ' HD2' HD11 ' A' ' 99' ' ' ILE . 28.0 ptt180 -66.1 -20.74 66.26 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.097 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -64.09 -33.24 75.32 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.141 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -77.64 -35.25 52.73 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.475 -0.766 . . . . 0.0 109.21 175.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 18.5 ttt -58.26 -50.41 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.954 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 29.8 m -60.61 -31.87 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -69.11 -37.94 78.65 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -59.87 -41.71 92.11 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -71.78 -36.39 58.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 121.447 -0.783 . . . . 0.0 111.72 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -65.11 -30.72 71.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -76.53 -41.72 45.73 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.618 0.723 . . . . 0.0 109.564 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -58.06 -35.0 70.72 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.272 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.44 78.57 Favored 'General case' 0 C--N 1.319 -0.759 0 O-C-N 122.056 -0.403 . . . . 0.0 111.41 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -72.89 -36.02 67.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.609 0.719 . . . . 0.0 109.168 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -43.18 99.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.92 -38.42 81.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.49 -41.15 80.16 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.419 1.009 . . . . 0.0 110.243 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.55 -41.66 99.03 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.165 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 87.5 t -69.99 -46.43 73.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.454 0.645 . . . . 0.0 109.704 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.54 -40.1 78.1 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 111.131 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -63.33 -51.72 64.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.403 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -71.12 -22.26 62.1 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.08 -4.96 57.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.886 0.374 . . . . 0.0 110.51 175.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.82 13.71 64.24 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 114.289 0.475 . . . . 0.0 114.289 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -79.64 145.4 33.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.776 -0.838 . . . . 0.0 112.605 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.1 mtp85 -72.41 -32.89 66.74 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.882 177.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -153.13 150.8 29.45 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 177.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.3 ttp -131.59 150.58 52.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -117.74 139.25 51.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -135.16 131.62 37.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.378 0.535 . . . . 0.0 110.287 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.7 tp -93.55 122.28 35.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -110.57 108.45 18.41 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.6 t -105.23 105.6 18.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 120.897 0.38 . . . . 0.0 110.801 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -75.73 144.59 41.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 174.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -121.74 104.14 9.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 103.125 -2.916 . . . . 0.0 103.125 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -123.1 156.56 34.7 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.543 0.527 . . . . 0.0 110.149 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -67.06 -52.69 39.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 110.583 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.29 -179.41 4.73 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.99 141.8 23.23 Favored Pre-proline 0 C--N 1.317 -0.832 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -57.12 142.92 94.35 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 117.696 -1.069 . . . . 0.0 113.851 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.1 m -77.65 -10.25 12.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -173.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -110.04 56.21 0.63 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.3 t0 61.76 52.53 3.48 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 123.238 1.494 . . . . 0.0 114.882 174.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -65.45 -17.88 64.89 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.349 -0.844 . . . . 0.0 112.69 175.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -58.81 -37.4 76.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -173.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.9 -18.61 65.46 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.66 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.3 mm -73.02 -37.87 54.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.11 -25.08 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.427 0.632 . . . . 0.0 110.438 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -89.15 3.14 52.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.184 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -116.95 98.49 6.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.31 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 47.1 m -68.53 126.11 28.61 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 172.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -86.25 108.44 18.38 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -110.31 101.39 10.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.76 0.79 . . . . 0.0 113.013 -176.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.2 tttm -99.48 75.58 1.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.76 -108.35 2.08 Favored Glycine 0 C--O 1.228 -0.238 0 C-N-CA 119.529 -1.319 . . . . 0.0 112.568 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 52.0 p -72.4 9.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.535 1.134 . . . . 0.0 112.965 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 99.3 t -129.49 144.82 36.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 C-N-CA 122.796 0.438 . . . . 0.0 110.471 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.0 t -136.34 118.32 15.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -118.79 126.39 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.471 -2.075 0 CA-C-O 122.74 1.257 . . . . 0.0 110.379 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -99.42 104.53 27.63 Favored Pre-proline 0 N--CA 1.419 -2.001 0 CA-C-N 111.4 -2.636 . . . . 0.0 109.474 -176.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -80.27 149.47 19.45 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 117.843 -0.971 . . . . 0.0 113.973 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.32 149.84 31.55 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.0 tt -142.72 123.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.1 t -102.57 107.84 22.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 136.16 33.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -60.7 -33.58 83.08 Favored Glycine 0 CA--C 1.511 -0.182 0 N-CA-C 114.908 0.723 . . . . 0.0 114.908 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.5 t -56.05 -23.88 36.19 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.5 ptm -140.97 35.83 1.75 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.586 1.184 . . . . 0.0 109.44 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.81 -41.94 34.39 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 -171.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -61.52 -51.36 68.93 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.16 1.8 . . . . 0.0 111.387 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -73.69 -32.94 64.2 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.828 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -72.73 -39.92 66.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.889 0.852 . . . . 0.0 111.309 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 11' ' ' ILE . 3.5 tm? -68.22 -43.47 77.93 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.751 -0.593 . . . . 0.0 110.491 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.424 -177.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.41 -32.03 62.54 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.4 t -91.21 -43.64 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.367 0.603 . . . . 0.0 110.157 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -127.39 79.61 73.0 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.036 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.6 -13.85 38.19 Favored 'Trans proline' 0 C--N 1.347 0.456 0 N-CA-C 114.535 0.937 . . . . 0.0 114.535 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.6 m -84.47 -2.46 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -76.83 137.29 39.11 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.447 0.641 . . . . 0.0 111.183 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -73.18 103.0 3.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.76 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 58.8 p -68.51 -18.63 64.42 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.063 0.459 . . . . 0.0 110.042 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.454 ' CD ' ' H ' ' A' ' 135' ' ' GLU . 1.9 mp0 -72.43 -15.74 61.83 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.503 0.721 . . . . 0.0 111.514 178.135 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -77.05 7.2 5.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 122.034 0.921 . . . . 0.0 110.593 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 44.0 t -140.49 131.14 25.62 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 105.315 -2.105 . . . . 0.0 105.315 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.8 t -150.34 161.15 43.03 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -62.21 -36.79 83.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.2 -22.16 62.62 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 122.02 0.914 . . . . 0.0 111.254 178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -119.04 19.11 13.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.641 -175.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -78.72 13.89 1.51 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -177.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 89.2 p -69.03 149.18 49.05 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 121.506 -0.746 . . . . 0.0 111.398 -178.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -64.25 -28.85 70.01 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.476 0.655 . . . . 0.0 110.449 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.14 -38.03 89.57 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.264 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -63.19 -29.11 70.52 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.98 -0.45 . . . . 0.0 110.866 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.92 -38.06 72.93 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.286 -0.259 . . . . 0.0 110.705 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -64.03 -45.73 87.6 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtt -62.69 -28.95 70.3 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.675 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.08 -34.49 73.53 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 121.63 -0.669 . . . . 0.0 111.115 -178.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -66.37 -45.64 79.42 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -67.1 -38.03 84.96 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.259 0.552 . . . . 0.0 110.375 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 60.3 mtt85 -61.86 -43.49 98.73 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -63.88 -42.17 97.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 118.515 0.598 . . . . 0.0 111.887 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.5 -36.36 83.95 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 122.092 -0.38 . . . . 0.0 111.648 -178.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 10.6 p -76.14 -35.66 59.14 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.321 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -41.24 95.38 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.69 0.796 . . . . 0.0 112.837 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -63.13 -38.25 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 118.753 0.706 . . . . 0.0 111.349 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.81 -40.52 63.31 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.9 ttpp -57.78 -25.46 60.54 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.132 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' GLN . . . . . 0.423 ' HA ' ' HB2' ' A' ' 164' ' ' GLN . 2.1 tp-100 -54.97 -28.41 51.47 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 178.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -65.8 -34.31 77.87 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.498 0.666 . . . . 0.0 110.739 177.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -76.79 -40.9 46.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' GLN . . . . . 0.423 ' HB2' ' HA ' ' A' ' 161' ' ' GLN . 20.9 mm100 -59.79 -46.38 89.39 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -59.6 -24.5 63.85 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 118.19 0.45 . . . . 0.0 111.605 -177.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -77.62 -49.04 15.4 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.706 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 55.2 p -72.4 -23.44 61.1 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.07 -19.49 7.39 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -177.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -52.85 -18.41 1.89 Allowed 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 51.38 67.02 1.02 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 171.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 33.6 m -63.61 -15.45 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.755 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -151.81 150.97 30.74 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 173.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -162.71 142.56 9.32 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 178.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -165.66 151.09 9.0 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 117.744 0.247 . . . . 0.0 110.947 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 83.19 173.79 49.93 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 117.77 1.868 . . . . 0.0 117.77 174.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 41.2 tttp -153.31 149.95 28.42 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 104.727 -2.323 . . . . 0.0 104.727 177.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 48.3 tp -112.83 161.16 17.26 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -144.54 163.93 32.41 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -83.78 -34.04 24.85 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 106.808 -1.553 . . . . 0.0 106.808 174.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 44.65 42.36 5.72 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 56.6 t30 -138.59 151.95 47.72 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.887 -0.508 . . . . 0.0 110.167 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.518 ' HG ' ' H ' ' A' ' 184' ' ' PHE . 27.7 tp -87.94 149.81 23.84 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 123.307 0.643 . . . . 0.0 109.557 -178.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -71.71 -15.22 62.2 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' PHE . . . . . 0.518 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER 52.6 35.15 17.34 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 118.407 2.743 . . . . 0.0 118.407 171.664 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 . . . . . 0 C--O 1.25 1.111 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 175.311 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.5 mtp . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 119.484 -0.294 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -67.36 -15.22 63.56 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 27.2 tp -55.05 -32.22 61.73 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 122.722 0.409 . . . . 0.0 111.166 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 22.4 tp -60.65 -48.11 83.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.821 0.343 . . . . 0.0 110.491 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -73.75 -30.63 62.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.443 0.64 . . . . 0.0 110.804 -178.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -61.62 -43.0 99.67 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.9 m -66.34 -44.31 83.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.778 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -53.05 -55.43 23.82 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -68.59 -35.66 77.66 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.527 -0.733 . . . . 0.0 112.858 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -74.88 -25.24 58.81 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.113 -0.992 . . . . 0.0 112.515 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.567 HD11 HD11 ' A' ' 125' ' ' LEU . 7.4 mm -67.76 -40.78 84.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.96 -40.29 80.21 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -41.95 96.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.392 177.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -63.54 -42.33 98.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.585 0.231 . . . . 0.0 110.539 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -65.2 -45.74 83.56 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.4 t -60.48 -40.11 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.101 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -62.16 -30.63 71.19 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.664 -0.647 . . . . 0.0 110.623 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.8 m -80.39 11.41 3.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.926 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.14 3.19 63.71 Favored Glycine 0 C--O 1.229 -0.194 0 N-CA-C 115.296 0.879 . . . . 0.0 115.296 175.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.454 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 16.5 m-85 -68.8 126.4 29.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.024 0.912 . . . . 0.0 110.361 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 134.89 13.75 Favored Glycine 0 C--O 1.225 -0.445 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.57 119.18 24.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 O-C-N 122.013 -0.698 . . . . 0.0 110.142 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 77.2 mt -89.41 -46.03 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -149.76 120.37 7.49 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.285 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 126.08 19.52 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 151.05 -30.89 0.98 Allowed Glycine 0 CA--C 1.506 -0.526 0 N-CA-C 111.356 -0.697 . . . . 0.0 111.356 176.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -64.73 141.82 58.64 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 176.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -67.26 -27.03 66.87 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -114.94 -5.02 12.53 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -173.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -144.73 142.97 30.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.36 0.982 . . . . 0.0 113.445 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.8 mt -136.5 125.98 38.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -107.77 123.87 49.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.454 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.3 mm? -124.15 128.58 49.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -83.0 132.22 35.15 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.56 123.52 89.64 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.67 -19.51 24.21 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 116.955 -1.563 . . . . 0.0 112.943 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -66.07 -33.87 76.78 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 56.75 27.38 12.66 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.65 1.214 . . . . 0.0 110.638 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 t -79.46 -172.85 3.43 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 112.217 -2.265 . . . . 0.0 106.347 176.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.7 m -41.75 -25.45 0.06 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -110.38 127.27 55.0 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 169.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -91.01 -32.42 15.93 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.62 166.42 32.15 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.36 136.67 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.2 ttt180 -112.64 111.28 21.98 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -81.47 128.53 33.98 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 101.917 -3.364 . . . . 0.0 101.917 173.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -136.13 114.89 12.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.732 -176.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tttm -87.38 94.66 9.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -151.7 136.41 17.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.264 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -97.26 147.24 24.33 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 175.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.97 134.61 47.56 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -92.25 -39.93 11.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -120.39 147.84 44.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.634 0.73 . . . . 0.0 112.418 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -61.3 -21.26 63.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.48 -33.25 74.73 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.961 -0.462 . . . . 0.0 109.8 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -68.24 -37.59 80.95 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 54.1 ttm -61.94 -46.5 89.03 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.67 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.1 m -68.02 -36.62 76.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.745 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -26.43 62.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.862 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -65.15 -34.5 78.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -72.08 -30.87 37.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.495 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.63 -40.17 93.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -67.91 -44.85 75.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.864 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -61.02 -38.76 87.21 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.465 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.71 76.03 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -68.87 -37.04 78.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.244 0.545 . . . . 0.0 109.917 177.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -64.21 -42.3 96.67 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.511 HG11 HG13 ' A' ' 109' ' ' VAL . 44.9 t -62.29 -40.41 87.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.066 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.521 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -57.53 -36.1 71.15 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 119.108 0.867 . . . . 0.0 111.333 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -64.33 -45.95 85.59 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.531 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.72 -40.8 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.663 0.744 . . . . 0.0 110.248 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -39.83 78.56 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.348 0.659 . . . . 0.0 110.201 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -63.35 -47.57 81.59 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.487 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -73.36 -23.01 60.15 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.989 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.3 -11.88 57.25 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.668 0.271 . . . . 0.0 111.353 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.21 17.6 68.32 Favored Glycine 0 CA--C 1.52 0.401 0 CA-C-O 121.55 0.528 . . . . 0.0 112.482 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 mmt-85 -69.62 136.95 51.85 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.113 -0.64 . . . . 0.0 111.503 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -72.09 -32.04 66.63 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -152.32 145.34 24.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 N-CA-C 102.536 -3.135 . . . . 0.0 102.536 173.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.1 ttp -125.36 143.04 51.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -178.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -120.58 129.79 53.92 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -117.64 134.06 55.29 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.021 -176.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.87 124.9 38.18 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -112.06 128.27 56.14 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 121.905 -0.497 . . . . 0.0 109.793 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.65 105.85 17.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -75.14 136.58 41.07 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -111.99 108.36 17.66 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 173.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -126.39 158.52 35.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.71 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.9 t -80.01 -28.9 39.36 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.632 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -155.41 167.11 31.44 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.85 158.83 41.54 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 122.669 0.388 . . . . 0.0 111.174 -175.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.41 153.17 42.47 Favored 'Trans proline' 0 C--N 1.355 0.898 0 O-C-N 122.178 0.567 . . . . 0.0 112.871 175.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -62.72 -29.69 47.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -157.41 151.61 24.76 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.8 t0 49.8 15.89 0.18 Allowed 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 27.7 p-90 -76.81 -25.21 53.01 Favored 'General case' 0 C--O 1.216 -0.669 0 O-C-N 121.118 -0.989 . . . . 0.0 110.741 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.05 -31.93 72.39 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 121.989 -0.444 . . . . 0.0 111.783 -175.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.59 -17.71 62.9 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.128 0.49 . . . . 0.0 110.823 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.8 mm -75.87 -36.12 31.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -70.22 -17.51 63.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.074 0.464 . . . . 0.0 111.341 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -96.34 2.71 52.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -121.48 138.42 54.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.434 0.635 . . . . 0.0 111.013 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 62.4 m -80.59 125.88 30.55 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -82.66 130.49 35.13 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 105.084 -2.191 . . . . 0.0 105.084 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -129.6 137.11 50.52 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.557 0.694 . . . . 0.0 112.448 -178.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -132.6 75.59 1.64 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.15 -112.66 5.18 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.989 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.8 t -77.5 16.49 0.63 Allowed 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.68 0.752 . . . . 0.0 111.935 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.511 HG13 HG11 ' A' ' 68' ' ' VAL . 76.6 t -130.07 141.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 121.47 -0.769 . . . . 0.0 111.677 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 70.9 m -132.49 140.21 48.27 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -138.24 138.17 43.45 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.291 0 CA-C-O 121.566 0.698 . . . . 0.0 110.564 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.98 108.77 62.52 Favored Pre-proline 0 N--CA 1.435 -1.2 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.101 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.41 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 51.8 Cg_endo -78.83 155.33 26.83 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 115.363 -2.625 . . . . 0.0 112.132 176.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -153.13 153.42 32.75 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 102.269 -3.234 . . . . 0.0 102.269 175.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.4 tt -146.88 130.08 8.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.0 m -105.92 133.53 50.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 N-CA-C 104.473 -2.417 . . . . 0.0 104.473 172.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.82 136.18 53.14 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -55.21 -34.13 58.57 Favored Glycine 0 C--O 1.227 -0.332 0 N-CA-C 115.65 1.02 . . . . 0.0 115.65 -174.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.4 t -61.7 -17.08 54.2 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -141.49 25.44 2.02 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.665 0.745 . . . . 0.0 109.815 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -48.0 -39.78 20.61 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -170.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -58.72 -51.33 70.41 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.456 1.026 . . . . 0.0 111.729 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -73.76 -34.71 64.82 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.333 0.587 . . . . 0.0 111.585 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.91 -40.59 91.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.065 0.936 . . . . 0.0 111.789 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.567 HD11 HD11 ' A' ' 11' ' ' ILE . 2.7 tm? -67.54 -44.76 77.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.433 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -70.97 -13.75 62.12 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.164 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.82 -35.5 62.44 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 176.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.62 -36.8 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 120.632 0.253 . . . . 0.0 111.327 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -126.39 75.85 73.46 Favored Pre-proline 0 C--N 1.326 -0.422 0 O-C-N 122.079 -0.388 . . . . 0.0 110.755 177.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.95 -14.99 39.69 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 118.53 -0.513 . . . . 0.0 112.766 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 m -76.03 0.78 17.42 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.821 0.449 . . . . 0.0 112.008 178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -117.27 139.07 51.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 -179.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -73.04 96.82 2.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 14.8 t -61.57 -20.65 63.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.627 0.727 . . . . 0.0 110.148 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -72.96 -16.3 61.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -72.27 -12.6 61.23 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 78.8 m -92.84 48.91 1.39 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.38 154.12 29.1 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.264 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -63.44 -23.0 67.21 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -174.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 60.5 mp0 -61.35 -24.69 66.64 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.421 0.629 . . . . 0.0 110.16 176.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -95.0 10.98 33.56 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -75.73 2.42 12.15 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 40.4 t -72.25 147.26 46.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.039 0.447 . . . . 0.0 110.813 178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -65.52 -28.71 69.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -64.3 -44.57 91.21 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.58 -37.33 86.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.916 -178.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.03 -45.48 92.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.96 0.409 . . . . 0.0 110.727 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -63.7 -46.08 87.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.218 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 84.1 mtp -64.33 -29.46 70.54 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.089 -0.382 . . . . 0.0 110.947 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -34.9 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.716 -0.615 . . . . 0.0 110.672 178.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -66.45 -47.18 73.96 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -67.09 -38.88 86.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.541 0.686 . . . . 0.0 110.401 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.4 ttt-85 -60.64 -44.19 96.69 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.35 99.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 111.995 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -33.77 76.55 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.856 0.36 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -75.97 -35.26 59.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.751 0.786 . . . . 0.0 111.523 175.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -62.13 -43.57 98.55 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 124.041 0.936 . . . . 0.0 113.341 -176.487 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 4.3 p -57.4 -43.43 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.86 -176.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -73.91 -39.87 63.55 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 121.657 -0.652 . . . . 0.0 110.117 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -62.81 -30.02 71.16 Favored 'General case' 0 C--O 1.219 -0.546 0 O-C-N 121.633 -0.667 . . . . 0.0 111.871 -179.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -58.63 -28.64 65.84 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 118.767 0.712 . . . . 0.0 111.203 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -63.36 -35.98 82.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 118.265 0.484 . . . . 0.0 110.19 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -76.97 -51.01 11.9 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.26 -38.43 71.14 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -175.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -57.11 -26.62 60.78 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -77.7 -44.67 27.17 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 121.453 -0.779 . . . . 0.0 110.214 173.78 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.34 -25.42 61.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 117.055 2.242 . . . . 0.0 117.055 -174.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -55.73 -24.33 34.28 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.68 -20.71 65.92 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 177.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -86.61 58.04 4.84 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.493 0.664 . . . . 0.0 111.285 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.424 HG23 ' H ' ' A' ' 171' ' ' VAL . 0.1 OUTLIER -64.97 133.76 30.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.86 -178.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -155.47 155.18 33.04 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -155.55 161.35 40.89 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -159.42 90.17 0.94 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 152.41 -178.01 29.84 Favored Glycine 0 C--O 1.229 -0.19 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.106 177.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -147.02 140.99 25.94 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.66 -165.12 1.25 Allowed 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 105.404 -2.073 . . . . 0.0 105.404 175.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 54.28 66.6 1.19 Allowed 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 173.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 49.4 ttt85 -77.31 -41.78 39.33 Favored 'General case' 0 C--O 1.214 -0.771 0 O-C-N 121.416 -0.802 . . . . 0.0 110.628 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 40.84 91.17 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -173.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -144.1 39.11 1.32 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.42 -175.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 33.1 tp -104.22 145.85 29.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.21 0.529 . . . . 0.0 111.523 -178.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -161.85 166.12 26.78 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -144.22 159.01 43.4 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 . . . . . 0 C--O 1.252 1.191 0 N-CA-C 103.986 -2.598 . . . . 0.0 103.986 178.365 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.4 ttm . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 55.86 40.86 30.57 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.335 0.971 . . . . 0.0 113.597 176.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.1 tt -55.98 -41.58 75.01 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -176.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 53.6 tp -54.32 -35.25 62.47 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.609 0.718 . . . . 0.0 112.299 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 61.9 mt-10 -57.12 -25.03 58.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -178.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -51.81 -50.46 60.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.602 0.637 . . . . 0.0 110.714 177.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.0 m -68.56 -39.61 80.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.2 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -58.76 -57.29 13.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.113 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.401 ' CZ3' HD11 ' A' ' 31' ' ' ILE . 98.3 m95 -70.34 -31.55 68.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -70.09 -35.12 73.94 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.644 -1.222 . . . . 0.0 109.183 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 125' ' ' LEU . 1.2 mm -65.0 -44.78 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.16 -42.04 80.31 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.33 -41.28 98.89 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.1 m80 -62.73 -45.75 91.29 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -66.84 -51.89 50.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.194 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.7 t -56.28 -43.09 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.927 0.394 . . . . 0.0 110.306 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -71.28 -18.24 62.43 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.109 -0.994 . . . . 0.0 112.362 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.9 t -88.08 9.51 22.32 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.967 0.507 . . . . 0.0 110.734 177.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.28 0.24 57.03 Favored Glycine 0 CA--C 1.517 0.205 0 N-CA-C 116.135 1.214 . . . . 0.0 116.135 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.408 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 22.8 m-85 -69.93 107.43 3.57 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.73 133.26 34.88 Favored Glycine 0 CA--C 1.511 -0.211 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.212 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.5 t -75.95 125.02 35.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.518 HD11 HD22 ' A' ' 43' ' ' LEU . 52.4 mt -93.91 -46.05 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -147.79 133.37 18.78 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.409 -178.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 149.41 42.92 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 101.203 -3.629 . . . . 0.0 101.203 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.25 20.23 33.41 Favored Glycine 0 C--O 1.225 -0.426 0 C-N-CA 120.416 -0.897 . . . . 0.0 110.957 -178.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -76.0 -174.07 2.55 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 105.037 -2.209 . . . . 0.0 105.037 174.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -54.28 41.79 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.198 0.523 . . . . 0.0 110.231 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -139.22 -11.12 1.25 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.263 173.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.19 164.71 14.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.401 HD11 ' CZ3' ' A' ' 9' ' ' TRP . 52.1 mt -135.58 126.29 43.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 76.8 m95 -105.9 132.87 51.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 4.2 mp -133.72 145.16 49.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -98.66 150.14 22.08 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 125.64 88.02 Favored Pre-proline 0 CA--C 1.544 0.75 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.63 -29.06 13.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 116.939 -1.574 . . . . 0.0 113.242 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -73.52 -19.42 60.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.847 0.356 . . . . 0.0 110.744 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.1 mttm 53.89 43.34 31.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.103 1.43 . . . . 0.0 110.045 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.2 p -69.73 -177.71 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 112.237 -2.256 . . . . 0.0 108.737 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -46.82 -33.07 4.14 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.09 113.47 21.06 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 172.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -78.48 -44.86 23.48 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.359 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.518 HD22 HD11 ' A' ' 23' ' ' ILE . 24.4 mt -137.35 166.17 24.46 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -173.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.2 t -134.55 139.74 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.791 0.837 . . . . 0.0 109.497 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 -120.34 124.27 45.14 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -91.77 130.17 37.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 104.264 -2.495 . . . . 0.0 104.264 174.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -136.49 139.79 42.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -125.72 103.12 7.65 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.775 0.716 . . . . 0.0 111.906 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -149.05 138.81 21.91 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.31 145.78 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.425 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.498 HD13 ' HG2' ' A' ' 57' ' ' MET . 7.2 mt -129.02 126.24 39.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.46 0.171 . . . . 0.0 111.085 -173.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -90.17 -38.15 13.69 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.674 0.749 . . . . 0.0 110.637 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -133.42 151.27 51.79 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.787 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HD2' HD11 ' A' ' 99' ' ' ILE . 21.4 ptt-85 -65.34 -18.14 65.08 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -64.53 -33.33 75.65 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.787 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -69.29 -40.37 77.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.498 ' HG2' HD13 ' A' ' 51' ' ' LEU . 91.8 mtp -55.92 -47.95 76.57 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.149 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -64.15 -31.21 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.682 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -71.13 -41.37 70.6 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -57.46 -43.65 84.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.164 0.507 . . . . 0.0 110.629 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -68.03 -30.65 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.423 -176.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.94 73.82 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.92 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -73.71 -43.75 58.36 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -54.38 -39.1 66.89 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 175.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.29 93.79 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.042 0.837 . . . . 0.0 110.791 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -67.97 -42.39 80.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.516 0.674 . . . . 0.0 109.379 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -59.18 -42.38 90.68 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.6 -36.9 77.65 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.975 0 CA-C-O 118.833 -0.603 . . . . 0.0 110.558 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.0 -42.59 85.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.951 1.25 . . . . 0.0 109.391 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -65.91 -48.41 71.51 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.328 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.0 t -66.17 -35.8 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.264 0.554 . . . . 0.0 110.346 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -43.91 96.9 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 121.558 -0.714 . . . . 0.0 110.037 178.197 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -67.61 -39.3 84.75 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.396 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.91 -40.36 88.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.825 0.345 . . . . 0.0 111.477 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -91.83 0.54 57.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.85 19.71 65.72 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 115.746 1.058 . . . . 0.0 115.746 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -77.93 142.58 38.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.684 -0.892 . . . . 0.0 110.698 -176.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -63.65 -40.48 96.96 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.13 -0.356 . . . . 0.0 111.182 -178.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.3 ptt-85 -144.91 160.37 41.41 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 102.09 -3.3 . . . . 0.0 102.09 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -135.09 145.9 48.37 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 119.568 1.076 . . . . 0.0 110.895 175.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 110' ' ' SER . 40.2 tttp -123.62 127.82 48.8 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.666 0.604 . . . . 0.0 109.671 174.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -122.5 132.64 54.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.814 -175.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.9 tp -92.79 123.66 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 174.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -115.6 108.5 16.49 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.3 t -105.08 112.92 40.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.107 0.254 . . . . 0.0 111.46 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.41 135.16 35.64 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 175.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -110.92 117.84 34.47 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.9 p -132.87 168.39 18.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -176.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.4 t -92.55 -28.95 16.44 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.64 161.73 39.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.36 149.88 39.13 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -177.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -64.35 151.14 86.67 Favored 'Trans proline' 0 C--N 1.346 0.418 0 O-C-N 122.34 0.652 . . . . 0.0 112.562 177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.0 m -77.76 -12.7 13.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 119.096 2.998 . . . . 0.0 119.096 -169.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.82 101.66 8.04 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 117.404 2.372 . . . . 0.0 117.404 -173.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 44.52 28.66 0.33 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 117.703 2.483 . . . . 0.0 117.703 172.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -63.11 -21.75 66.39 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -176.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -61.72 -31.27 71.42 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.746 -0.596 . . . . 0.0 110.774 -177.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.5 -28.09 69.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.082 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.474 HD11 ' HD2' ' A' ' 54' ' ' ARG . 7.4 mm -73.59 -35.81 45.7 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.75 71.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.444 0.64 . . . . 0.0 111.114 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.65 -24.42 59.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.293 0.568 . . . . 0.0 111.358 178.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -85.16 99.36 11.02 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -171.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 59.6 m -68.26 122.58 18.64 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 171.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.88 120.66 25.96 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -118.76 128.18 54.24 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.079 0.943 . . . . 0.0 110.474 -179.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -130.75 75.57 1.67 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.246 -1.343 . . . . 0.0 107.773 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.02 -112.63 5.0 Favored Glycine 0 C--O 1.219 -0.831 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.703 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.1 p -84.49 16.99 2.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -121.64 140.73 44.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.447 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 7.9 p -134.88 137.71 43.47 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -134.01 130.05 54.82 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.724 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -99.09 110.76 59.05 Favored Pre-proline 0 N--CA 1.432 -1.361 0 CA-C-N 114.424 -1.262 . . . . 0.0 107.979 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -79.64 149.95 21.32 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 117.417 -1.255 . . . . 0.0 111.597 179.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.84 150.69 29.59 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.9 tt -145.89 137.36 19.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 -178.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.0 m -119.83 133.79 65.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 103.559 -2.756 . . . . 0.0 103.559 175.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.38 136.21 53.9 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 -176.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -45.58 -43.35 10.95 Favored Glycine 0 N--CA 1.461 0.318 0 N-CA-C 116.915 1.526 . . . . 0.0 116.915 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.405 HG22 ' H ' ' A' ' 119' ' ' THR . 0.2 OUTLIER -53.25 -29.93 35.48 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -178.565 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.9 ptm -140.6 30.84 1.88 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 122.664 1.221 . . . . 0.0 109.624 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.06 -37.81 47.81 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -58.39 -40.83 83.43 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.621 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -78.44 -43.37 27.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.808 0.813 . . . . 0.0 111.105 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.66 -43.37 93.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.991 0.901 . . . . 0.0 112.196 -177.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.479 HD12 ' CD2' ' A' ' 132' ' ' PHE . 1.2 tm? -65.01 -42.06 94.79 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.27 -175.186 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -74.78 -18.39 60.48 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.72 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.72 -36.26 65.18 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 59.5 t -85.59 -40.19 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.427 0.632 . . . . 0.0 110.117 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -124.91 82.26 61.17 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.122 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -68.92 -4.54 13.65 Favored 'Trans proline' 0 C--N 1.347 0.462 0 N-CA-C 114.919 1.084 . . . . 0.0 114.919 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 35.4 p -80.53 -8.18 59.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.367 0.603 . . . . 0.0 109.628 175.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' PHE . . . . . 0.479 ' CD2' HD12 ' A' ' 125' ' ' LEU . 71.2 t80 -86.15 124.93 33.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.697 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -78.61 97.24 5.73 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.8 t -67.23 -19.53 65.55 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 176.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -62.01 -36.4 81.45 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.485 176.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.93 -23.36 33.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.34 1.067 . . . . 0.0 110.51 -176.113 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.1 t -93.68 68.16 3.96 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.076 -0.966 . . . . 0.0 112.121 -175.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 85.3 p -66.06 158.15 29.16 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -62.41 -33.35 74.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.381 0.61 . . . . 0.0 110.67 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -63.93 -24.9 67.91 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.549 0.69 . . . . 0.0 112.065 178.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 -79.4 -11.83 59.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.212 0.53 . . . . 0.0 110.392 -176.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -102.62 40.96 1.28 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -175.397 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 24.2 p -68.3 160.11 30.02 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.654 -0.818 . . . . 0.0 110.116 178.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 29.9 p90 -64.81 -28.86 69.86 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.631 -0.668 . . . . 0.0 111.324 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -69.33 -41.23 76.93 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -62.97 -33.7 75.94 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 177.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.68 95.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.19 0.519 . . . . 0.0 111.117 177.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -44.23 92.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 48.7 mtp -69.03 -28.89 66.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.02 92.49 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.901 -0.499 . . . . 0.0 110.222 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.99 -46.73 80.21 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -60.33 -45.6 92.86 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.241 1.019 . . . . 0.0 110.373 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 22.2 ttm180 -65.48 -33.86 76.92 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.3 -42.75 92.74 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 121.224 -0.19 . . . . 0.0 110.905 177.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.18 -41.0 91.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 28.0 m -67.09 -35.36 79.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.562 0.696 . . . . 0.0 111.019 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tt -70.18 -33.76 72.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 39.9 t -58.36 -44.44 88.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -68.81 -37.84 79.49 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.475 -0.49 . . . . 0.0 109.928 178.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -58.09 -29.96 65.87 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.381 176.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -54.86 -31.82 60.08 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.394 0.543 . . . . 0.0 111.005 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -59.73 -45.21 92.88 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.745 -0.597 . . . . 0.0 111.919 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -79.13 -32.65 44.51 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.625 0.726 . . . . 0.0 111.439 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.4 tm0? -61.38 -39.18 89.73 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 121.964 -0.46 . . . . 0.0 110.859 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -62.53 -17.75 60.5 Favored 'General case' 0 C--O 1.217 -0.641 0 N-CA-C 113.901 1.075 . . . . 0.0 113.901 -178.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -62.71 -17.84 61.44 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 120.973 0.416 . . . . 0.0 111.331 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 36.4 p -63.04 -13.68 38.67 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -53.2 -24.48 11.09 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -67.14 -14.15 62.63 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -78.73 139.61 38.42 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.28 121.41 17.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.11 -174.79 4.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.489 -176.09 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -146.73 160.83 41.74 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -133.66 169.64 16.72 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.065 0.546 . . . . 0.0 109.975 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 158.93 165.58 16.28 Favored Glycine 0 C--O 1.224 -0.492 0 C-N-CA 121.072 -0.585 . . . . 0.0 113.007 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.99 132.34 28.4 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 94.3 mt -85.39 153.48 22.49 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 103.617 -2.735 . . . . 0.0 103.617 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 70.2 148.57 0.08 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 124.385 1.053 . . . . 0.0 111.629 -178.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -145.02 87.64 1.84 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -176.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 65.71 169.08 0.21 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 174.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -135.4 162.44 32.6 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.8 tp -142.01 141.55 32.85 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 178.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -68.56 -27.88 66.46 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -176.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 65.3 150.97 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -178.808 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 . . . . . 0 C--O 1.246 0.878 0 N-CA-C 105.616 -1.994 . . . . 0.0 105.616 -179.453 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 tpt . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 119.044 -0.503 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -72.78 36.88 0.08 Allowed 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 117.344 2.35 . . . . 0.0 117.344 -175.082 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.47 -41.39 80.25 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.107 -0.996 . . . . 0.0 110.276 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.35 -39.74 89.38 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.24 -38.15 90.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.712 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -62.24 -46.18 90.01 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 23.5 m -65.16 -43.23 92.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.047 0.451 . . . . 0.0 110.519 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.63 -53.94 51.76 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.384 0.673 . . . . 0.0 111.156 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -69.8 -27.41 64.87 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.956 -0.465 . . . . 0.0 111.679 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -71.13 -36.85 72.26 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.745 -0.597 . . . . 0.0 111.881 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.4 mm -67.84 -45.9 83.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.86 -45.86 74.61 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.9 91.96 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.39 -34.74 76.58 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.684 -176.493 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -71.07 -52.18 20.92 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.531 178.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.0 m -60.1 -32.84 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.828 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -67.99 -23.96 65.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.417 . . . . 0.0 110.723 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 t -89.17 9.82 24.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.809 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.73 2.68 59.73 Favored Glycine 0 C--O 1.227 -0.293 0 N-CA-C 115.612 1.005 . . . . 0.0 115.612 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 15.5 m-85 -72.31 99.76 2.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.064 0.932 . . . . 0.0 109.402 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.76 134.36 40.99 Favored Glycine 0 CA--C 1.512 -0.125 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.819 -177.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.2 t -77.23 124.26 35.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 79.3 mt -90.09 -43.58 14.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -150.13 127.33 11.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.402 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.37 131.68 26.68 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 170.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.7 -88.54 0.07 OUTLIER Glycine 0 CA--C 1.507 -0.454 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 178.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -68.61 157.44 36.12 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.1 t -75.2 -3.48 33.27 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.81 0.338 . . . . 0.0 111.724 -176.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.1 -36.48 35.34 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -177.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -140.45 144.51 36.13 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -176.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 87.7 mt -139.31 132.24 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -105.22 134.33 48.51 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -129.72 139.75 51.26 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.927 0.491 . . . . 0.0 110.294 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -86.93 140.47 29.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -92.44 105.61 14.96 Favored Pre-proline 0 CA--C 1.553 1.068 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 91.9 Cg_endo -72.76 -17.29 25.99 Favored 'Trans proline' 0 C--N 1.352 0.729 0 CA-C-N 118.431 0.475 . . . . 0.0 112.991 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -67.47 -16.41 64.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.751 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.9 mttt 54.49 42.37 31.38 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 122.67 1.224 . . . . 0.0 108.823 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.4 p -72.78 -175.04 1.59 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 112.884 -1.962 . . . . 0.0 109.637 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.5 m -52.35 -31.71 34.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.769 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -98.66 136.25 38.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.043 0.537 . . . . 0.0 109.62 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -83.34 -33.75 25.8 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.9 mt -135.01 158.03 45.39 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.619 -176.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.21 141.7 43.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -138.5 150.71 46.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.247 0.546 . . . . 0.0 111.079 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.1 mt -113.98 135.96 53.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -136.47 129.92 31.81 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.261 0.35 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -106.11 114.84 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -151.76 150.4 30.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -118.85 139.56 51.41 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 103.601 -2.74 . . . . 0.0 103.601 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -152.22 144.45 23.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -82.03 -35.15 29.1 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -133.3 154.52 50.63 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.461 ' HD2' HD11 ' A' ' 99' ' ' ILE . 28.5 ptt-85 -62.9 -17.87 62.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -61.77 -33.34 73.92 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.622 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.53 -39.1 67.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 ttp -61.84 -45.81 92.17 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.586 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.41 -33.35 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.22 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -65.05 -39.87 93.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.758 -178.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -57.87 -43.49 86.01 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.172 0.295 . . . . 0.0 110.421 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mt -74.07 -35.59 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.761 -0.587 . . . . 0.0 111.341 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.3 -39.0 78.19 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -76.61 -40.76 48.44 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.571 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.56 93.34 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.21 -33.93 76.56 Favored 'General case' 0 C--O 1.209 -1.036 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.66 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.19 -41.73 96.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.584 0.707 . . . . 0.0 109.75 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -63.61 -46.21 86.78 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.304 0.574 . . . . 0.0 109.697 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.4 t -65.24 -38.23 82.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.908 -177.745 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -58.6 -43.03 89.41 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -64.47 -42.05 96.15 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.177 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.9 t -65.7 -39.47 84.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.619 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.3 OUTLIER -61.93 -44.95 95.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.561 -0.712 . . . . 0.0 111.95 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.3 m80 -64.44 -31.54 72.79 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.484 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -66.73 -24.21 66.2 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.914 0.387 . . . . 0.0 111.325 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.7 mp -100.68 -17.64 16.9 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.202 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.52 6.94 59.89 Favored Glycine 0 CA--C 1.523 0.594 0 CA-C-O 121.574 0.541 . . . . 0.0 113.93 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 -71.37 140.8 50.31 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -59.14 -47.01 86.84 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -170.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -153.97 153.72 32.49 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.675 0.671 . . . . 0.0 110.609 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.469 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -102.19 164.13 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.654 0.782 . . . . 0.0 112.716 -178.349 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.6 mptt -148.2 129.01 14.28 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 101.389 -3.56 . . . . 0.0 101.389 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -139.57 128.11 22.99 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -174.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.6 tp -91.43 121.16 32.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -115.16 108.62 16.86 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.184 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 12.4 t -101.69 113.06 36.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -82.14 143.51 31.4 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 175.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -123.25 117.35 25.09 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 173.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.1 m -135.59 158.31 44.7 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 123.447 0.467 . . . . 0.0 111.522 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 52.3 m -68.16 -49.16 62.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-O 121.885 0.85 . . . . 0.0 108.844 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -144.31 158.77 43.56 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 103.142 -2.91 . . . . 0.0 103.142 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.76 155.94 53.0 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.959 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -63.61 154.11 70.96 Favored 'Trans proline' 0 C--N 1.346 0.404 0 O-C-N 122.208 0.583 . . . . 0.0 112.789 177.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.6 m -88.26 10.52 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -121.83 83.49 2.1 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 114.449 1.278 . . . . 0.0 114.449 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 31.09 45.0 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 118.005 2.594 . . . . 0.0 118.005 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -70.01 -15.37 63.01 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.43 -0.794 . . . . 0.0 111.48 179.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -64.38 -29.67 70.74 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.664 -0.648 . . . . 0.0 109.687 -178.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.444 ' HA ' ' HE2' ' A' ' 101' ' ' LYS . 78.0 mm-40 -67.29 -18.32 65.14 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.635 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.461 HD11 ' HD2' ' A' ' 54' ' ' ARG . 10.1 mm -87.16 -38.4 12.11 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.667 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.04 -39.57 82.39 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.419 0.628 . . . . 0.0 112.477 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 98' ' ' GLU . 48.0 pttt -89.63 3.79 51.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.763 -178.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -102.22 107.19 18.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.805 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.5 m -68.31 123.19 20.07 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 175.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -85.65 125.35 33.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 178.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -125.89 127.32 45.82 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 121.688 0.756 . . . . 0.0 109.496 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -143.72 113.12 6.92 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.249 -178.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 55.39 -126.28 38.8 Favored Glycine 0 C--O 1.24 0.502 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.294 178.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.2 p -84.55 15.2 3.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.527 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.4 t -119.29 148.77 22.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.309 0.576 . . . . 0.0 112.216 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 t -139.31 140.07 37.48 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 100.598 -3.853 . . . . 0.0 100.598 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.8 t -136.29 133.94 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -101.07 111.68 63.82 Favored Pre-proline 0 C--O 1.244 0.781 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 174.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -78.2 153.37 28.09 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 117.058 -1.495 . . . . 0.0 111.376 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.61 151.63 34.1 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.61 137.56 16.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.1 t -116.87 107.9 23.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 177.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.21 141.17 28.86 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.65 -19.9 61.04 Favored Glycine 0 C--O 1.228 -0.28 0 N-CA-C 114.435 0.534 . . . . 0.0 114.435 -177.265 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 38.8 p -62.69 -29.47 70.67 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.631 0.975 . . . . 0.0 113.631 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.8 ptm -144.42 40.55 1.33 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.05 -43.63 30.57 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -173.214 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -43.8 97.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 119.069 0.849 . . . . 0.0 111.844 -176.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -73.68 -39.13 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.911 0.386 . . . . 0.0 111.232 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.47 -39.76 92.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.492 0.663 . . . . 0.0 110.445 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -63.71 -49.41 73.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.019 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -70.49 -15.45 62.8 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.881 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.61 64.61 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 31.7 t -91.86 -44.64 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 121.458 0.647 . . . . 0.0 110.689 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -124.97 77.98 66.21 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.123 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.2 -6.64 19.3 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 118.611 -0.459 . . . . 0.0 112.476 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 49.2 p -88.11 -5.72 58.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.677 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -79.2 124.15 28.08 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -85.23 99.94 11.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.649 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 23.2 p -68.41 -23.82 64.68 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 176.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -68.27 -38.19 81.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.415 178.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.32 -31.53 70.06 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 5.8 p -169.1 127.2 0.99 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.501 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 90.8 p -126.48 163.04 24.23 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -25.17 62.5 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -63.6 -32.21 73.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.083 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -98.67 24.52 7.42 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.494 0.664 . . . . 0.0 109.979 179.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -127.27 -163.51 1.26 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.795 0.807 . . . . 0.0 110.477 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 99.4 p -154.16 168.07 27.76 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -66.71 -28.96 68.85 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.475 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -67.78 -33.5 74.95 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.985 0.898 . . . . 0.0 109.89 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -60.77 -24.39 65.74 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.488 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.84 95.29 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.731 0.241 . . . . 0.0 110.629 178.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -64.25 -44.82 90.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.7 mtm -62.76 -29.97 71.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.862 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.3 83.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 177.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -64.8 -45.72 85.08 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.623 0.249 . . . . 0.0 110.426 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -60.03 -44.32 94.7 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.317 0.579 . . . . 0.0 110.556 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -69.78 -28.53 65.82 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.083 -0.385 . . . . 0.0 111.071 178.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -66.45 -37.48 85.24 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.13 -34.68 78.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.83 0.347 . . . . 0.0 110.127 178.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 m -74.23 -38.02 63.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.678 0.751 . . . . 0.0 110.551 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.65 -39.92 88.46 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.6 p -60.61 -34.84 60.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 CA-C-N 118.934 0.788 . . . . 0.0 110.278 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -71.49 -41.09 69.73 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 108.914 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -64.17 -26.04 68.35 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.628 -0.67 . . . . 0.0 110.948 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.88 -28.61 51.58 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.848 -0.532 . . . . 0.0 111.368 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -62.81 -34.31 77.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.252 0.549 . . . . 0.0 110.294 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -76.06 -43.44 43.73 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -60.83 -32.76 72.14 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -57.36 -17.73 13.98 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -58.75 -16.82 18.47 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 177.427 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 21.5 p -62.66 -17.76 61.09 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 177.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.48 -22.76 63.88 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.231 0.468 . . . . 0.0 111.68 178.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -72.87 -14.21 61.44 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -104.85 137.68 42.26 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 21.9 t -88.67 93.3 4.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.059 0.457 . . . . 0.0 112.056 -176.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -156.95 162.12 39.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 174.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -164.02 -62.59 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 177.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 3.4 m120 58.66 19.26 6.59 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 174.12 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -94.67 166.81 26.66 Favored Glycine 0 N--CA 1.454 -0.161 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 178.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -141.38 134.05 28.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.5 mp -130.84 161.27 32.16 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -152.93 157.56 40.8 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 177.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 43.0 ttt-85 -155.9 146.24 21.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -70.88 160.05 33.51 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -154.74 153.57 31.46 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.509 ' HG ' ' H ' ' A' ' 184' ' ' PHE . 28.5 tp -151.29 146.36 25.98 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 -178.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -72.19 -18.71 61.83 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 184' ' ' PHE . . . . . 0.509 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 1.3 t80 66.22 167.15 0.21 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.061 1.344 . . . . 0.0 114.217 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.9 0 CA-C-O 116.141 -1.885 . . . . 0.0 106.402 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 mtt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.87 0.366 . . . . 25.0 110.866 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.04 150.66 32.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.882 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.54 -42.85 71.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 25.0 110.979 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.4 mt -61.38 -35.91 78.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 25.0 110.884 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -51.96 -39.9 60.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.799 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -52.08 -39.54 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.87 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.928 HG21 HD21 ' A' ' 121' ' ' LEU . 0.2 OUTLIER -70.44 -54.31 12.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.092 -0.503 . . . . 25.0 111.118 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -51.9 -43.98 63.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 25.0 110.914 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -71.98 -34.65 69.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -55.34 28.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.908 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.452 HG22 HD23 ' A' ' 15' ' ' LEU . 42.1 mm -59.72 -37.4 70.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.251 -0.431 . . . . 25.0 111.093 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.26 -53.74 32.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 25.0 111.107 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.444 ' HB1' HD22 ' A' ' 157' ' ' LEU . . . -60.01 -35.63 75.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 25.0 111.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -61.27 -54.97 37.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.865 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.62 ' HB3' HD22 ' A' ' 33' ' ' LEU . 4.3 mm? -56.07 -55.31 34.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.932 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.549 HG12 ' HG2' ' A' ' 161' ' ' GLN . 95.1 t -53.27 -51.88 36.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.117 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -58.47 -33.72 70.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.923 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.69 -16.57 64.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.821 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 117.95 -24.91 8.65 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 25.0 112.445 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -51.2 103.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 25.0 110.833 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.34 149.79 34.94 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.705 -0.76 . . . . 25.0 112.516 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.577 HG11 ' HB2' ' A' ' 25' ' ' ALA . 21.8 t -90.29 106.71 17.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.814 0.34 . . . . 25.0 111.099 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.9 mt -69.53 -35.69 67.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 25.0 111.137 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -161.03 118.98 2.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.577 ' HB2' HG11 ' A' ' 22' ' ' VAL . . . -140.31 110.77 6.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 25.0 111.086 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 133.2 49.9 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.843 -0.694 . . . . 25.0 112.573 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.31 -57.64 2.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.887 0.375 . . . . 25.0 110.873 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -179.35 -73.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 25.0 110.913 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -139.25 35.19 2.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 25.0 110.801 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.13 128.83 18.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.871 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 78.1 mt -141.49 131.93 26.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.101 -0.5 . . . . 25.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.7 m95 -101.33 149.66 23.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 25.0 110.864 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.62 HD22 ' HB3' ' A' ' 15' ' ' LEU . 1.8 mt -140.74 116.74 10.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 25.0 110.913 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.553 ' HA ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -74.48 146.35 42.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 25.0 110.894 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.434 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . . . -103.42 104.11 39.49 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.677 0.751 . . . . 25.0 111.085 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 35' ' ' ALA . 54.0 Cg_endo -69.84 -32.22 18.65 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.636 2.224 . . . . 25.0 112.279 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -57.57 -27.02 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.306 -0.407 . . . . 25.0 110.858 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.9 mttt 66.07 44.65 2.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.907 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 p -83.91 -176.71 6.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.43 . . . . 25.0 110.806 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.42 -35.0 17.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 25.0 110.851 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.55 132.13 35.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.934 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASP . . . . . 0.682 ' O ' HD23 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.36 -65.26 0.95 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 25.0 110.937 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.682 HD23 ' O ' ' A' ' 42' ' ' ASP . 18.8 mt -138.37 166.66 23.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.949 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.37 129.23 73.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 25.0 111.093 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.431 ' HB2' HD11 ' A' ' 82' ' ' LEU . 42.4 ttt180 -115.95 146.67 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 25.0 110.859 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.3 tp -123.83 110.33 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 25.0 110.974 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -116.72 140.61 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.287 -0.415 . . . . 25.0 110.966 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -125.65 101.52 6.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.52 . . . . 25.0 110.889 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -144.08 148.76 35.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 25.0 110.898 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -78.82 146.05 33.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 25.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.0 129.62 36.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.927 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.63 -52.2 2.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.108 -0.496 . . . . 25.0 110.804 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -99.83 168.41 9.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 25.0 110.956 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -34.48 36.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.828 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -54.68 -34.92 62.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 25.0 110.957 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -65.78 -33.38 75.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 25.0 110.84 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.498 ' HG2' HG21 ' A' ' 99' ' ' ILE . 1.5 tpp -58.15 -52.91 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.839 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.593 HG13 HG12 ' A' ' 99' ' ' ILE . 24.8 m -68.86 -33.04 57.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.234 -0.439 . . . . 25.0 111.12 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -26.22 68.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 25.0 110.805 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -77.26 -29.98 54.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 25.0 110.884 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.457 HG21 ' HB2' ' A' ' 104' ' ' PHE . 8.1 mm -73.62 -43.26 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 25.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -29.12 16.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.271 -0.422 . . . . 25.0 110.887 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.76 -35.95 57.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 25.0 110.895 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.744 ' O ' HG23 ' A' ' 68' ' ' VAL . 1.1 mp0 -58.4 -51.43 69.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.468 . . . . 25.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.06 -35.9 48.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.154 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -61.74 -43.43 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.446 . . . . 25.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -35.52 58.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.277 -0.42 . . . . 25.0 110.866 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.948 HG11 HG13 ' A' ' 109' ' ' VAL . 81.1 t -52.79 -36.6 23.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 25.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -61.19 -36.1 78.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 25.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -48.41 81.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.898 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' VAL . . . . . 0.573 HG11 HD11 ' A' ' 43' ' ' LEU . 21.7 t -74.82 -41.49 46.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 25.0 111.188 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.83 -36.31 47.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.846 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -72.32 -35.94 68.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.825 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -47.28 53.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.43 . . . . 25.0 110.887 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.6 HD23 ' HD2' ' A' ' 77' ' ' ARG . 4.4 mp -70.88 -19.61 62.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 25.0 110.956 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.74 33.37 87.07 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.845 -0.693 . . . . 25.0 112.497 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.6 ' HD2' HD23 ' A' ' 75' ' ' LEU . 71.9 mtt-85 -103.63 176.17 5.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 25.0 110.847 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.444 ' O ' HG22 ' A' ' 108' ' ' THR . 0.1 OUTLIER -85.29 -52.96 5.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.935 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -127.03 144.77 50.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.116 -0.493 . . . . 25.0 110.805 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.561 ' HB3' HG13 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -116.83 111.57 19.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.854 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -82.08 119.18 23.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.914 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.431 HD11 ' HB2' ' A' ' 45' ' ' ARG . 5.7 tt -130.7 135.18 47.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.904 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.4 tp -99.43 107.44 19.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 25.0 110.896 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.408 ' O ' ' HB3' ' A' ' 114' ' ' ALA . 1.7 t30 -105.36 108.89 20.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 25.0 110.87 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.569 ' CG1' HG23 ' A' ' 116' ' ' VAL . 21.8 t -106.41 146.43 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 25.0 111.174 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -108.16 137.59 45.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -114.12 103.66 11.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 25.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 p -131.06 169.25 16.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.862 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.8 t -67.09 -35.29 79.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 25.0 111.126 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -162.78 176.03 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.434 . . . . 25.0 110.853 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.603 ' HB1' ' HD2' ' A' ' 92' ' ' PRO . . . -73.68 161.34 79.24 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.533 0.683 . . . . 25.0 111.099 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.603 ' HD2' ' HB1' ' A' ' 91' ' ' ALA . 53.1 Cg_endo -69.92 176.86 6.32 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.651 2.234 . . . . 25.0 112.324 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.441 HG23 ' N ' ' A' ' 94' ' ' ASP . 10.6 m -51.46 -47.36 35.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.109 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.441 ' N ' HG23 ' A' ' 93' ' ' VAL . 0.2 OUTLIER 171.92 -172.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 25.0 110.868 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 57.48 38.79 28.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.43 ' HZ3' ' HB2' ' A' ' 100' ' ' ALA . 18.2 p-90 -120.57 -32.2 4.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 25.0 110.907 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -51.83 -35.28 43.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.861 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.87 -40.24 96.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 25.0 110.858 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.593 HG12 HG13 ' A' ' 58' ' ' VAL . 2.4 mp -65.02 -47.77 86.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 25.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.43 ' HB2' ' HZ3' ' A' ' 96' ' ' TRP . . . -50.9 -30.35 14.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 25.0 111.087 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.55 -38.19 12.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.944 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.28 139.88 58.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 25.0 110.921 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.9 m -101.89 143.66 31.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.44 . . . . 25.0 111.183 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.457 ' HB2' HG21 ' A' ' 61' ' ' ILE . 7.9 t80 -97.14 104.28 16.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.858 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -112.92 100.97 9.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 25.0 110.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -101.74 86.81 3.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.43 -112.43 4.97 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.726 -0.749 . . . . 25.0 112.458 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' THR . . . . . 0.444 HG22 ' O ' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -95.0 30.01 2.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.355 . . . . 25.0 111.252 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.948 HG13 HG11 ' A' ' 68' ' ' VAL . 18.3 t -119.39 151.82 21.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 25.0 111.043 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 36.2 p -137.05 112.55 9.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.044 -0.526 . . . . 25.0 110.794 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -142.81 139.1 28.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.041 -0.527 . . . . 25.0 111.101 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -116.32 136.0 22.97 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.691 0.758 . . . . 25.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 149.16 66.24 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.669 2.246 . . . . 25.0 112.317 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' A' ' 85' ' ' VAL . . . -152.72 136.56 16.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.279 -0.418 . . . . 25.0 111.119 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.1 tt -138.83 144.21 30.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.159 -0.473 . . . . 25.0 111.093 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.744 HG13 ' CB ' ' A' ' 124' ' ' ASP . 90.8 t -124.57 124.91 69.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 25.0 111.196 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.567 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -70.65 140.06 51.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 25.0 110.834 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -75.04 -33.12 55.52 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.706 -0.759 . . . . 25.0 112.489 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.766 HG23 ' HG2' ' A' ' 120' ' ' MET . 5.1 t -84.63 -34.05 23.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 25.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' MET . . . . . 0.766 ' HG2' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER -111.08 33.04 4.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 25.0 110.835 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.928 HD21 HG21 ' A' ' 7' ' ' THR . 3.2 tt -52.68 -36.2 56.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.416 . . . . 25.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -58.55 -37.46 75.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.855 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.03 -35.82 64.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 25.0 110.927 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.744 ' CB ' HG13 ' A' ' 116' ' ' VAL . 3.4 m-20 -72.61 -38.13 67.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 25.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -52.22 -42.79 63.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.925 -179.939 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -79.83 -34.97 38.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 25.0 110.886 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.12 -33.81 76.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 25.0 111.112 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.55 -60.13 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 25.0 111.108 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -113.09 76.18 2.3 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.762 0.792 . . . . 25.0 110.944 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -30.71 22.04 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.727 2.285 . . . . 25.0 112.311 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 t -69.6 -16.32 63.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.265 -0.425 . . . . 25.0 110.863 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -70.45 139.69 51.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.828 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -67.54 91.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 25.0 110.934 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.76 16.14 24.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 25.0 111.148 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.76 -53.22 7.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.861 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -58.68 -35.79 73.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.489 . . . . 25.0 110.889 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -53.71 121.05 7.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 25.0 110.885 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -148.66 137.03 21.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 25.0 110.861 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.98 -37.95 67.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 25.0 110.915 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -60.45 -40.04 89.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 25.0 110.874 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -97.68 25.81 5.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.905 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -114.81 132.72 56.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 25.0 111.074 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 4.1 t -164.5 164.13 21.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 25.0 110.776 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 54.1 p90 -61.4 -36.2 79.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.495 . . . . 25.0 110.873 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -67.52 -36.13 80.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 25.0 110.896 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.43 -37.91 70.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.459 . . . . 25.0 110.861 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.57 -49.72 75.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 25.0 111.064 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -36.63 66.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 25.0 110.878 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.0 mtt -68.93 -41.44 78.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.932 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.64 -38.62 72.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 25.0 111.088 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -63.72 -53.68 47.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 25.0 110.871 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.08 -43.74 64.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.275 -0.42 . . . . 25.0 110.839 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -66.54 -38.96 88.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 25.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.32 -46.47 88.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.51 -36.32 55.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.93 -36.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 25.0 110.878 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.444 HD22 ' HB1' ' A' ' 13' ' ' ALA . 0.7 OUTLIER -62.73 -54.6 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 25.0 110.925 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.0 -35.95 23.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 25.0 111.13 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -63.94 -60.56 3.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 25.0 110.999 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -56.39 -35.37 67.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.892 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' GLN . . . . . 0.549 ' HG2' HG12 ' A' ' 16' ' ' VAL . 7.9 tp-100 -54.79 -35.06 63.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 25.0 110.857 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.92 -51.45 69.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.251 -0.431 . . . . 25.0 110.91 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -68.41 -36.04 78.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.919 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -67.83 -36.14 79.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.453 . . . . 25.0 110.907 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -37.58 55.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.127 -0.488 . . . . 25.0 110.862 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -38.89 58.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.159 -0.473 . . . . 25.0 110.891 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 167' ' ' THR . . . . . 0.564 ' O ' HG22 ' A' ' 171' ' ' VAL . 0.3 OUTLIER -72.42 -41.5 66.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 25.0 111.079 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -51.56 -34.51 37.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.222 -0.445 . . . . 25.0 110.913 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -69.08 -35.03 76.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.079 -0.51 . . . . 25.0 111.122 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -70.29 -66.21 0.63 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 25.0 111.097 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 167' ' ' THR . 0.0 OUTLIER -40.97 -78.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 25.0 111.154 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 172' ' ' PHE . . . . . 0.45 ' H ' HG23 ' A' ' 171' ' ' VAL . 0.1 OUTLIER 175.08 -67.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 25.0 110.898 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -148.28 177.89 9.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.959 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -168.02 142.01 3.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 25.0 110.906 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 106.89 163.01 22.19 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.691 -0.766 . . . . 25.0 112.435 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -156.87 176.39 12.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 25.0 110.884 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -171.16 169.23 6.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.917 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -171.9 -179.54 2.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.483 . . . . 25.0 110.939 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 62.18 98.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 25.0 110.847 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.27 92.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 25.0 110.939 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -179.08 -171.45 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 25.0 110.911 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 62.86 163.18 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.13 -0.486 . . . . 25.0 110.883 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 31.5 p90 -174.61 137.57 0.48 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.809 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.25 110.17 13.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.066 -0.516 . . . . 25.0 110.823 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 25.0 110.924 -180.0 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.3 mtp . . . . . 0 N--CA 1.498 1.935 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -67.12 30.85 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 117.808 2.522 . . . . 0.0 117.808 -175.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.9 tt -67.48 -48.64 66.57 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 120.786 -1.196 . . . . 0.0 108.965 -179.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.12 -35.06 79.03 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.335 0.588 . . . . 0.0 110.887 177.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -59.62 -27.17 66.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.107 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.49 -48.98 78.63 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.6 m -67.44 -38.76 85.02 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.968 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -55.17 -53.43 56.01 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -65.95 -30.87 71.51 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.953 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.68 -33.38 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.088 -0.382 . . . . 0.0 111.85 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.423 HD11 HD11 ' A' ' 125' ' ' LEU . 7.4 mm -68.04 -43.66 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.348 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.36 -43.61 88.48 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.32 96.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.36 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -59.03 -46.02 89.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.143 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.28 -53.2 39.59 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.29 -0.164 . . . . 0.0 111.025 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 73.1 t -53.99 -44.47 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.944 -0.473 . . . . 0.0 111.883 178.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.83 -16.28 64.02 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.462 -0.774 . . . . 0.0 112.722 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.2 m -89.79 1.24 56.38 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.423 0.289 . . . . 0.0 110.924 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.06 -1.0 28.45 Favored Glycine 0 C--O 1.228 -0.278 0 N-CA-C 115.887 1.115 . . . . 0.0 115.887 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.464 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 37.7 m-85 -68.63 118.51 11.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 117.974 0.887 . . . . 0.0 109.39 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.86 130.82 11.93 Favored Glycine 0 CA--C 1.508 -0.386 0 N-CA-C 111.051 -0.819 . . . . 0.0 111.051 -177.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.6 t -75.47 130.31 36.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.14 0.495 . . . . 0.0 110.164 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.9 mt -102.46 -44.54 10.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 175.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -150.62 138.63 20.08 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.21 105.41 5.03 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 -177.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.09 42.73 50.53 Favored Glycine 0 CA--C 1.503 -0.668 0 N-CA-C 116.655 1.422 . . . . 0.0 116.655 167.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -59.18 -44.26 92.16 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.2 p -156.75 -71.94 0.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.648 176.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -121.85 8.08 9.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.305 -0.862 . . . . 0.0 113.218 -176.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -131.48 138.61 49.06 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -171.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.9 mt -138.96 137.26 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -120.79 133.55 55.32 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.151 0.58 . . . . 0.0 109.967 177.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.4 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 2.6 mp -131.07 137.28 49.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.908 0.883 . . . . 0.0 110.272 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -86.17 137.04 32.95 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.78 118.25 70.9 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 84.8 Cg_endo -76.26 -25.45 9.95 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 117.192 -1.405 . . . . 0.0 112.035 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -72.94 -30.52 63.93 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.393 1.077 . . . . 0.0 112.012 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.2 mttp 55.99 39.24 30.54 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.722 1.249 . . . . 0.0 111.554 177.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.2 t -77.66 -172.99 2.81 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 104.48 -2.415 . . . . 0.0 104.48 170.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -41.4 -1.78 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.071 1 N-CA-C 121.945 4.054 . . . . 0.0 121.945 -178.15 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -132.95 125.37 29.66 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -74.58 -33.63 62.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.589 0.709 . . . . 0.0 109.54 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.06 161.03 37.81 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.711 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.7 t -130.79 139.06 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -123.87 136.38 54.32 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tp -113.21 124.97 53.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -136.45 135.56 38.76 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -118.5 100.09 7.23 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.063 0.459 . . . . 0.0 112.177 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.41 150.23 30.21 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -87.82 151.41 22.88 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.6 mt -138.22 120.28 15.59 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -88.14 -33.41 18.22 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.098 0.475 . . . . 0.0 110.755 -178.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -129.87 149.9 51.4 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.494 ' HD2' HD11 ' A' ' 99' ' ' ILE . 15.0 ptt180 -66.93 -22.42 65.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.673 -0.642 . . . . 0.0 111.147 -179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -32.69 73.77 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -74.37 -39.5 62.7 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 46.3 ttm -58.54 -48.59 80.38 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.279 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 20.8 m -63.2 -31.9 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 122.037 -0.414 . . . . 0.0 111.59 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -70.07 -34.13 72.8 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.834 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.22 -42.56 91.3 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 175.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -66.17 -31.28 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -63.82 -39.54 94.47 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -76.64 -41.98 43.85 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -57.48 -36.58 71.67 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 113.034 0.754 . . . . 0.0 113.034 178.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.488 ' HA ' HG11 ' A' ' 109' ' ' VAL . . . -61.89 -37.28 84.0 Favored 'General case' 0 C--O 1.208 -1.124 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -37.28 77.39 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.815 0.341 . . . . 0.0 110.471 177.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -61.16 -47.69 85.04 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.481 HG11 HG13 ' A' ' 109' ' ' VAL . 75.4 t -65.12 -40.72 89.78 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.408 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.31 -40.83 83.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -65.23 -44.74 87.25 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.733 -0.605 . . . . 0.0 110.884 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.7 t -67.01 -36.97 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-O 121.231 0.538 . . . . 0.0 110.176 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.07 -44.52 94.68 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.812 -0.555 . . . . 0.0 110.749 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -65.59 -41.08 93.22 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.2 -40.0 92.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.2 mp -94.57 -0.07 54.83 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.07 15.38 65.07 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 116.241 1.256 . . . . 0.0 116.241 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.8 mtt-85 -72.47 142.86 48.59 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.25 -32.99 67.17 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.35 -0.843 . . . . 0.0 112.979 -177.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.45 160.82 43.12 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 102.31 -3.218 . . . . 0.0 102.31 178.174 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.6 mtp -141.86 148.23 38.44 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.858 1.208 . . . . 0.0 113.004 178.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -117.6 141.27 48.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 174.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.2 tp -128.26 135.44 49.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 68.0 tp -94.14 119.5 33.06 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 170.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -115.04 108.73 17.06 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -177.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.4 t -107.68 118.44 55.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -176.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -88.01 146.21 25.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.226 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -121.47 116.86 25.5 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 172.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 78.2 p -136.45 160.32 39.11 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.226 0.329 . . . . 0.0 110.722 -174.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.2 t -76.87 -29.24 55.73 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.583 -0.698 . . . . 0.0 111.381 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -150.7 164.08 37.01 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 106.26 -1.755 . . . . 0.0 106.26 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.88 152.78 41.87 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -177.321 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -59.4 149.21 82.83 Favored 'Trans proline' 0 C--N 1.349 0.579 0 O-C-N 122.367 0.667 . . . . 0.0 113.42 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.8 m -77.79 -16.14 14.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 117.317 2.34 . . . . 0.0 117.317 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -120.73 100.26 7.01 Favored 'General case' 0 C--O 1.21 -0.991 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -175.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 44.6 31.46 0.63 Allowed 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 117.29 2.33 . . . . 0.0 117.29 172.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.7 p-90 -61.94 -22.23 65.44 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.461 -0.775 . . . . 0.0 112.642 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.88 -31.28 69.65 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.04 -0.413 . . . . 0.0 111.664 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -58.75 -39.85 82.14 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.768 -0.826 . . . . 0.0 108.768 177.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.494 HD11 ' HD2' ' A' ' 54' ' ' ARG . 8.8 mm -63.89 -39.35 85.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.04 -177.12 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.28 -10.33 57.33 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -112.0 3.81 17.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -109.88 105.85 15.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.852 -175.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.0 m -68.36 122.42 18.35 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 174.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -84.05 122.55 28.94 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -123.01 132.87 54.32 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.783 0.802 . . . . 0.0 109.643 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -147.61 125.48 11.97 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.23 -119.42 13.0 Favored Glycine 0 C--O 1.227 -0.343 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -176.797 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -119.23 19.34 12.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.167 0.984 . . . . 0.0 108.576 175.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 65' ' ' ALA . 84.6 t -97.14 138.45 22.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.618 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -126.12 139.98 52.94 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 172.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.2 t -132.72 136.76 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.262 0 CA-C-O 121.813 0.816 . . . . 0.0 110.347 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.2 103.37 47.9 Favored Pre-proline 0 N--CA 1.433 -1.279 0 CA-C-N 113.422 -1.717 . . . . 0.0 109.347 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.18 152.61 27.62 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 115.636 -2.443 . . . . 0.0 112.483 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.69 154.69 38.96 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.63 -2.73 . . . . 0.0 103.63 175.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -150.76 135.89 10.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.5 m -111.99 138.03 42.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 172.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.44 142.57 47.43 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.76 -27.68 59.36 Favored Glycine 0 C--O 1.227 -0.283 0 CA-C-N 115.956 -0.565 . . . . 0.0 114.169 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.8 p -55.45 -30.03 59.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.84 26.27 2.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.352 0.596 . . . . 0.0 110.527 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 27.6 tp -43.51 -44.04 5.79 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -170.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -60.91 -43.27 98.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 119.118 0.872 . . . . 0.0 112.068 -177.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -74.95 -38.7 61.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 122.282 1.039 . . . . 0.0 110.564 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.82 -38.97 92.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.035 0.921 . . . . 0.0 111.686 -177.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.423 HD11 HD11 ' A' ' 11' ' ' ILE . 2.5 tm? -61.78 -50.04 73.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.102 -178.62 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -72.06 -15.7 62.02 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.404 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.21 -34.67 63.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 56.2 t -91.18 -41.51 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.113 0.482 . . . . 0.0 109.979 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -124.24 76.33 60.65 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 122.882 0.473 . . . . 0.0 111.532 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.13 -11.64 32.15 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 117.726 -1.049 . . . . 0.0 112.181 177.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 24.7 p -76.27 -8.74 57.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.556 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -93.21 131.41 38.33 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.195 0.521 . . . . 0.0 109.598 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 -75.12 113.9 12.99 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 22.9 p -62.19 -27.34 68.9 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.93 -23.76 66.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 178.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -65.35 -29.27 69.98 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 177.459 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 22.9 t -114.23 52.73 0.82 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.385 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.8 t -56.17 145.44 26.23 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 177.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -60.33 -29.56 68.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.444 0.64 . . . . 0.0 110.394 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -66.03 -29.78 70.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.654 0.74 . . . . 0.0 111.622 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -95.74 -14.69 23.15 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.435 -174.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -78.12 71.94 4.62 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -175.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 59.6 p -114.39 153.67 29.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.343 0.592 . . . . 0.0 111.005 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 35.3 p90 -63.8 -28.75 70.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.243 0.544 . . . . 0.0 110.471 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -66.57 -48.13 70.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.485 0.66 . . . . 0.0 109.397 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -68.45 -24.39 64.72 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.847 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.89 -36.79 70.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 177.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.83 -41.27 95.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.467 0.651 . . . . 0.0 109.382 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 45.9 mtt -68.36 -35.44 77.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.517 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.2 -30.73 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.315 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.97 -48.27 74.62 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.01 -40.58 91.23 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.568 0.699 . . . . 0.0 110.007 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -60.26 -38.92 84.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.394 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -68.18 -45.42 73.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.706 -0.224 . . . . 0.0 110.905 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.19 -39.02 91.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.307 0.575 . . . . 0.0 110.028 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 42.0 m -66.32 -34.59 78.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.04 0.448 . . . . 0.0 110.577 177.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.3 tt -67.33 -39.9 85.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.762 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 66.9 t -58.49 -50.02 80.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.29 -40.4 93.81 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.142 -0.623 . . . . 0.0 110.968 -178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 12.5 ttpp -56.38 -40.15 74.11 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.864 -0.523 . . . . 0.0 110.571 176.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -56.46 -31.38 63.93 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -175.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -65.11 -39.54 93.25 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.067 0.461 . . . . 0.0 110.426 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -76.91 -44.34 32.14 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.757 -0.589 . . . . 0.0 109.463 174.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -55.26 -38.54 68.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -174.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -62.08 -17.48 57.71 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -55.59 -17.83 6.39 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 18.9 p -62.52 -17.62 60.16 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.616 0.367 . . . . 0.0 111.703 176.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.35 -33.19 65.43 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.408 0.683 . . . . 0.0 110.282 176.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -65.06 -14.03 59.45 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -84.92 -1.01 56.13 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.8 t 44.94 70.29 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 173.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -143.86 168.09 20.78 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -126.15 145.38 50.38 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -162.12 174.51 12.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 104.27 177.74 25.26 Favored Glycine 0 C--O 1.23 -0.122 0 CA-C-O 121.189 0.327 . . . . 0.0 113.577 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -151.75 137.41 17.88 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 104.659 -2.348 . . . . 0.0 104.659 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.5 tt -158.24 124.05 4.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 118.061 0.391 . . . . 0.0 109.976 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 -132.65 151.27 52.0 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 104.327 -2.471 . . . . 0.0 104.327 175.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.37 -34.73 48.11 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.931 -0.708 . . . . 0.0 109.768 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 37.64 55.0 1.5 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 178.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -143.93 156.42 44.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.218 -178.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 26.9 tp -129.06 169.34 14.84 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 44.0 p90 -148.75 164.83 33.22 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -134.32 166.4 22.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.902 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.3 ptp . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -97.93 36.38 1.56 Allowed 'General case' 0 C--O 1.22 -0.484 0 CA-C-O 121.278 0.561 . . . . 0.0 112.062 -176.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.3 tt -61.16 -38.18 85.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.114 0.483 . . . . 0.0 109.905 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 69.7 mt -64.1 -42.71 96.8 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.402 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -67.17 -38.48 85.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.667 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -60.9 -50.7 72.37 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.6 m -59.77 -40.1 87.11 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 121.075 0.464 . . . . 0.0 111.008 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -59.7 -45.13 93.07 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -75.6 -34.23 60.6 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.791 1.281 . . . . 0.0 108.776 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tptt -64.63 -39.65 94.09 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.834 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.5 mm -72.1 -40.47 66.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 -42.31 84.24 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.26 98.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -62.07 -46.91 87.04 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.352 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -63.48 -48.04 79.29 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.051 -0.406 . . . . 0.0 110.718 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.6 -37.19 79.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.014 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -74.2 -10.5 59.67 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.077 -1.014 . . . . 0.0 111.765 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.0 m -94.77 12.69 27.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.0 2.63 66.33 Favored Glycine 0 CA--C 1.517 0.204 0 N-CA-C 116.496 1.359 . . . . 0.0 116.496 175.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -70.36 115.09 9.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 118.444 1.122 . . . . 0.0 109.237 178.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.34 133.86 20.44 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.0 t -78.6 118.69 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.519 HD11 HD22 ' A' ' 43' ' ' LEU . 40.6 mt -90.27 -44.92 14.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 177.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -149.65 124.65 9.99 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.451 -177.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.12 135.57 32.65 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 104.689 -2.337 . . . . 0.0 104.689 173.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.25 -82.75 0.05 OUTLIER Glycine 0 CA--C 1.507 -0.435 0 C-N-CA 120.257 -0.973 . . . . 0.0 112.539 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -70.56 158.2 36.55 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.94 -13.08 59.1 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -178.686 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -84.15 -41.69 16.79 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 115.667 1.728 . . . . 0.0 115.667 -174.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -136.93 147.09 46.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 116.511 2.041 . . . . 0.0 116.511 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.1 mt -136.36 130.05 47.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 174.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.9 m95 -103.23 127.25 50.6 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 177.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -123.02 142.37 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.039 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -92.26 133.84 35.45 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 175.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.22 114.0 29.07 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.22 -29.13 14.65 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 116.667 -1.756 . . . . 0.0 113.245 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -74.15 -11.76 60.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.006 0.523 . . . . 0.0 111.279 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 mttm 59.4 41.6 19.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 123.355 1.55 . . . . 0.0 107.896 -178.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -177.57 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 110.898 -2.864 . . . . 0.0 117.952 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 p -50.4 -26.78 5.35 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.537 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -117.12 139.09 51.16 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -81.98 -35.04 29.4 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.519 HD22 HD11 ' A' ' 23' ' ' ILE . 73.4 mt -133.62 158.84 42.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.831 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.58 134.38 66.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -116.39 102.86 9.9 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.18 129.17 34.3 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.167 -2.16 . . . . 0.0 105.167 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -136.37 138.32 41.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -105.22 95.22 5.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.73 122.78 7.63 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.203 0.525 . . . . 0.0 111.065 -178.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -91.54 134.56 34.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -124.36 126.61 46.27 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -171.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -72.9 -41.18 64.9 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -129.18 152.07 49.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -63.41 -19.72 64.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -73.22 -33.01 65.1 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 121.982 -0.449 . . . . 0.0 109.938 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -67.25 -28.41 68.02 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.755 -0.591 . . . . 0.0 109.484 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 77.4 mtp -63.86 -51.73 63.26 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 9.1 m -65.8 -31.79 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.541 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -61.46 -43.91 98.03 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.543 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -64.52 -46.61 82.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.278 0.561 . . . . 0.0 110.187 -178.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mp -68.22 -33.25 59.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 121.272 -0.892 . . . . 0.0 110.618 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.188 -0.945 . . . . 0.0 110.08 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -76.56 -43.64 38.16 Favored 'General case' 0 C--O 1.243 0.729 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.404 ' O ' HG23 ' A' ' 68' ' ' VAL . 55.4 mt-30 -56.93 -40.08 75.68 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.628 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -35.88 75.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.045 0.384 . . . . 0.0 111.276 -178.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -72.46 -40.05 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.502 0.667 . . . . 0.0 109.308 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.4 -38.57 84.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.554 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 64' ' ' GLN . 89.3 t -70.43 -38.4 73.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 CA-C-O 118.628 -0.701 . . . . 0.0 110.802 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.84 -34.32 77.1 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.414 1.461 . . . . 0.0 110.123 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttt-85 -62.56 -44.8 95.43 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.611 -0.436 . . . . 0.0 109.926 175.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 84.4 t -66.62 -41.39 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.19 -42.87 77.82 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 123.271 0.628 . . . . 0.0 109.411 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -67.7 -40.9 84.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.623 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -58.53 -41.51 85.68 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -100.44 6.65 44.43 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.11 12.38 60.3 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 117.213 1.645 . . . . 0.0 117.213 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.8 ttt85 -62.07 145.1 54.18 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.854 0.827 . . . . 0.0 109.825 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -68.2 -34.91 77.14 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 122.039 -0.413 . . . . 0.0 110.755 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -149.05 160.66 43.13 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.0 mmm -127.92 136.08 50.86 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.48 138.06 50.66 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 tt -138.55 140.98 39.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 118.356 0.525 . . . . 0.0 112.251 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -104.44 118.43 36.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 173.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -107.99 127.38 53.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.3 t -121.79 111.91 32.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 121.363 -0.135 . . . . 0.0 111.171 -178.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -81.59 147.57 29.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -120.76 115.95 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 171.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 t -131.25 160.5 34.72 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.568 0.543 . . . . 0.0 111.128 -173.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.1 m -67.1 -46.75 73.25 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -149.29 170.87 17.51 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.45 152.95 70.87 Favored Pre-proline 0 C--N 1.314 -0.971 0 CA-C-N 115.385 -0.825 . . . . 0.0 108.92 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.75 151.42 47.92 Favored 'Trans proline' 0 C--N 1.35 0.618 0 O-C-N 122.358 0.662 . . . . 0.0 112.008 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -61.18 -20.03 21.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 117.761 2.504 . . . . 0.0 117.761 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -155.51 145.63 21.66 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.6 t0 39.9 30.15 0.06 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 174.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -73.47 -22.4 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.339 -0.85 . . . . 0.0 110.705 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -64.85 -32.02 73.53 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.922 -0.486 . . . . 0.0 111.525 -176.368 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -64.18 -25.11 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.713 -0.395 . . . . 0.0 109.996 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.6 mm -73.96 -43.43 52.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -178.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.83 -16.95 63.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.665 0.745 . . . . 0.0 110.105 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -95.1 4.03 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.61 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -126.64 118.76 25.46 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.7 m -68.28 126.83 30.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 173.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -85.72 111.77 20.43 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -110.67 125.23 53.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.933 0.397 . . . . 0.0 110.951 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.4 ttpp -138.58 101.9 4.46 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.01 -112.72 5.08 Favored Glycine 0 C--N 1.322 -0.231 0 C-N-CA 120.164 -1.017 . . . . 0.0 111.806 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.9 p -89.66 9.15 28.06 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 44.7 t -115.46 143.48 25.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.6 m -127.76 118.18 23.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 171.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.5 t -120.49 130.88 73.97 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.304 0 CA-C-O 121.624 0.726 . . . . 0.0 111.21 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.49 110.9 61.66 Favored Pre-proline 0 N--CA 1.433 -1.322 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.587 177.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -80.14 150.56 20.37 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.169 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.92 154.14 37.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 176.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.0 tt -147.4 125.8 3.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -177.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.7 t -102.37 120.96 52.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.05 136.24 47.24 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -179.387 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.67 -22.53 53.32 Favored Glycine 0 C--O 1.228 -0.257 0 N-CA-C 114.694 0.637 . . . . 0.0 114.694 -177.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 54.3 p -59.47 -32.08 69.91 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.1 ptm -139.89 29.5 2.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 122.051 0.929 . . . . 0.0 108.845 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 tt -46.1 -41.25 12.06 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -172.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -62.35 -45.0 95.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.006 0.821 . . . . 0.0 111.126 -176.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -74.44 -39.75 62.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.783 0.801 . . . . 0.0 111.287 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -66.58 -37.84 85.78 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.007 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 14.4 tp -62.1 -36.37 81.51 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.928 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.33 -15.93 61.88 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.71 -31.37 59.63 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.01 -40.28 10.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.258 -179.03 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -125.83 77.05 70.63 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.441 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -67.49 -19.82 48.42 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.427 0.895 . . . . 0.0 114.427 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.2 m -80.06 -9.46 59.7 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -64.82 140.01 58.82 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.286 0.565 . . . . 0.0 111.346 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -92.93 105.91 17.95 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.576 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 33.7 p -73.86 -20.62 60.37 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 176.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -62.81 -20.11 64.71 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 123.848 0.859 . . . . 0.0 111.838 178.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -77.23 6.64 6.3 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.455 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -157.46 -179.15 7.9 Favored 'General case' 0 C--O 1.221 -0.428 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 25.1 t -150.92 155.32 38.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 103.078 -2.934 . . . . 0.0 103.078 175.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -68.38 -22.73 64.63 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 118.396 0.543 . . . . 0.0 109.985 178.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -65.9 -24.72 66.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.955 0.883 . . . . 0.0 110.662 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 38.3 t60 -82.66 -4.31 57.59 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.774 -175.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -74.44 43.55 0.18 Allowed 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -175.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 73.3 m -66.04 147.21 53.7 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 177.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -64.04 -36.35 83.7 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -69.34 -27.88 65.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.858 0.837 . . . . 0.0 110.027 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -61.86 -26.09 67.93 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.46 -178.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.66 96.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.435 0.636 . . . . 0.0 110.054 177.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -68.92 -39.56 79.58 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 90.5 mtp -65.82 -36.7 84.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.98 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.95 78.78 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.263 . . . . 0.0 110.524 178.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -65.44 -44.85 85.99 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 177.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.02 -44.23 96.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.521 0.677 . . . . 0.0 109.73 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 -61.11 -41.12 96.11 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.645 179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.32 -41.38 98.51 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.66 -38.28 90.5 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.349 -0.844 . . . . 0.0 110.142 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 59.9 p -69.94 -30.02 67.31 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.854 175.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.49 -43.97 92.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.357 0.663 . . . . 0.0 109.898 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 76.7 t -57.95 -46.54 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.659 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -71.43 -37.56 71.43 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.107 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -59.68 -29.88 68.38 Favored 'General case' 0 C--O 1.216 -0.708 0 O-C-N 122.02 -0.425 . . . . 0.0 111.495 178.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -54.89 -31.1 59.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.378 0.535 . . . . 0.0 111.096 178.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -63.13 -36.53 83.92 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.955 0.883 . . . . 0.0 110.95 178.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -76.84 -41.95 42.1 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.16 175.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.5 tm0? -63.78 -40.87 97.72 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -174.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.72 -17.76 10.12 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -61.98 -47.49 84.58 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 122.22 -0.3 . . . . 0.0 110.414 177.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 33.9 p -74.51 -35.35 63.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.105 0.479 . . . . 0.0 110.579 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -60.99 -19.59 61.45 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -178.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -50.74 -13.95 0.17 Allowed 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 63.72 61.65 0.97 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 174.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 32.6 m -76.13 -0.49 2.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.087 175.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -143.01 159.11 42.85 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.063 -2.94 . . . . 0.0 103.063 178.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -160.27 177.72 10.35 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 64.12 21.53 12.6 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.624 1.169 . . . . 0.0 113.388 177.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -95.8 10.8 68.39 Favored Glycine 0 C--O 1.224 -0.491 0 N-CA-C 114.376 0.51 . . . . 0.0 114.376 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -150.34 163.87 37.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.472 0.636 . . . . 0.0 109.75 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 60.3 tp -140.73 -51.97 0.47 Allowed 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.753 0.658 . . . . 0.0 109.41 178.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 53.36 -105.61 0.26 Allowed 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 175.311 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 62.96 74.78 0.42 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.482 1.113 . . . . 0.0 113.164 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -58.19 152.23 17.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.777 177.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -133.48 68.13 1.5 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.211 0.529 . . . . 0.0 111.272 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 62.2 tp -79.47 84.66 5.33 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -153.99 104.29 2.64 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -178.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -126.18 1.38 7.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.528 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.916 0 CA-C-O 116.366 -1.778 . . . . 0.0 110.217 -177.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.8 mtm . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -151.69 155.27 37.97 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.7 tt -54.53 -46.11 73.5 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -176.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -61.75 -30.56 70.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.418 ' HB2' ' HB1' ' A' ' 147' ' ' ALA . 95.7 mt-10 -62.84 -35.46 80.02 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.1 m -61.93 -42.78 99.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.53 0.681 . . . . 0.0 111.845 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -59.92 -51.03 71.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.511 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -69.75 -27.34 64.87 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 121.867 -0.521 . . . . 0.0 111.357 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -66.21 -43.56 86.36 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.811 -0.555 . . . . 0.0 110.886 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.7 mm -70.62 -37.5 69.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.0 -45.35 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.49 -44.52 90.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.377 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -57.58 -46.74 83.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.37 -178.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.12 -50.91 59.79 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -66.0 -31.04 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.54 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -68.16 -14.34 62.9 Favored 'General case' 0 C--O 1.221 -0.425 0 O-C-N 121.855 -0.528 . . . . 0.0 110.719 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.7 m -95.91 8.9 42.35 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 122.767 0.427 . . . . 0.0 109.998 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.64 -2.88 58.94 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 115.435 0.934 . . . . 0.0 115.435 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -65.44 115.23 5.47 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 109.905 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.3 138.57 27.96 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.374 -176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.2 t -83.11 107.35 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.428 HD11 HD22 ' A' ' 43' ' ' LEU . 84.0 mt -71.91 -47.23 56.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.92 130.56 10.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.232 178.063 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.36 136.32 33.04 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 101.146 -3.65 . . . . 0.0 101.146 170.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.02 -59.96 0.06 OUTLIER Glycine 0 CA--C 1.5 -0.88 0 N-CA-C 106.504 -2.638 . . . . 0.0 106.504 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -65.85 145.28 56.14 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 172.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.9 m -77.81 -16.96 57.96 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.911 -176.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -92.37 -19.57 21.96 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 -173.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -142.32 149.72 39.84 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.1 mt -141.25 133.1 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -103.5 130.02 50.8 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.551 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -124.39 141.18 52.28 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -99.29 145.79 26.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.47 105.65 17.02 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.02 -16.47 32.28 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 118.012 -0.858 . . . . 0.0 111.49 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -61.62 -28.7 69.56 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.017 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 58.79 37.79 24.87 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.2 p -76.75 -176.28 3.78 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 112.495 -2.139 . . . . 0.0 109.593 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 p -54.87 -8.91 0.29 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -132.9 136.12 45.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -80.27 -35.94 35.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.305 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 HD11 ' A' ' 23' ' ' ILE . 40.4 mt -138.6 163.34 32.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.116 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.2 p -138.63 139.41 41.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -119.34 132.87 55.94 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mp -106.24 122.46 46.27 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 177.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.53 121.28 18.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 118.118 0.417 . . . . 0.0 110.659 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -100.8 114.93 29.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.677 0.751 . . . . 0.0 109.188 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -151.64 150.37 30.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.456 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.0 147.72 44.87 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 174.402 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 73.6 mt -139.83 107.64 5.66 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -83.0 -40.55 19.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.64 0.734 . . . . 0.0 110.892 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -132.44 156.72 46.22 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.927 -0.578 . . . . 0.0 112.145 -178.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 95' ' ' ASP . 15.9 ptt180 -64.97 -15.33 62.1 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.098 0.475 . . . . 0.0 111.093 175.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -63.35 -37.44 87.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -75.46 -30.86 60.08 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.952 0.406 . . . . 0.0 110.057 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 97.1 mtp -63.58 -47.35 81.87 Favored 'General case' 0 C--O 1.211 -0.972 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.92 -30.74 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.682 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 mtm-85 -61.49 -43.41 98.91 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -59.13 -42.18 89.99 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.17 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -64.51 -30.79 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -61.03 -40.18 92.62 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 177.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -72.96 -37.22 67.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.207 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 68.2 mm-40 -56.2 -50.54 70.95 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.25 -36.57 82.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 122.161 -0.337 . . . . 0.0 111.841 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.47 -43.49 97.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.991 0.424 . . . . 0.0 109.871 178.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -67.33 -42.42 83.61 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.419 HG11 HG13 ' A' ' 109' ' ' VAL . 57.0 t -62.94 -37.55 79.59 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.168 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -58.42 -41.0 84.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.008 0.822 . . . . 0.0 110.137 178.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 87.4 mtt-85 -63.87 -41.66 97.7 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.3 t -69.81 -43.42 79.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.118 0.485 . . . . 0.0 110.167 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -57.53 -41.14 80.29 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -65.85 -37.67 86.81 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.357 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -68.94 -40.26 79.09 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.076 0.465 . . . . 0.0 110.463 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 mp -75.42 -13.21 60.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.136 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.69 6.41 55.19 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 114.084 0.394 . . . . 0.0 114.084 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -73.57 140.78 46.51 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.801 . . . . 0.0 110.352 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -66.45 -38.03 86.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.634 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -131.16 161.3 32.46 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mtp -144.87 148.63 34.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 118.708 0.685 . . . . 0.0 109.824 174.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -121.47 143.49 49.22 Favored 'General case' 0 CA--C 1.514 -0.41 0 O-C-N 123.594 0.559 . . . . 0.0 110.97 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -139.76 125.66 19.64 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.0 tp -93.53 121.75 35.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -111.98 112.61 24.38 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.126 -0.359 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.3 t -105.98 110.94 33.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-O 121.201 0.524 . . . . 0.0 111.834 -176.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -80.1 136.64 36.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -114.18 112.31 22.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 173.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.6 m -132.13 158.23 42.2 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.846 0.355 . . . . 0.0 111.108 -175.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.5 t -74.86 -28.93 60.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.826 -0.546 . . . . 0.0 110.393 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -154.99 166.12 34.6 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 -178.489 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.4 155.09 54.33 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.15 154.34 73.98 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 117.328 -1.315 . . . . 0.0 111.994 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.57 -12.54 13.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 120.402 3.482 . . . . 0.0 120.402 -168.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -151.54 140.45 21.0 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -175.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 54' ' ' ARG . 7.3 m-20 42.69 15.3 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 120.153 3.39 . . . . 0.0 120.153 173.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 25.3 p-90 -63.68 -21.41 66.37 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 120.837 -1.164 . . . . 0.0 113.598 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.66 -29.46 70.65 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -62.39 -33.5 74.88 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.616 0.722 . . . . 0.0 109.615 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 mm -69.19 -40.49 80.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.825 -174.069 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.73 -15.19 63.1 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.866 0.365 . . . . 0.0 111.793 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -102.2 3.27 38.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -177.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -117.42 130.32 56.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.483 0.659 . . . . 0.0 112.155 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -80.71 125.27 29.83 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 173.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -84.02 126.08 32.7 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -123.85 135.61 53.86 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.84 0.829 . . . . 0.0 110.502 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -135.49 91.73 2.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.75 -109.54 2.85 Favored Glycine 0 C--O 1.22 -0.76 0 N-CA-C 107.336 -2.305 . . . . 0.0 107.336 -177.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.0 p -110.85 7.26 21.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.777 0.323 . . . . 0.0 111.558 178.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.419 HG13 HG11 ' A' ' 68' ' ' VAL . 78.7 t -87.68 139.36 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.7 m -126.86 136.99 53.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.9 t -132.09 135.35 58.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -111.14 115.83 52.14 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -79.69 151.08 21.87 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 117.373 -1.284 . . . . 0.0 112.331 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.15 152.72 42.1 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 175.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.7 tt -146.81 131.31 10.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.2 m -113.68 128.45 70.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 103.598 -2.742 . . . . 0.0 103.598 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.33 136.32 54.88 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -47.16 -39.9 13.27 Favored Glycine 0 C--O 1.226 -0.382 0 N-CA-C 117.173 1.629 . . . . 0.0 117.173 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 119' ' ' THR . 0.2 OUTLIER -55.58 -29.31 58.81 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.764 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -142.46 32.7 1.48 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.099 1.428 . . . . 0.0 108.934 -178.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 tp -52.04 -36.4 50.18 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -60.17 -49.86 75.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.562 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.68 -32.98 64.23 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.735 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -63.45 -45.33 91.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.829 0.347 . . . . 0.0 110.719 177.08 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.68 -44.08 96.94 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -75.37 -14.08 60.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.819 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.52 -41.82 37.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.945 0.402 . . . . 0.0 110.03 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG13 ' CD2' ' A' ' 129' ' ' PHE . 5.2 p -88.91 -33.98 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.244 0.545 . . . . 0.0 110.577 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' PHE . . . . . 0.451 ' CD2' HG13 ' A' ' 128' ' ' VAL . 61.1 m-85 -126.78 75.62 75.38 Favored Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 122.0 -0.438 . . . . 0.0 110.233 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -67.29 -10.75 29.71 Favored 'Trans proline' 0 C--N 1.349 0.593 0 CA-C-O 121.415 0.506 . . . . 0.0 113.006 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.4 p -80.26 -9.97 59.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.459 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.84 135.64 33.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.424 0.63 . . . . 0.0 110.5 -178.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 85.9 mtt-85 -86.37 116.11 24.32 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 33.3 p -64.21 -17.32 63.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.775 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.33 -36.01 76.97 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.306 0.574 . . . . 0.0 110.78 176.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -75.1 -9.47 58.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.665 0.745 . . . . 0.0 110.58 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.7 t -118.35 34.46 5.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.426 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 64.8 m -59.8 145.79 44.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.232 0.539 . . . . 0.0 109.816 178.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -56.55 -39.07 72.81 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -174.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -60.27 -39.59 87.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 122.005 0.907 . . . . 0.0 110.545 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -83.7 -9.59 58.74 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.682 -175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -82.06 22.21 0.81 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.418 0.627 . . . . 0.0 111.612 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.28 148.08 38.03 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.658 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -60.34 -32.71 71.51 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -72.68 -44.3 61.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.602 0.715 . . . . 0.0 109.869 176.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -61.15 -27.12 68.17 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.295 -178.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.418 ' HB1' ' HB2' ' A' ' 5' ' ' GLU . . . -57.1 -39.98 76.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.839 177.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -78.7 -31.12 46.38 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.969 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 94.0 mmm -63.26 -34.48 77.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.319 176.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -67.86 -44.61 76.73 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.5 -40.88 96.47 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.669 0.747 . . . . 0.0 109.34 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -61.57 -42.26 98.59 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.647 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.42 -42.31 98.73 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 177.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 47.7 mt -64.27 -31.8 73.15 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.235 -0.291 . . . . 0.0 110.334 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.4 m -76.18 -36.36 58.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.771 0.796 . . . . 0.0 110.543 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.36 -34.72 77.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.813 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 2.1 p -52.97 -28.09 13.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.479 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.34 -41.43 89.17 Favored 'General case' 0 C--O 1.218 -0.59 0 O-C-N 121.066 -1.021 . . . . 0.0 109.26 178.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.54 -29.91 70.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.252 0.549 . . . . 0.0 111.774 -179.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 161' ' ' GLN . . . . . 0.435 HE21 ' HB3' ' A' ' 161' ' ' GLN . 0.0 OUTLIER -57.05 -27.85 62.05 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 121.788 -0.57 . . . . 0.0 110.747 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -65.2 -40.84 94.74 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.533 1.061 . . . . 0.0 111.632 -177.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -76.9 -28.88 55.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.032 0.444 . . . . 0.0 110.222 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 89.0 mm-40 -70.95 -41.17 71.46 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.426 0.631 . . . . 0.0 111.402 175.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -67.62 -17.83 64.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.64 0.776 . . . . 0.0 111.609 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -56.97 -17.76 10.97 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 178.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 17.9 p -59.12 -23.96 62.57 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 176.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -61.07 -36.54 79.88 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.361 0.6 . . . . 0.0 110.291 176.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -70.12 -15.03 62.91 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 122.019 -0.426 . . . . 0.0 111.472 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -89.21 4.59 48.12 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.2 t 54.63 42.78 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 122.164 0.983 . . . . 0.0 110.897 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -106.78 168.39 9.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.883 -177.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -154.02 161.63 41.8 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -156.62 -175.38 5.4 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -149.35 163.85 29.27 Favored Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 177.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -126.27 157.17 39.01 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 117.452 0.626 . . . . 0.0 110.366 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 66.3 tp -108.58 121.31 44.73 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 177.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -90.75 -53.02 4.58 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 123.324 0.39 . . . . 0.0 110.723 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 13.3 ttp180 55.1 -151.19 0.4 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.39 0.676 . . . . 0.0 110.977 178.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 50.84 21.78 1.02 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 118.341 2.719 . . . . 0.0 118.341 176.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -74.99 91.93 2.55 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 174.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 33.4 tp -146.42 156.51 43.35 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -109.71 146.85 34.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -178.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -127.16 40.72 3.66 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -177.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 . . . . . 0 C--O 1.243 0.756 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 -178.839 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.922 0.392 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -141.92 162.11 36.3 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 121.935 -0.478 . . . . 0.0 111.546 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.0 mt -62.49 -46.26 89.25 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -176.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.66 -35.32 80.46 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -63.02 -31.76 72.97 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.021 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -63.02 -51.64 65.98 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -64.64 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.294 0.568 . . . . 0.0 111.271 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -56.58 -50.77 70.97 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.264 0.626 . . . . 0.0 111.04 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.385 -0.822 . . . . 0.0 111.71 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -66.3 -42.88 87.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.073 -0.392 . . . . 0.0 110.064 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.426 HD11 HD11 ' A' ' 125' ' ' LEU . 14.8 mm -69.2 -39.54 79.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.35 -44.21 79.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.53 99.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.093 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -46.47 90.41 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.913 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.2 mt -65.01 -46.24 82.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.156 0.503 . . . . 0.0 110.889 -179.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.8 -38.34 82.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.702 -178.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -78.93 -3.5 45.18 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.242 -0.911 . . . . 0.0 112.374 178.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.9 t -96.46 17.44 16.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.058 0.456 . . . . 0.0 110.008 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.89 -0.77 64.87 Favored Glycine 0 CA--C 1.518 0.246 0 N-CA-C 116.257 1.263 . . . . 0.0 116.257 175.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -75.96 135.47 40.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.109 0.955 . . . . 0.0 110.043 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.77 146.48 20.64 Favored Glycine 0 CA--C 1.505 -0.589 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.1 t -90.19 121.25 40.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 117.794 0.797 . . . . 0.0 109.22 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.6 mt -87.98 -45.66 15.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -161.07 147.49 14.79 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 175.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 115.27 9.75 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -177.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 73.52 40.54 46.99 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.288 -1.125 . . . . 0.0 110.288 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -62.57 -41.81 99.16 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.0 m -146.08 -65.62 0.3 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 171.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -139.13 10.44 2.57 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.513 0.673 . . . . 0.0 112.581 178.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.66 158.99 38.54 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.6 mt -131.2 131.43 63.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -110.3 129.65 55.7 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.393 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -117.1 133.8 55.55 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.859 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -85.26 124.32 31.76 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.35 120.93 83.53 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.55 -22.87 37.75 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 117.164 -1.424 . . . . 0.0 113.599 -175.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.98 -18.49 55.9 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -176.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm 59.76 29.0 18.56 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-O 121.961 0.886 . . . . 0.0 109.509 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 t -65.91 -177.56 0.49 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 113.872 -1.513 . . . . 0.0 110.243 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.1 m -45.53 -44.64 12.82 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -81.68 106.14 13.38 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 170.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -84.86 -24.74 28.42 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -138.38 156.13 47.88 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.345 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 69.9 t -136.74 144.56 32.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 104.81 -2.293 . . . . 0.0 104.81 176.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.02 149.95 46.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 119.047 0.84 . . . . 0.0 111.755 174.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -115.4 132.54 56.59 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.663 -1.977 . . . . 0.0 105.663 179.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -136.5 126.81 26.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.206 0.457 . . . . 0.0 112.135 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.15 115.13 27.03 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -150.58 125.26 9.68 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -87.35 111.4 21.04 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.507 HD13 ' HG2' ' A' ' 57' ' ' MET . 4.6 mt -106.5 121.05 43.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -171.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -91.03 -36.03 14.29 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.578 0.704 . . . . 0.0 111.773 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -128.14 147.38 50.55 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.869 -0.52 . . . . 0.0 111.391 -177.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -65.29 -20.37 66.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -63.54 -33.33 75.35 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.05 -30.57 63.82 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 121.659 -0.651 . . . . 0.0 109.263 179.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.507 ' HG2' HD13 ' A' ' 51' ' ' LEU . 84.5 mtp -66.32 -51.85 53.19 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.8 m -60.94 -36.42 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.186 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -66.12 -36.82 84.16 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -62.04 -40.21 94.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.977 0.418 . . . . 0.0 110.022 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.406 HD12 ' O ' ' A' ' 57' ' ' MET . 2.5 mp -73.25 -34.2 43.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 121.42 -0.8 . . . . 0.0 111.058 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -58.74 -37.94 77.32 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -74.87 -43.43 54.5 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.603 0.716 . . . . 0.0 109.881 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.451 HE22 ' HB2' ' A' ' 84' ' ' ASN . 47.2 mt-30 -58.79 -39.38 80.91 Favored 'General case' 0 C--O 1.212 -0.872 0 O-C-N 121.765 -0.584 . . . . 0.0 111.409 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.83 -34.41 74.51 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 118.114 0.416 . . . . 0.0 110.505 -178.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -71.62 -42.58 67.48 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -60.15 -42.86 95.8 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.276 0.56 . . . . 0.0 109.508 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -67.46 -39.17 82.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 123.111 0.564 . . . . 0.0 110.336 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.55 -41.87 81.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.107 0.479 . . . . 0.0 110.736 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -65.12 -41.18 95.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.827 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.7 t -68.88 -39.69 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.4 ttp85 -60.09 -40.74 90.66 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.819 -0.55 . . . . 0.0 109.846 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -63.39 -41.11 98.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.906 -0.134 . . . . 0.0 110.845 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.55 -41.38 98.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.061 0.458 . . . . 0.0 110.899 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.82 -15.87 55.24 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.82 15.58 71.51 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-O 121.546 0.526 . . . . 0.0 112.227 -177.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -70.2 140.08 52.43 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 122.153 -0.616 . . . . 0.0 110.617 -175.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -64.45 -39.41 93.78 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.446 HH22 ' CD ' ' A' ' 105' ' ' GLU . 11.2 mtp180 -148.35 156.37 42.42 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 177.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.0 mmm -131.97 124.34 29.18 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.145 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -105.35 135.73 46.19 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 175.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -130.61 132.84 45.72 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.9 tp -94.74 123.51 38.24 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.451 ' HB2' HE22 ' A' ' 64' ' ' GLN . 36.6 t30 -120.06 114.47 22.03 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 122.159 0.184 . . . . 0.0 111.389 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.06 116.86 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.989 0.424 . . . . 0.0 111.671 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -80.92 152.81 27.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.514 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -128.09 115.87 19.11 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.508 -2.404 . . . . 0.0 104.508 171.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -136.88 151.87 49.58 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.474 0.484 . . . . 0.0 110.621 -173.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 87.7 m -67.22 -49.85 63.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 168.53 11.12 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -176.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.32 140.61 22.13 Favored Pre-proline 0 C--N 1.313 -0.991 0 N-CA-C 104.818 -2.29 . . . . 0.0 104.818 176.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.1 145.88 83.92 Favored 'Trans proline' 0 C--N 1.345 0.386 0 N-CA-C 114.706 1.002 . . . . 0.0 114.706 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.2 m -76.63 -4.24 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -175.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -120.86 100.46 7.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 119.461 -0.304 . . . . 0.0 111.513 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 22.53 50.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 32.7 p-90 -66.84 -22.84 65.98 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.488 -0.758 . . . . 0.0 112.276 -178.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -63.06 -31.25 72.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 121.914 -0.491 . . . . 0.0 110.742 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -63.78 -34.82 78.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.2 mm -63.99 -38.53 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 122.486 0.314 . . . . 0.0 110.283 -177.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.13 -25.78 68.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 111.181 -179.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -90.81 -2.33 57.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -96.0 102.34 14.12 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.957 -0.465 . . . . 0.0 111.749 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -68.4 118.76 11.88 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 103.039 -2.948 . . . . 0.0 103.039 169.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -82.93 110.77 18.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLU . . . . . 0.446 ' CD ' HH22 ' A' ' 79' ' ' ARG . 5.1 mt-10 -107.81 121.12 44.08 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 122.094 0.949 . . . . 0.0 110.257 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -119.62 78.52 1.33 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.62 5.04 Favored Glycine 0 C--O 1.221 -0.694 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.448 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.7 p -76.81 -19.93 56.98 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 122.248 -0.56 . . . . 0.0 112.342 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.5 t -89.12 146.66 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.091 -0.38 . . . . 0.0 110.997 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 57.8 p -137.88 139.91 40.11 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 171.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.8 t -132.48 136.85 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.638 0 CA-C-O 122.021 0.915 . . . . 0.0 109.799 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -106.13 103.09 43.42 Favored Pre-proline 0 N--CA 1.428 -1.56 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.434 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -82.25 152.73 16.11 Favored 'Trans proline' 0 C--N 1.347 0.47 0 N-CA-C 114.129 0.78 . . . . 0.0 114.129 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.57 158.05 39.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 175.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.4 tt -149.66 128.48 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 118.369 0.531 . . . . 0.0 109.873 -178.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.3 t -100.08 116.97 44.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.82 139.96 38.82 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.54 -27.8 68.62 Favored Glycine 0 C--N 1.322 -0.2 0 CA-C-N 116.056 -0.52 . . . . 0.0 114.153 -177.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 27.0 p -54.01 -33.82 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -177.278 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.59 30.89 1.88 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.529 0.68 . . . . 0.0 110.107 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.9 tt -44.85 -36.96 3.54 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -175.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 18.3 ptp180 -55.61 -51.38 67.37 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.78 -38.56 38.2 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.976 0.893 . . . . 0.0 111.114 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.58 -38.09 86.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.975 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.426 HD11 HD11 ' A' ' 11' ' ' ILE . 2.7 tm? -63.24 -49.43 74.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -72.72 -16.12 61.67 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.391 -177.301 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.05 -34.97 64.25 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 46.6 t -91.35 -42.19 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.245 0.545 . . . . 0.0 110.285 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.9 76.53 66.2 Favored Pre-proline 0 C--N 1.324 -0.512 0 C-N-CA 122.93 0.492 . . . . 0.0 111.734 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.67 -11.92 33.23 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 118.325 -0.65 . . . . 0.0 113.123 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -75.84 -12.82 60.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.905 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -90.85 131.19 36.64 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -79.04 105.18 10.2 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 5.9 t -58.12 -17.22 16.81 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -176.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -57.76 -35.17 70.39 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.906 0.882 . . . . 0.0 110.722 174.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -71.74 -5.61 35.24 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.415 0.626 . . . . 0.0 111.022 -179.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 12.8 t -130.23 34.83 4.16 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 177.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.8 t -56.94 151.34 14.91 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.116 -179.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -60.15 -26.77 66.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.958 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -62.16 -23.92 66.87 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.238 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 70.3 m80 -119.17 14.99 13.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.88 -177.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.41 67.92 5.28 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.283 0.563 . . . . 0.0 111.301 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 31.2 t -109.42 143.06 39.51 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -66.69 -28.93 68.84 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.992 0.425 . . . . 0.0 110.364 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -70.49 -35.36 73.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.663 0.744 . . . . 0.0 110.532 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 44.8 m-20 -59.34 -24.38 63.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.433 -178.3 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -37.26 69.3 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -64.97 -43.49 92.46 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 37.3 mtt -64.09 -36.59 84.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.369 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.27 -38.28 89.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.271 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -65.47 -43.04 91.52 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.007 0.432 . . . . 0.0 109.921 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -64.43 -41.98 96.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.472 0.653 . . . . 0.0 109.772 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -42.39 99.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.714 177.562 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -62.74 -43.02 99.88 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 122.82 0.448 . . . . 0.0 112.15 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.35 -37.31 86.79 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.585 -0.697 . . . . 0.0 109.948 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 21.5 m -67.64 -33.39 74.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.688 0.756 . . . . 0.0 110.673 176.145 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.81 -38.56 73.31 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.669 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.2 t -56.14 -42.48 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.93 -38.54 88.83 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.317 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 48.7 tttt -63.81 -37.5 87.62 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.733 -0.604 . . . . 0.0 110.405 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -31.95 61.8 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -176.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -57.5 -46.0 84.26 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 122.043 0.925 . . . . 0.0 110.81 177.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -76.94 -40.18 48.03 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.758 0.789 . . . . 0.0 110.359 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -61.41 -51.47 68.63 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -174.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -60.41 -37.32 80.48 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.371 0.987 . . . . 0.0 110.374 -177.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -61.75 -50.09 73.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.561 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 14.5 m -72.35 -43.66 63.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.632 -179.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.07 -42.44 99.68 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 123.847 0.859 . . . . 0.0 112.74 -176.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.3 -44.22 84.09 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.356 178.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 50.86 25.37 2.14 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.986 0.803 . . . . 0.0 110.014 -174.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 16.6 t 67.42 -59.2 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.402 1.881 . . . . 0.0 113.036 -176.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' PHE . . . . . 0.41 ' HB3' ' H ' ' A' ' 173' ' ' GLN . 0.5 OUTLIER 55.4 -143.21 0.75 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 123.87 0.868 . . . . 0.0 109.009 176.963 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 173' ' ' GLN . . . . . 0.41 ' H ' ' HB3' ' A' ' 172' ' ' PHE . 76.2 mm-40 -142.78 166.55 24.34 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -58.5 139.17 56.07 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -175.15 -141.89 3.88 Favored Glycine 0 C--O 1.221 -0.683 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -177.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 68.8 tttt 57.87 85.7 0.09 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 66.6 tp -69.4 129.56 40.09 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 173.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -129.06 172.67 11.17 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 36.1 ptt85 -146.34 166.31 26.71 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -113.59 171.6 7.48 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 175.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -83.42 153.9 24.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.048 0.451 . . . . 0.0 110.763 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -84.04 167.16 17.11 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 175.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 7.0 p90 -74.63 135.85 41.97 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -99.24 4.31 46.6 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 . . . . . 0 C--O 1.246 0.891 0 CA-C-N 114.526 -1.216 . . . . 0.0 109.557 -177.726 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 ptt? . . . . . 0 N--CA 1.497 1.878 0 N-CA-C 110.213 -0.292 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.419 ' HA ' ' HB2' ' A' ' 5' ' ' GLU . 37.7 m-85 -54.57 -36.55 64.48 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 -169.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -42.43 99.3 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.988 0.899 . . . . 0.0 109.516 179.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -73.68 -36.51 65.31 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.946 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 2' ' ' PHE . 0.9 OUTLIER -59.96 -39.18 84.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.059 0.39 . . . . 0.0 109.961 177.683 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -60.03 -53.14 61.27 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.9 m -63.05 -42.92 99.82 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.241 0.544 . . . . 0.0 111.114 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -56.91 -51.28 69.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.496 0.718 . . . . 0.0 112.14 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -71.31 -28.75 64.32 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.605 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -68.74 -36.48 78.45 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.664 -0.647 . . . . 0.0 109.511 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.537 HD11 HD11 ' A' ' 125' ' ' LEU . 22.2 mm -72.88 -36.01 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.62 85.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.02 -41.89 97.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.887 177.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -57.51 -49.87 74.91 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.549 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.24 -49.87 57.8 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.299 -178.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -39.45 82.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.722 -175.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -11.67 61.09 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.263 -0.898 . . . . 0.0 111.855 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.0 m -95.92 11.53 33.51 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 122.559 0.344 . . . . 0.0 110.32 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.25 -3.57 56.78 Favored Glycine 0 C--O 1.228 -0.26 0 N-CA-C 116.176 1.23 . . . . 0.0 116.176 175.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -66.79 126.14 28.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.065 0.932 . . . . 0.0 108.886 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.89 135.71 14.06 Favored Glycine 0 C--O 1.227 -0.318 0 N-CA-C 110.524 -1.031 . . . . 0.0 110.524 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.1 t -79.45 124.08 37.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 117.496 0.648 . . . . 0.0 109.258 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.6 mt -96.08 -45.5 13.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -148.56 141.96 25.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.41 105.37 4.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.941 0.337 . . . . 0.0 111.088 178.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.04 45.21 6.74 Favored Glycine 0 C--O 1.226 -0.4 0 C-N-CA 120.597 -0.811 . . . . 0.0 114.937 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.25 -37.85 88.96 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 104.04 -2.578 . . . . 0.0 104.04 174.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.1 t -151.36 -64.49 0.18 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 113.934 -1.485 . . . . 0.0 108.777 169.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -139.36 14.33 2.58 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -173.608 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.2 159.46 37.68 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 72.2 mt -132.59 125.89 53.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 105.46 -2.052 . . . . 0.0 105.46 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -99.14 129.63 45.41 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.86 138.27 54.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.914 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -81.59 129.78 34.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.23 118.07 68.68 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -74.37 -21.13 17.74 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 116.862 -1.625 . . . . 0.0 113.894 -175.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -77.44 -22.14 51.89 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 56.54 34.36 24.25 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 123.075 1.417 . . . . 0.0 111.092 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.5 p -74.48 -172.91 1.6 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.438 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.8 m -42.23 -28.24 0.18 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 112.675 0.621 . . . . 0.0 112.675 172.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -91.22 129.25 37.23 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 173.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -105.71 -41.46 5.44 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 31.4 mt -132.15 154.67 49.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.13 0.491 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -129.93 139.23 52.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -125.19 120.09 30.35 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.2 mt -96.02 120.54 36.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 104.035 -2.58 . . . . 0.0 104.035 175.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -135.09 127.93 31.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.937 0.789 . . . . 0.0 111.403 -175.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -103.18 105.78 16.16 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.018 0.913 . . . . 0.0 112.208 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -151.56 131.53 13.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.313 178.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -82.24 151.29 26.89 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 176.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -134.54 141.97 46.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.827 0.285 . . . . 0.0 110.432 -174.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -94.9 -45.64 7.2 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -128.4 154.62 45.82 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -178.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -64.3 -15.32 60.0 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.989 176.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -64.45 -34.93 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.26 178.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -75.81 -41.63 52.21 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -47.75 83.54 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.358 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.08 -34.73 72.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.993 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 83.5 mtt85 -71.14 -32.43 68.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -177.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.85 -42.62 89.75 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.8 mp -71.49 -37.16 63.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.975 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.07 -33.39 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 119.067 0.849 . . . . 0.0 109.688 -179.032 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -74.29 -44.94 50.65 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -36.21 73.86 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 121.833 -0.542 . . . . 0.0 111.308 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.28 -43.93 72.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.79 -42.68 93.9 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -63.78 -56.93 11.81 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.707 0.765 . . . . 0.0 113.044 178.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.9 p -64.14 -30.41 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.86 -173.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.17 -37.48 64.52 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -64.43 -42.82 95.81 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.837 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 17.7 t -68.28 -37.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.419 0.628 . . . . 0.0 109.734 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -42.73 98.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.703 -178.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.6 m80 -67.53 -35.96 80.1 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.648 178.61 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -30.49 71.42 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.78 -9.6 58.68 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 177.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.22 18.29 71.06 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -76.55 121.96 23.91 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 122.011 -0.7 . . . . 0.0 110.407 -175.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.3 mtp180 -66.53 -35.39 80.12 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -157.58 149.72 22.45 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 172.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -147.34 126.15 12.68 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.958 -173.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -88.24 117.39 27.12 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.502 1.047 . . . . 0.0 111.309 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.05 121.91 34.06 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.589 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.2 tp -87.39 100.27 12.61 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -100.28 113.27 25.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -178.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.2 t -114.4 111.19 34.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -79.73 144.66 33.44 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.39 116.76 25.39 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 172.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.7 p -136.12 152.16 50.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -172.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.9 m -67.18 -48.62 67.4 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -138.55 157.92 45.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 -176.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.59 152.64 63.96 Favored Pre-proline 0 C--N 1.312 -1.048 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.14 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -64.53 149.74 89.41 Favored 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 117.632 -1.112 . . . . 0.0 112.059 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.02 -6.9 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 119.021 2.971 . . . . 0.0 119.021 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -126.91 112.89 15.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.479 1.288 . . . . 0.0 114.479 -173.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 21.07 45.71 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 118.977 2.954 . . . . 0.0 118.977 175.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.437 ' HA ' HG12 ' A' ' 99' ' ' ILE . 52.1 p-90 -72.11 -15.52 61.99 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.133 -0.979 . . . . 0.0 110.796 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.38 -31.3 72.45 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.539 -0.726 . . . . 0.0 111.202 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.89 -37.23 76.11 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 174.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.437 HG12 ' HA ' ' A' ' 96' ' ' TRP . 7.4 mm -67.45 -40.97 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -178.654 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.42 -32.82 73.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.264 0.554 . . . . 0.0 111.881 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -88.48 2.49 52.75 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.251 0.548 . . . . 0.0 110.289 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.8 ttpp -114.51 103.06 10.66 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 123.169 0.587 . . . . 0.0 111.849 -176.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 81.9 m -68.35 126.92 31.12 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 174.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -83.78 117.73 23.45 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -116.74 135.62 53.62 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.703 0.763 . . . . 0.0 111.072 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -144.41 85.82 1.8 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.66 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.69 5.21 Favored Glycine 0 C--O 1.225 -0.456 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.436 178.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.7 p -82.75 10.21 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.7 t -122.29 144.53 31.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -176.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.56 144.01 43.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 100.826 -3.768 . . . . 0.0 100.826 169.813 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.8 t -138.54 134.44 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.953 0 CA-C-N 119.449 1.022 . . . . 0.0 109.01 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -99.45 114.56 65.67 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -82.16 62.85 8.16 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 121.839 1.692 . . . . 0.0 113.76 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.01 147.2 48.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.7 tt -148.15 138.11 16.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 59.4 t -110.62 114.09 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.8 137.24 35.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -21.14 65.03 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.343 -0.456 . . . . 0.0 114.141 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 119' ' ' THR . 30.6 p -59.65 -31.56 69.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -177.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptm -140.43 34.2 1.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 tt -42.13 -42.86 3.1 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 117.187 2.292 . . . . 0.0 117.187 -172.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -61.04 -51.31 69.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 118.631 0.65 . . . . 0.0 112.255 -176.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -74.08 -35.54 64.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.528 0.68 . . . . 0.0 111.798 -179.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -67.84 -36.41 80.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.842 0.83 . . . . 0.0 111.512 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.537 HD11 HD11 ' A' ' 11' ' ' ILE . 3.4 tm? -68.51 -43.38 76.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -70.75 -14.73 62.55 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.133 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.68 -34.04 66.92 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 176.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -94.38 -36.77 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -126.07 77.65 71.12 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 122.232 -0.292 . . . . 0.0 110.924 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -69.45 -9.33 25.93 Favored 'Trans proline' 0 C--N 1.347 0.483 0 N-CA-C 113.704 0.617 . . . . 0.0 113.704 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.0 p -83.5 -9.72 58.79 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 122.73 0.412 . . . . 0.0 111.852 178.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -80.98 141.64 34.24 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.191 0.52 . . . . 0.0 111.434 -177.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -86.47 127.2 34.83 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.55 -21.16 66.58 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.455 0.645 . . . . 0.0 110.386 177.168 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -70.52 -21.1 62.77 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.947 179.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -92.5 7.32 43.68 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.771 0.795 . . . . 0.0 108.933 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.9 40.11 1.38 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 176.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.4 m -61.5 145.22 52.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.491 179.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -60.93 -35.35 76.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.557 0.694 . . . . 0.0 112.142 -177.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -59.1 -33.75 71.2 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.836 178.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -97.94 11.29 37.95 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.594 -175.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -77.58 10.29 2.75 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.6 t -60.44 151.01 29.31 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.568 0.699 . . . . 0.0 112.788 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -61.68 -28.72 69.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.341 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -64.4 -44.79 90.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.136 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -70.28 -24.5 63.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.955 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.4 -37.02 84.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.298 0.57 . . . . 0.0 109.483 175.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -73.88 -40.82 62.93 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.1 mtt -65.14 -30.79 71.74 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 120.693 0.282 . . . . 0.0 110.742 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.48 91.29 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -67.63 -44.75 77.23 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.34 -42.85 99.36 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.648 0.737 . . . . 0.0 109.869 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -58.86 -44.83 91.12 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.15 176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.81 -32.27 73.88 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.819 -0.55 . . . . 0.0 109.832 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.94 -35.16 59.82 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.155 0.979 . . . . 0.0 110.538 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.67 -37.55 87.98 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -176.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -60.03 -37.17 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 118.838 0.744 . . . . 0.0 110.946 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -72.87 -38.71 66.9 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.196 -0.94 . . . . 0.0 108.64 177.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -59.12 -29.74 67.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.176 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.9 -28.58 51.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.292 -0.255 . . . . 0.0 110.947 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -68.45 -39.33 81.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.596 0.712 . . . . 0.0 110.48 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -67.27 -39.68 86.09 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.513 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -70.89 -44.22 66.72 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -65.78 -22.44 66.57 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.5 pttt -69.51 -17.93 63.63 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.714 -0.616 . . . . 0.0 112.226 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 81.8 p -67.1 -14.06 62.54 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -175.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -55.55 -24.49 32.57 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -58.4 -22.37 53.79 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 177.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -108.8 104.47 13.74 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 176.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 33.1 m -61.95 142.52 16.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.867 0.841 . . . . 0.0 113.203 -176.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -150.11 170.12 19.67 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 179.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -144.89 138.91 27.28 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -158.33 161.1 37.61 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 149.02 -174.34 28.66 Favored Glycine 0 N--CA 1.454 -0.128 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 178.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 38.3 pttt -155.96 167.76 29.37 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 103.945 -2.613 . . . . 0.0 103.945 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -135.02 141.37 46.15 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -147.81 171.37 15.81 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 105.757 -1.942 . . . . 0.0 105.757 177.202 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -157.6 150.99 23.64 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.669 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -129.99 168.58 16.47 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -153.49 157.26 39.57 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 175.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 33.5 tp -140.55 152.8 45.82 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -155.18 164.43 38.84 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -129.12 -11.19 4.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.262 0.553 . . . . 0.0 110.127 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 . . . . . 0 C--O 1.244 0.769 0 N-CA-C 101.256 -3.609 . . . . 0.0 101.256 177.902 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 ttp . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 119.416 -0.326 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -68.69 147.35 51.97 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.48 -38.99 60.65 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 -174.43 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 71.4 mt -54.94 -35.23 64.01 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 47.7 mt-10 -56.81 -26.01 57.02 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -58.37 -49.4 77.37 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 m -71.82 -41.77 67.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.0 0.428 . . . . 0.0 110.934 178.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.478 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 64.1 t80 -56.05 -56.22 23.43 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -67.61 -29.73 69.13 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.853 -0.529 . . . . 0.0 110.766 -178.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -69.12 -39.42 78.92 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.352 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.613 HD11 HD11 ' A' ' 125' ' ' LEU . 8.2 mm -62.24 -46.22 96.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -42.18 79.48 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.37 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -60.83 -46.33 90.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 mt -66.53 -51.44 56.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.936 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.9 t -56.04 -46.74 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.81 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.455 ' HA ' ' HG2' ' A' ' 161' ' ' GLN . 0.0 OUTLIER -63.37 -22.03 66.64 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.756 -0.59 . . . . 0.0 112.431 -178.313 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.3 m -87.19 1.08 54.21 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.02 -0.94 27.06 Favored Glycine 0 C--O 1.228 -0.277 0 N-CA-C 115.898 1.119 . . . . 0.0 115.898 176.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -68.0 122.66 18.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.377 1.088 . . . . 0.0 108.438 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.79 116.3 4.25 Favored Glycine 0 CA--C 1.507 -0.424 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -178.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -71.81 111.98 6.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.1 mt -75.6 -42.9 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -143.01 116.45 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.904 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -139.91 112.96 8.19 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.49 -50.85 0.06 OUTLIER Glycine 0 CA--C 1.506 -0.493 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -67.06 161.04 25.35 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 176.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.1 m -100.26 -7.03 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 176.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -88.99 -44.94 10.04 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 113.376 -1.738 . . . . 0.0 111.004 -175.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 45' ' ' ARG . 11.2 pt-20 -139.56 148.52 42.69 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 86.0 mt -140.1 132.26 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -108.3 136.02 48.64 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.059 0.39 . . . . 0.0 109.968 176.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mp -131.16 129.98 42.45 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.346 0.658 . . . . 0.0 109.749 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -79.58 136.41 36.85 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.34 115.29 41.85 Favored Pre-proline 0 CA--C 1.546 0.795 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.48 -25.56 9.51 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 117.334 -1.311 . . . . 0.0 112.668 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.85 59.31 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.883 0.873 . . . . 0.0 111.482 -179.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt 57.34 45.49 20.0 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 t -60.13 -177.69 0.07 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 112.433 -2.167 . . . . 0.0 112.955 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 p -55.88 -29.02 59.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.239 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -109.36 136.96 47.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -80.18 -30.54 38.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.725 -175.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.0 mt -137.57 162.45 33.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.186 -176.412 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.3 t -129.59 135.39 61.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 30' ' ' GLU . 59.1 ttt180 -125.01 134.59 52.52 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 175.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.2 129.56 54.23 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 104.427 -2.434 . . . . 0.0 104.427 177.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -136.43 132.56 35.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 117.891 0.314 . . . . 0.0 110.736 -177.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 tmtm? -106.76 110.8 23.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.832 -0.542 . . . . 0.0 109.673 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -151.52 144.91 24.8 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -106.77 101.22 10.67 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.65 135.57 35.53 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -92.29 -37.27 12.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 175.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -126.27 150.86 48.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.009 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -65.02 -15.54 62.44 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.854 -0.529 . . . . 0.0 110.998 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -63.38 -36.33 83.37 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -73.47 -40.52 64.07 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.8 ttm -57.39 -48.75 78.26 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.934 -0.306 . . . . 0.0 111.0 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.33 -31.84 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.832 0.742 . . . . 0.0 112.108 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.0 mtt180 -66.82 -41.21 87.86 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -179.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.28 -36.29 77.49 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.85 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.5 mm -64.38 -30.81 51.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 121.626 -0.671 . . . . 0.0 112.243 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -63.39 -36.87 85.15 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.808 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -72.38 -38.69 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -56.58 -49.89 73.54 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.66 -27.94 68.73 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.349 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.97 -46.06 83.09 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -66.48 -42.59 87.25 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.93 -40.83 88.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 119.034 -0.507 . . . . 0.0 112.116 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.31 -33.34 74.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.014 1.279 . . . . 0.0 109.999 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.3 ttm-85 -64.05 -42.12 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.6 t -68.66 -41.68 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -57.03 -41.37 78.48 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.795 0.438 . . . . 0.0 111.35 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.5 t-80 -62.23 -40.54 96.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.758 0.314 . . . . 0.0 110.883 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -73.27 -41.86 63.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.739 0.304 . . . . 0.0 111.791 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.69 -17.94 59.78 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.47 7.18 63.71 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.444 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -65.42 140.45 58.63 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 122.068 -0.666 . . . . 0.0 109.356 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.02 -32.45 73.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.613 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.7 ttt85 -150.73 154.04 36.64 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 29.7 mmm -124.38 150.36 45.66 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -127.33 142.43 51.45 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.554 0.534 . . . . 0.0 109.651 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -142.35 124.81 15.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.922 0.391 . . . . 0.0 111.198 -176.339 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.6 tp -90.87 108.08 19.61 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -102.09 111.52 23.82 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 10.8 t -100.98 106.87 20.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.061 0.458 . . . . 0.0 112.002 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -75.69 139.68 42.08 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -118.22 113.23 21.2 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 172.161 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.2 m -128.28 155.0 45.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.6 m -67.16 -48.39 68.15 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.818 0.818 . . . . 0.0 108.908 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.27 170.87 15.17 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 -177.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.93 151.16 43.11 Favored Pre-proline 0 C--N 1.314 -0.966 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -62.16 151.51 81.56 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 122.194 0.576 . . . . 0.0 112.307 176.422 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -63.62 -18.39 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 N-CA-C 121.176 3.769 . . . . 0.0 121.176 -167.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -150.21 137.93 19.96 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 116.241 1.941 . . . . 0.0 116.241 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 t0 37.87 24.1 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 119.179 3.029 . . . . 0.0 119.179 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 30.6 p-90 -67.59 -22.32 65.37 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 120.742 -1.224 . . . . 0.0 110.376 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.25 -31.26 71.06 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.4 . . . . 0.0 111.944 -178.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -59.77 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.8 mm -66.04 -39.58 84.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.911 -175.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.26 -14.7 60.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.35 0.595 . . . . 0.0 111.658 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -100.16 3.28 43.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.789 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -124.2 144.6 49.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.598 0.714 . . . . 0.0 110.979 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.7 m -79.89 147.16 31.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 104.468 -2.419 . . . . 0.0 104.468 172.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -107.61 123.67 48.81 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -125.95 130.94 52.25 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.455 0.645 . . . . 0.0 109.645 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.05 75.52 1.3 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 178.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.36 -112.65 3.7 Favored Glycine 0 C--O 1.224 -0.528 0 C-N-CA 119.722 -1.228 . . . . 0.0 111.15 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.2 p -93.19 22.15 5.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.532 0.682 . . . . 0.0 110.975 -178.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 54.2 t -123.86 141.03 45.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.7 t -127.68 140.92 51.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 104.286 -2.487 . . . . 0.0 104.286 170.498 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.2 t -135.86 138.5 47.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -114.33 114.44 45.45 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.08 157.73 30.4 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 115.955 -2.23 . . . . 0.0 111.122 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.09 149.78 31.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 103.023 -2.954 . . . . 0.0 103.023 175.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -147.88 137.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 118.776 0.716 . . . . 0.0 109.602 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 83.1 t -114.18 117.27 55.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.2 140.42 36.5 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.52 -22.68 61.78 Favored Glycine 0 C--N 1.322 -0.222 0 C-N-CA 121.06 -0.591 . . . . 0.0 113.823 -176.288 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 37.2 p -61.05 -32.06 71.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 18.0 ptp -142.66 40.69 1.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.5 tt -43.29 -45.98 6.12 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.79 -1.55 . . . . 0.0 114.906 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -61.16 -37.29 82.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -43.73 61.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.354 0.597 . . . . 0.0 110.68 -176.119 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -64.49 -41.16 96.63 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.919 0.866 . . . . 0.0 109.45 179.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.613 HD11 HD11 ' A' ' 11' ' ' ILE . 0.6 OUTLIER -63.49 -43.29 97.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.035 -176.55 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -73.7 -18.68 60.98 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.298 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.26 -34.85 61.42 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.2 t -90.03 -41.65 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 121.319 0.581 . . . . 0.0 110.283 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.29 79.48 70.17 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.154 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -66.78 -14.19 42.86 Favored 'Trans proline' 0 N--CA 1.474 0.376 0 N-CA-C 114.233 0.82 . . . . 0.0 114.233 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 7.2 m -83.16 2.62 34.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -68.54 132.02 46.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.51 0.672 . . . . 0.0 111.101 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -78.11 106.0 9.7 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 176.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 17.3 p -61.57 -23.8 66.22 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -22.45 66.89 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 176.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -82.28 7.33 14.13 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.757 0.789 . . . . 0.0 110.447 -177.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 52.3 t -129.98 115.07 16.62 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 77.0 p -140.6 158.62 43.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -178.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -67.87 -19.85 65.07 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.54 0.686 . . . . 0.0 110.449 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -58.18 -27.43 63.84 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.292 1.037 . . . . 0.0 110.479 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -117.31 15.94 14.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.815 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -82.71 52.26 2.07 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 11.6 p -132.23 163.0 29.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 122.019 0.914 . . . . 0.0 112.801 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -66.47 -28.73 68.82 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.794 -1.094 . . . . 0.0 110.201 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -71.15 -41.88 69.86 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 121.893 -0.505 . . . . 0.0 110.218 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -64.55 -33.97 77.16 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.8 71.85 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.941 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -69.06 -45.05 71.34 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 36.3 mmt -62.75 -28.92 70.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.131 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -61.98 -35.53 78.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.172 -0.33 . . . . 0.0 111.742 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -67.32 -44.48 79.05 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.14 0.495 . . . . 0.0 109.713 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -65.21 -38.58 90.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.732 0.777 . . . . 0.0 109.458 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -58.85 -46.68 87.17 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.377 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -66.98 -45.31 78.05 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.0 -40.5 93.79 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.595 -176.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 33.9 p -71.81 -34.74 69.61 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.203 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.28 -34.64 76.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.726 0.41 . . . . 0.0 111.712 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 71.2 t -56.94 -46.94 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 118.47 0.577 . . . . 0.0 110.675 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -73.83 -37.51 64.82 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -56.71 -25.34 54.1 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.811 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 161' ' ' GLN . . . . . 0.455 ' HG2' ' HA ' ' A' ' 17' ' ' ASN . 4.0 tm0? -54.92 -32.03 60.74 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -62.17 -36.41 81.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.859 0.361 . . . . 0.0 110.282 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -76.89 -45.43 28.19 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.243 0.617 . . . . 0.0 110.331 174.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -55.95 -41.46 74.71 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -65.51 -20.72 66.46 Favored 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 33.0 mttm -77.57 -41.15 39.88 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 176.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.39 -23.56 61.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.589 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -56.37 -35.32 67.58 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 123.307 0.643 . . . . 0.0 111.362 -179.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -60.3 -14.14 16.63 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.261 0.838 . . . . 0.0 113.261 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -120.99 10.31 10.77 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 22.0 m -85.04 141.89 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 119.495 1.043 . . . . 0.0 110.101 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -137.33 -26.35 1.0 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 179.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 64.62 -42.88 0.3 Allowed 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 116.631 2.086 . . . . 0.0 116.631 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 58.21 25.19 12.3 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 177.047 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -178.7 174.64 46.78 Favored Glycine 0 CA--C 1.507 -0.406 0 N-CA-C 108.697 -1.761 . . . . 0.0 108.697 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -159.77 165.6 32.11 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 64.2 tp -149.59 132.52 16.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 101.63 -3.471 . . . . 0.0 101.63 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -157.82 157.51 33.43 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -176.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 47.36 90.39 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -150.94 114.97 5.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.494 0.664 . . . . 0.0 110.12 168.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -165.46 162.69 19.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.968 -1.015 . . . . 0.0 108.426 -175.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 32.6 tp -152.8 147.11 25.65 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 175.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 22.3 p90 -142.1 164.47 30.07 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 -177.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -157.21 172.95 17.72 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 -177.588 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 . . . . . 0 C--O 1.244 0.807 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 179.049 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.4 mtp . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 118.824 -0.608 . . . . 0.0 109.899 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 62.48 163.85 0.1 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.948 0.899 . . . . 0.0 113.416 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.3 tt -72.41 -42.8 64.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.558 0.694 . . . . 0.0 111.063 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.03 -35.25 78.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -60.82 -29.73 69.66 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.5 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -61.2 -51.07 70.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -179.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 m -63.76 -42.0 97.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.489 0.661 . . . . 0.0 110.837 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -59.09 -51.75 68.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.97 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -72.37 -28.66 63.17 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.746 -0.596 . . . . 0.0 111.547 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -64.68 -44.42 90.39 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.1 mm -70.84 -37.67 69.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.23 81.64 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.52 -46.12 89.86 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 116.894 -0.139 . . . . 0.0 111.305 178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -54.73 -47.18 74.1 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.228 0.611 . . . . 0.0 112.037 -177.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.07 -45.82 55.14 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.409 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.6 t -56.97 -41.92 77.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 O-C-N 122.032 -0.417 . . . . 0.0 111.4 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.7 p30 -72.08 -4.78 30.89 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.141 -0.974 . . . . 0.0 112.734 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.4 m -98.31 13.56 31.03 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.68 -3.92 53.4 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.394 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.469 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.0 m-85 -69.67 121.69 17.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.627 0.727 . . . . 0.0 109.694 -178.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.62 129.94 9.59 Favored Glycine 0 N--CA 1.449 -0.495 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.5 t -74.01 126.9 35.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.0 mt -96.2 -44.04 12.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -150.17 133.23 16.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.13 127.31 21.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 118.936 0.789 . . . . 0.0 112.404 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.37 28.37 52.85 Favored Glycine 0 C--O 1.221 -0.666 0 C-N-CA 120.476 -0.869 . . . . 0.0 114.28 173.018 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -58.74 -34.31 71.23 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.574 1.178 . . . . 0.0 108.729 178.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.4 m -159.54 -72.21 0.08 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 175.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.93 20.17 2.65 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.382 0.611 . . . . 0.0 111.541 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -129.89 159.08 37.7 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 115.1 1.519 . . . . 0.0 115.1 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.6 mt -139.25 131.19 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.86 0.864 . . . . 0.0 109.036 176.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -100.92 135.9 41.62 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 mp -129.46 138.1 51.22 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 122.975 0.51 . . . . 0.0 110.095 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.05 137.78 32.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -88.45 107.47 16.96 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 117.905 0.32 . . . . 0.0 111.513 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 81.9 Cg_endo -70.06 -17.01 36.48 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 120.58 0.854 . . . . 0.0 112.474 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -66.62 -25.26 66.52 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.884 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 60.7 42.96 12.94 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 -174.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.2 t -66.47 -177.52 0.57 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 112.577 -2.102 . . . . 0.0 112.943 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.9 p -55.07 -33.98 63.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 178.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 25.5 p-80 -107.29 143.24 35.83 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -89.73 -29.72 18.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.721 -173.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.69 164.43 28.85 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.479 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.1 t -130.54 138.07 54.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -123.85 113.65 18.81 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tp -94.57 128.56 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -136.46 118.4 15.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.426 0.557 . . . . 0.0 111.607 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -86.47 94.68 9.47 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.383 -0.823 . . . . 0.0 109.084 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.2 t-160 -147.25 135.81 21.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.164 0.506 . . . . 0.0 111.314 -176.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -89.99 151.54 21.63 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 124.951 1.3 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.7 mt -138.32 140.06 39.36 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -176.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -92.86 -44.71 8.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -129.64 160.57 32.92 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.712 -0.618 . . . . 0.0 109.634 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -64.65 -22.42 66.97 Favored 'General case' 0 C--O 1.219 -0.513 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -66.28 -33.36 75.57 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.252 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -69.16 -35.06 75.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 177.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.27 -50.53 67.55 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.327 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.3 m -63.72 -32.79 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 O-C-N 121.452 -0.78 . . . . 0.0 110.297 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.55 -36.92 83.85 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.663 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.78 -46.71 86.72 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.2 mp -69.22 -33.94 60.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.418 -0.801 . . . . 0.0 110.744 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -57.91 -40.81 81.27 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -69.29 -44.74 71.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.477 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.53 -42.92 97.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.1 -31.28 66.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -41.49 98.15 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.214 1.007 . . . . 0.0 109.474 177.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -73.6 -33.93 64.82 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -65.32 -43.34 95.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.92 -33.68 75.16 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.395 0.998 . . . . 0.0 110.556 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.18 -45.36 93.75 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.095 -0.378 . . . . 0.0 110.184 175.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.51 -40.43 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -37.56 69.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.126 -0.359 . . . . 0.0 110.739 178.019 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -63.08 -40.52 97.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.519 0.2 . . . . 0.0 110.787 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -65.91 -39.62 90.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.192 0.52 . . . . 0.0 110.307 179.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -77.28 -9.66 58.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.868 -0.606 . . . . 0.0 112.6 -179.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.69 14.67 60.86 Favored Glycine 0 CA--C 1.52 0.396 0 CA-C-O 121.43 0.461 . . . . 0.0 113.837 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.5 mtp85 -73.51 148.65 42.9 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.955 -0.733 . . . . 0.0 112.665 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.48 -33.75 71.61 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.539 176.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -154.4 151.67 29.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.5 mmm -118.43 141.84 48.15 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 43.4 tttp -120.82 130.75 54.1 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -132.68 125.92 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.901 0.382 . . . . 0.0 111.857 -171.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.3 tp -88.23 123.32 32.73 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 175.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -116.41 127.97 55.09 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.18 116.36 47.57 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 120.991 0.424 . . . . 0.0 110.734 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -83.56 145.4 28.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -121.45 112.0 17.99 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 173.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.5 m -130.28 154.03 48.03 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -170.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.2 m -67.21 -48.28 68.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -141.41 159.59 41.9 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 -177.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.86 157.84 45.59 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.616 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -61.45 146.86 96.7 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 117.715 -1.056 . . . . 0.0 111.168 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.0 m -70.66 -11.71 15.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 118.983 2.957 . . . . 0.0 118.983 -168.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.42 137.41 21.74 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t0 47.17 14.48 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 119.242 3.053 . . . . 0.0 119.242 171.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -69.02 -21.38 64.13 Favored 'General case' 0 C--N 1.318 -0.771 0 O-C-N 121.026 -1.046 . . . . 0.0 113.605 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -59.3 -31.15 68.88 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.019 -0.425 . . . . 0.0 111.473 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.34 -31.07 72.13 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.196 0.522 . . . . 0.0 109.821 177.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.7 mm -71.1 -40.73 75.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.028 0.442 . . . . 0.0 110.159 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.97 5.38 8.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.461 0.648 . . . . 0.0 110.569 178.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.34 -2.69 15.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.815 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -125.24 137.9 54.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.776 0.798 . . . . 0.0 112.512 -175.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 28.2 m -83.28 122.79 28.9 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.395 -2.446 . . . . 0.0 104.395 175.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -82.79 118.42 23.38 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -119.78 126.2 50.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.943 0.877 . . . . 0.0 111.287 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -127.46 75.45 1.59 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.228 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.76 -112.74 5.26 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 119.951 -1.119 . . . . 0.0 111.277 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 46.8 p -77.98 17.7 0.56 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 83.0 t -130.47 140.53 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 123.01 0.524 . . . . 0.0 110.663 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.8 m -131.51 132.54 44.28 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 169.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.3 t -132.01 133.43 60.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -114.13 109.04 49.73 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.18 159.57 20.37 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 117.247 -1.369 . . . . 0.0 113.644 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.93 159.17 44.73 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 102.973 -2.973 . . . . 0.0 102.973 176.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.0 tt -149.23 139.76 16.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.72 108.72 26.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.61 136.29 33.35 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.11 -23.43 67.88 Favored Glycine 0 C--O 1.225 -0.45 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.404 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 26.7 p -59.0 -28.62 66.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -143.43 35.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.244 1.021 . . . . 0.0 108.355 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.8 tt -46.03 -40.55 10.78 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 -173.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.6 -37.93 85.74 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 119.227 -0.989 . . . . 0.0 112.606 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -42.45 29.27 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.958 0.885 . . . . 0.0 110.573 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -39.42 92.09 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.404 -174.677 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -68.27 -44.01 76.51 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 122.082 -0.386 . . . . 0.0 110.35 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -73.62 -14.32 61.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.928 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.12 -31.58 62.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 177.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.61 -37.86 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 120.695 0.283 . . . . 0.0 110.964 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -130.16 77.07 77.02 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 122.101 -0.374 . . . . 0.0 111.5 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.64 -13.8 37.99 Favored 'Trans proline' 0 C--N 1.348 0.548 0 N-CA-C 113.819 0.661 . . . . 0.0 113.819 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.9 m -73.26 -10.51 59.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 178.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -102.53 125.64 49.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -71.58 110.41 6.14 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 13.3 t -63.15 -10.54 15.43 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -62.59 -32.43 73.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.36 0.6 . . . . 0.0 109.767 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -71.29 -7.62 48.23 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.859 0.838 . . . . 0.0 110.232 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 10.9 t -129.71 33.43 4.45 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.078 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.0 m -61.38 146.79 47.07 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -53.99 -41.75 68.27 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -175.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.53 -38.38 87.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.685 0.755 . . . . 0.0 111.274 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -85.07 -17.69 36.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.783 -177.312 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.92 40.07 0.45 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 67.5 m -63.09 149.93 43.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.184 0.516 . . . . 0.0 109.925 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -59.52 -30.81 68.85 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.012 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -72.53 -35.09 67.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.79 0.328 . . . . 0.0 111.213 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -69.04 -26.79 65.15 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -179.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.33 -36.5 78.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.07 0.462 . . . . 0.0 110.209 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -72.66 -40.92 65.94 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 54.2 mtt -62.09 -37.81 86.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.946 0.403 . . . . 0.0 109.988 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.85 97.47 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 122.178 -0.326 . . . . 0.0 110.247 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -64.58 -44.7 89.84 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.958 0.408 . . . . 0.0 110.121 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -63.38 -43.29 98.02 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.545 0.688 . . . . 0.0 109.953 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 37.6 ttt85 -64.02 -34.68 78.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.786 178.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -63.84 -39.56 94.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.215 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.96 -37.68 88.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.951 0.405 . . . . 0.0 109.995 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 14.5 m -69.74 -35.02 74.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.55 0.69 . . . . 0.0 110.904 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -42.93 74.3 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -62.57 -32.99 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 120.494 -0.483 . . . . 0.0 109.882 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.59 -46.02 91.62 Favored 'General case' 0 C--O 1.211 -0.968 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -64.84 -31.32 72.5 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.235 -0.915 . . . . 0.0 111.194 178.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -60.75 -28.47 68.73 Favored 'General case' 0 C--O 1.212 -0.89 0 O-C-N 121.538 -0.726 . . . . 0.0 111.351 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.42 -33.3 74.51 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.606 1.094 . . . . 0.0 110.665 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -65.29 -44.42 88.03 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 93.0 mm-40 -70.9 -31.73 68.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.585 -178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -69.61 -22.46 63.49 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 121.628 -0.67 . . . . 0.0 111.386 178.121 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -68.16 -37.36 80.92 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 176.39 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -32.23 66.12 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.329 175.338 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -61.68 -24.34 66.69 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.986 0.514 . . . . 0.0 111.248 178.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.12 56.6 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -67.18 151.81 46.89 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 22.1 t -77.06 94.54 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.052 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.1 168.24 20.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.163 -177.35 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -135.33 135.53 40.83 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -104.55 4.19 32.67 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.592 0.711 . . . . 0.0 110.243 -178.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 104.48 164.49 24.47 Favored Glycine 0 C--O 1.217 -0.961 0 N-CA-C 107.845 -2.102 . . . . 0.0 107.845 -176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.15 165.12 37.33 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.142 0.971 . . . . 0.0 109.428 -177.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 80.9 mt -111.02 164.3 12.95 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 121.206 0.527 . . . . 0.0 111.807 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -75.08 149.15 39.22 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.31 81.54 7.25 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 -177.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -76.04 154.55 35.61 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.971 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -149.32 143.77 26.02 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 40.1 tp -144.08 149.95 37.4 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 174.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -156.49 164.4 38.28 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -175.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -140.15 146.4 38.76 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 104.14 -2.541 . . . . 0.0 104.14 177.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 . . . . . 0 C--O 1.251 1.139 0 CA-C-O 115.962 -1.97 . . . . 0.0 105.863 -177.803 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.9 mtm . . . . . 0 N--CA 1.488 1.451 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 72.29 106.45 0.07 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.605 1.562 . . . . 0.0 112.897 -178.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp -61.74 -32.25 72.48 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.98 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.1 -36.79 82.8 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.193 -0.317 . . . . 0.0 111.138 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -32.36 73.93 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.412 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -62.95 -52.54 62.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.2 m -59.96 -42.09 93.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.766 0.317 . . . . 0.0 110.73 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -56.29 -55.37 34.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 123.063 0.545 . . . . 0.0 112.15 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -71.07 -28.98 64.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 121.725 -0.61 . . . . 0.0 111.94 -178.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -70.51 -35.58 73.28 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.834 -0.541 . . . . 0.0 110.153 176.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' A' ' 11' ' ' ILE . 4.0 mm -69.38 -42.05 81.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.27 81.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.31 92.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.522 178.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -59.47 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.728 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.7 mt -63.87 -50.01 70.5 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.464 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.95 -42.34 89.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.757 0.313 . . . . 0.0 110.569 -177.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -4.35 38.12 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.8 m -103.12 7.82 38.73 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.722 0.409 . . . . 0.0 110.655 176.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.98 0.33 35.95 Favored Glycine 0 C--O 1.228 -0.246 0 N-CA-C 116.527 1.371 . . . . 0.0 116.527 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.453 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.9 m-85 -72.89 117.96 15.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 118.312 1.056 . . . . 0.0 109.519 177.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.79 134.89 17.01 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -178.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.8 t -78.12 126.1 38.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 117.733 0.767 . . . . 0.0 109.481 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.401 HD11 HD22 ' A' ' 43' ' ' LEU . 51.9 mt -98.64 -47.98 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -149.64 138.68 21.18 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.12 121.98 15.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 118.847 0.749 . . . . 0.0 112.65 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.9 39.73 53.91 Favored Glycine 0 C--O 1.223 -0.568 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.61 175.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -58.51 -44.72 89.58 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.9 t -154.5 -68.06 0.13 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 175.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -139.36 19.39 2.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.837 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.63 154.94 47.36 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.126 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.2 mt -139.4 132.23 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 41.5 m95 -108.58 127.5 54.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.9 mm? -124.01 140.93 52.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.557 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -84.62 126.61 33.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 176.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.73 123.84 88.51 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.4 -29.22 14.0 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 115.56 -2.493 . . . . 0.0 113.12 -178.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -71.3 -31.97 68.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.186 0.517 . . . . 0.0 112.11 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 58.07 38.31 26.57 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.829 1.775 . . . . 0.0 108.68 -176.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.6 t -60.78 -172.63 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.725 171.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.0 m -41.52 -26.13 0.06 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -114.92 139.92 49.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 165.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -86.34 -31.58 21.47 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.843 -0.536 . . . . 0.0 109.786 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.401 HD22 HD11 ' A' ' 23' ' ' ILE . 68.9 mt -140.43 164.62 29.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 -177.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.2 p -135.29 137.36 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -111.83 125.17 53.73 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.13 124.66 39.29 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 104.009 -2.589 . . . . 0.0 104.009 174.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -136.44 125.55 24.51 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -175.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -107.34 99.16 8.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.878 0.847 . . . . 0.0 112.454 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.92 150.1 34.54 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.618 -179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.88 144.44 33.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.72 133.85 55.32 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -85.0 -39.88 17.53 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 122.37 1.081 . . . . 0.0 108.93 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -132.05 157.34 44.41 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -64.35 -19.55 65.54 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -178.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.412 ' HA ' HG22 ' A' ' 58' ' ' VAL . 6.9 pt20 -62.34 -33.24 74.33 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -69.5 -33.04 72.27 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.412 ' O ' HD12 ' A' ' 61' ' ' ILE . 4.8 ttm -72.65 -48.45 39.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.798 177.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 55' ' ' GLN . 23.6 m -58.05 -36.75 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.251 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.16 -29.8 65.66 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.668 -178.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -64.52 -39.18 93.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.412 HD12 ' O ' ' A' ' 57' ' ' MET . 2.9 mt -74.12 -38.32 48.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 122.004 -0.435 . . . . 0.0 111.857 179.286 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -66.59 -29.66 69.77 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.53 -37.76 56.17 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -56.71 -34.29 67.32 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.535 178.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.01 67.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.04 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -69.3 -46.17 67.8 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.908 0.776 . . . . 0.0 109.097 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 -56.74 -43.78 81.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.4 -34.2 57.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.076 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.84 -42.0 95.28 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.685 1.13 . . . . 0.0 109.636 176.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.43 -46.37 90.39 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.36 -38.95 82.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 178.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.57 -44.2 89.66 Favored 'General case' 0 CA--C 1.511 -0.54 0 O-C-N 121.842 -0.536 . . . . 0.0 110.22 179.443 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -66.06 -45.18 82.29 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -61.3 -41.43 96.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -90.0 -5.78 56.31 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.04 9.0 45.62 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 116.413 1.325 . . . . 0.0 116.413 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -67.22 146.62 54.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.912 -0.758 . . . . 0.0 110.477 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -62.41 -35.59 79.71 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.068 0.461 . . . . 0.0 110.338 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -149.49 148.37 29.33 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 175.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -113.75 139.04 49.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -116.06 132.06 56.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -134.56 125.57 27.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.514 0.597 . . . . 0.0 111.022 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.8 tp -89.13 124.44 34.33 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 174.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -113.89 108.64 17.33 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.53 111.55 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.807 0.337 . . . . 0.0 110.52 -176.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -82.78 133.06 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 176.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -111.27 109.47 19.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.0 m -127.31 155.59 43.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.057 0.456 . . . . 0.0 112.108 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.6 m -71.2 -46.92 60.2 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 175.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -138.85 158.76 43.63 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -175.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 146.13 39.61 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.862 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.68 150.3 88.41 Favored 'Trans proline' 0 C--N 1.345 0.363 0 O-C-N 121.895 0.418 . . . . 0.0 113.177 178.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -79.46 -7.49 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 116.728 2.121 . . . . 0.0 116.728 -173.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -108.49 97.0 6.73 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 14.96 55.62 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -73.12 -12.83 61.04 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.71 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.62 -31.16 70.36 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.828 -0.545 . . . . 0.0 111.735 -177.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.77 -33.2 74.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.219 0.533 . . . . 0.0 110.249 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.0 mm -67.25 -37.11 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -176.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.21 73.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.383 0.611 . . . . 0.0 110.824 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.76 -9.31 54.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.367 0.603 . . . . 0.0 111.078 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -88.14 95.74 10.27 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.157 -178.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 86.3 m -68.51 124.24 23.02 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 173.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -87.41 108.28 18.93 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -106.18 128.41 53.91 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.516 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -132.15 75.54 1.64 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.524 -1.288 . . . . 0.0 107.524 177.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.68 5.21 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.116 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.1 p -79.32 20.72 0.51 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.2 t -127.68 141.12 47.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.5 t -139.21 112.89 8.42 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.225 -1.769 . . . . 0.0 106.225 173.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.6 t -109.73 129.4 64.67 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 122.561 1.172 . . . . 0.0 110.311 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -102.07 99.73 13.2 Favored Pre-proline 0 N--CA 1.425 -1.699 0 CA-C-N 111.801 -2.454 . . . . 0.0 107.919 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.94 151.87 21.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 115.292 -2.672 . . . . 0.0 113.032 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.54 150.84 31.76 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 175.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -144.15 134.29 20.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.8 m -115.36 127.59 72.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 103.679 -2.711 . . . . 0.0 103.679 175.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.68 136.34 54.87 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -176.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -46.91 -39.03 10.82 Favored Glycine 0 N--CA 1.461 0.304 0 N-CA-C 117.268 1.667 . . . . 0.0 117.268 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -37.34 63.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.4 ptm -136.53 34.38 2.72 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.961 1.362 . . . . 0.0 108.673 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.3 tp -51.0 -38.52 51.76 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 116.966 2.21 . . . . 0.0 116.966 -172.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -64.97 -41.15 95.71 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.656 0.662 . . . . 0.0 111.255 -177.366 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.92 -37.57 70.02 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -65.91 -40.89 91.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.596 0.712 . . . . 0.0 110.811 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.36 -49.03 78.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.161 -177.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -71.76 -15.11 62.17 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.432 -177.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.99 -35.66 57.0 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.249 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.0 p -94.81 -37.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 120.853 0.359 . . . . 0.0 111.583 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -130.1 75.51 79.27 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 122.036 -0.415 . . . . 0.0 110.662 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.43 -13.83 40.51 Favored 'Trans proline' 0 C--N 1.349 0.598 0 CA-C-O 121.392 0.497 . . . . 0.0 112.813 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 11.9 p -75.62 -8.3 56.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.074 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -78.3 124.83 28.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.301 0.572 . . . . 0.0 110.704 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -76.13 100.03 4.86 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.004 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 5.2 p -62.55 -19.35 63.57 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.316 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -63.93 -25.5 68.17 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.857 0.361 . . . . 0.0 111.431 176.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -70.92 -27.25 63.65 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 7.5 t -100.56 46.06 0.96 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.365 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.73 151.89 32.68 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 178.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.6 mp0 -55.69 -40.32 72.19 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -173.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -65.48 -36.98 85.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.604 0.716 . . . . 0.0 110.928 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -79.38 -23.54 43.25 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.098 -178.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.76 12.38 2.67 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 68.2 m -54.54 141.18 32.28 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 177.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -49.27 -45.86 45.49 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 -172.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -72.28 -26.47 61.99 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -55.79 -24.46 36.03 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 120.992 0.425 . . . . 0.0 110.198 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.7 64.72 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.47 -45.91 85.32 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 75.4 mtm -69.6 -28.93 66.36 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.017 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.97 -31.22 69.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 122.159 -0.338 . . . . 0.0 111.575 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -65.81 -43.72 87.78 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -69.62 -36.63 76.32 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.434 0.635 . . . . 0.0 109.363 -179.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.28 92.55 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.657 177.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -66.78 -40.61 88.24 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.787 0.435 . . . . 0.0 111.86 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.7 mt -64.99 -37.78 88.8 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 121.68 -0.638 . . . . 0.0 110.039 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 38.7 m -69.06 -31.72 70.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.612 0.72 . . . . 0.0 110.282 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.88 -45.49 64.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.943 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.09 -33.06 60.99 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -66.54 -39.21 88.47 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.428 -0.795 . . . . 0.0 109.37 176.15 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -60.76 -34.43 74.44 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 175.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -60.02 -28.54 67.82 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -68.48 -36.31 78.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.156 0.503 . . . . 0.0 111.051 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -76.73 -34.42 58.1 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 176.321 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 8.9 tm0? -63.42 -51.6 65.04 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.202 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -66.01 -22.87 66.47 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.399 0.619 . . . . 0.0 111.14 -178.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 47.6 tttt -75.27 -47.95 25.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.611 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 21.6 p -72.4 -17.43 61.81 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -57.79 -24.31 56.62 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.81 0.844 . . . . 0.0 111.789 177.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.36 -18.63 11.52 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 176.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -74.03 105.94 5.49 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 174.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 10.2 t -58.62 104.63 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -175.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.66 172.7 15.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.522 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -128.92 116.25 19.09 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.412 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -143.04 168.56 19.43 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 105.151 -2.166 . . . . 0.0 105.151 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 72.55 -136.85 23.82 Favored Glycine 0 C--O 1.227 -0.298 0 N-CA-C 108.168 -1.973 . . . . 0.0 108.168 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt 51.88 51.76 15.87 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.562 0.696 . . . . 0.0 112.134 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.5 155.36 40.07 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.2 151.69 45.5 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -160.82 169.05 23.49 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.197 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 54.59 -153.53 0.3 Allowed 'General case' 0 N--CA 1.47 0.535 0 O-C-N 124.724 1.265 . . . . 0.0 111.092 174.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 62.06 -168.9 0.18 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.318 0.647 . . . . 0.0 110.724 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' LEU . . . . . 0.502 ' HG ' ' H ' ' A' ' 183' ' ' TYR . 7.5 tp 62.12 -174.42 0.14 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.967 0.907 . . . . 0.0 112.546 179.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 183' ' ' TYR . . . . . 0.502 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 51.8 p90 -163.35 165.56 23.93 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 103.806 -2.665 . . . . 0.0 103.806 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -133.39 149.78 51.82 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.032 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 -178.949 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttp . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 120.997 0.427 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -134.29 154.26 51.4 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 110.302 -0.259 . . . . 0.0 110.302 -176.545 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 pp -59.66 -32.31 70.34 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.024 0.44 . . . . 0.0 111.231 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.32 -36.54 82.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.897 0.379 . . . . 0.0 111.385 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -68.58 -29.58 68.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.332 -0.23 . . . . 0.0 110.679 -179.348 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.97 -50.0 73.84 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.157 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -64.79 -41.48 95.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.529 179.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -54.5 -52.34 62.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.986 0.422 . . . . 0.0 110.936 179.548 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -73.3 -29.27 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.005 -0.434 . . . . 0.0 111.977 -179.852 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -68.7 -36.09 78.01 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.546 -0.721 . . . . 0.0 111.304 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.6 mm -70.25 -39.08 76.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.843 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.27 -44.56 84.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.72 -42.32 95.33 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.968 178.347 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -62.2 -43.06 99.69 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.655 0.264 . . . . 0.0 111.371 -179.097 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 mt -69.84 -46.26 66.0 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.173 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 40.9 t -54.56 -42.55 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.956 -0.465 . . . . 0.0 110.857 173.171 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -61.35 -33.82 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 110.839 178.069 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -79.65 9.49 5.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 122.922 0.489 . . . . 0.0 112.271 177.886 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.19 -0.21 61.93 Favored Glycine 0 CA--C 1.517 0.212 0 N-CA-C 116.415 1.326 . . . . 0.0 116.415 175.507 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.8 m-85 -68.27 132.23 46.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.93 0.865 . . . . 0.0 110.075 179.891 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.33 133.4 11.77 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.217 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.9 t -75.38 121.45 27.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.3 mt -85.67 -46.07 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 177.102 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -160.52 132.3 5.94 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.39 141.99 35.53 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 174.731 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.58 -80.9 0.05 OUTLIER Glycine 0 CA--C 1.508 -0.391 0 C-N-CA 120.112 -1.042 . . . . 0.0 111.39 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -69.45 158.13 35.75 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.45 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.9 m -76.56 0.74 18.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.18 178.872 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.27 -46.19 14.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -177.41 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -147.68 143.89 27.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -136.69 133.08 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 177.039 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 57.5 m95 -112.25 133.12 54.55 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.142 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.59 131.59 48.16 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 123.426 0.69 . . . . 0.0 109.69 -178.716 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -80.92 132.91 35.46 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.686 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.74 109.59 12.53 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.338 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.2 Cg_endo -74.72 -19.0 19.01 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 117.182 -1.412 . . . . 0.0 112.239 -178.044 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -68.83 -27.88 66.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.908 178.91 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 77.7 mttt 58.74 41.96 20.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 123.175 1.465 . . . . 0.0 107.106 -178.535 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -177.08 0.24 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 111.188 -2.733 . . . . 0.0 113.409 -179.47 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.7 p -51.9 -28.22 15.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.704 175.567 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.532 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 46.8 p-80 -107.36 143.82 35.11 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 173.916 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -85.94 -36.9 19.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.566 -172.276 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -141.66 163.26 33.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.13 -177.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.0 t -122.84 134.57 65.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 175.014 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.25 127.7 38.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.759 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.9 mt -97.51 129.81 44.64 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -136.56 150.37 48.58 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.718 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -115.08 131.5 56.91 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 173.575 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.69 140.43 20.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.588 0.233 . . . . 0.0 111.265 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -93.01 125.51 37.64 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 175.085 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -128.49 101.48 6.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.137 -0.352 . . . . 0.0 111.11 -174.563 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.0 -42.15 58.03 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.925 0.869 . . . . 0.0 111.251 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -129.19 156.89 43.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.316 -179.324 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HD2' HD11 ' A' ' 99' ' ' ILE . 25.7 ptt180 -65.82 -20.58 66.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 122.05 -0.406 . . . . 0.0 111.249 -178.355 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -62.34 -33.31 74.45 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.59 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -72.47 -34.65 67.88 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 121.537 -0.727 . . . . 0.0 109.186 178.264 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -65.25 -47.43 76.8 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.005 178.105 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.2 m -64.78 -31.76 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.538 -0.726 . . . . 0.0 111.207 179.442 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -68.13 -36.17 79.29 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.619 179.417 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.39 -44.81 92.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.472 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.4 -30.74 51.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -176.924 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.15 -40.5 96.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -70.59 -41.07 72.83 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.273 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.412 ' O ' HG23 ' A' ' 68' ' ' VAL . 83.2 mm-40 -57.08 -48.22 79.12 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.009 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.36 94.25 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.603 -177.891 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.55 -38.85 88.01 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 121.545 0.688 . . . . 0.0 110.281 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -61.19 -42.78 99.18 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.345 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.486 HG11 HG13 ' A' ' 109' ' ' VAL . 81.9 t -69.06 -38.71 78.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 119.131 -0.461 . . . . 0.0 112.111 -179.448 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -56.55 -41.16 76.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.038 0.835 . . . . 0.0 110.201 179.812 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.3 mtm-85 -63.55 -33.46 75.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.496 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.8 t -76.72 -44.38 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.902 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.4 mmt-85 -61.05 -34.82 75.48 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -58.04 -39.64 78.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.144 0.497 . . . . 0.0 109.884 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -73.41 -38.65 65.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.918 0.389 . . . . 0.0 111.087 179.276 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.28 -18.02 60.78 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -177.261 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.38 -3.08 1.95 Allowed Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.776 1.471 . . . . 0.0 116.776 179.311 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.27 143.39 43.05 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -62.18 -36.58 82.31 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -149.14 157.86 43.71 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.231 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.38 157.76 27.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.532 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 17.5 mmtt -143.41 132.01 22.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 174.509 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tt -142.47 127.41 18.35 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -175.198 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.4 tp -83.12 104.08 13.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 175.309 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -102.62 108.55 19.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.461 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.7 t -100.38 112.32 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.314 -176.24 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -91.41 106.78 18.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.417 0.627 . . . . 0.0 112.045 -179.903 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -79.19 126.89 31.35 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.482 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 92.2 p -141.42 164.04 31.3 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 122.696 0.398 . . . . 0.0 110.669 -174.342 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 74.3 m -69.7 -49.07 56.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 176.231 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -153.54 177.85 10.48 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 -175.429 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.439 ' HB2' ' HD2' ' A' ' 117' ' ' ARG . . . -96.01 151.19 38.12 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.638 -174.873 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.58 149.74 80.42 Favored 'Trans proline' 0 C--N 1.351 0.661 0 O-C-N 122.475 0.724 . . . . 0.0 113.079 174.831 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.0 m -80.26 -10.71 12.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -175.45 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -117.57 74.87 0.95 Allowed 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -172.836 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 53.38 49.16 20.3 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 174.083 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 49.5 p-90 -68.16 -19.71 64.82 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 121.522 -0.736 . . . . 0.0 109.875 175.517 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -63.06 -34.56 77.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.725 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.59 -35.2 70.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 176.273 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.557 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.3 mm -71.12 -44.57 74.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.132 0.491 . . . . 0.0 111.095 -176.341 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 100' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -67.96 -27.89 66.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.645 0.736 . . . . 0.0 111.79 -177.414 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -93.89 6.22 49.14 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.236 -177.049 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -119.89 144.41 47.42 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.407 0.622 . . . . 0.0 111.436 176.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.7 m -88.2 127.77 35.45 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.415 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -85.0 129.77 34.74 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 175.582 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -132.32 128.96 38.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.543 0.687 . . . . 0.0 110.091 178.475 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -149.54 114.78 5.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.251 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 58.01 -127.29 44.71 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.477 -0.868 . . . . 0.0 114.195 177.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.8 p -82.46 13.11 3.85 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 122.746 0.419 . . . . 0.0 111.155 -178.95 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.486 HG13 HG11 ' A' ' 68' ' ' VAL . 2.3 t -123.57 149.9 27.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -176.903 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.9 t -138.43 139.75 39.02 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 100.259 -3.978 . . . . 0.0 100.259 171.175 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.6 t -136.31 136.57 48.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 118.42 0.554 . . . . 0.0 109.806 -177.189 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -105.62 113.77 63.73 Favored Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 171.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.497 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 69.6 Cg_endo -76.36 158.28 36.88 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 116.158 -2.094 . . . . 0.0 111.638 176.873 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 152.78 37.66 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.35 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.2 tt -145.13 138.01 21.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -177.811 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 96.5 t -118.16 119.97 63.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.016 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.439 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -85.91 156.55 20.46 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 179.687 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.69 -27.67 53.44 Favored Glycine 0 C--N 1.318 -0.456 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 168.75 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 p -67.66 -42.82 81.56 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -177.234 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptp -128.28 37.98 4.06 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.559 1.171 . . . . 0.0 109.281 -179.272 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -45.55 -43.27 11.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.59 -1.641 . . . . 0.0 115.07 -177.233 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.3 mtm180 -69.5 -31.49 69.78 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.495 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -72.31 -41.54 66.44 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.443 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -64.5 -41.5 96.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.495 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.38 -42.14 98.24 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.568 -0.73 . . . . 0.0 112.371 -179.446 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -76.38 -14.34 60.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 119.813 1.188 . . . . 0.0 112.105 -179.07 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -85.09 -40.01 17.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.27 0.557 . . . . 0.0 110.246 178.705 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 42.6 t -91.57 -40.87 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.417 0.627 . . . . 0.0 110.816 -177.523 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -128.44 70.57 79.73 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.876 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.04 -15.69 49.54 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 CA-C-N 118.39 0.461 . . . . 0.0 113.147 179.691 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.7 m -83.37 0.34 46.4 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -73.34 137.02 44.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.327 0.584 . . . . 0.0 109.683 179.376 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -83.56 119.08 24.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.592 0.71 . . . . 0.0 109.805 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.9 p -68.86 -12.68 61.81 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.303 -177.661 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -57.9 -38.98 76.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 122.036 0.922 . . . . 0.0 109.392 177.664 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.36 -9.25 58.26 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.466 -1.243 . . . . 0.0 112.675 -177.178 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.6 t -126.75 36.27 4.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.885 0.374 . . . . 0.0 111.809 -175.645 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 55.3 m -66.94 132.26 47.59 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 176.633 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -68.47 -25.26 64.89 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -175.561 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -64.01 -31.2 72.31 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.362 0.601 . . . . 0.0 110.484 178.744 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -96.98 10.27 39.68 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-O 121.298 0.57 . . . . 0.0 111.756 -178.441 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -75.25 109.11 8.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.275 0.56 . . . . 0.0 110.338 -178.86 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 68.1 m -139.1 147.33 41.82 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.064 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -66.76 -32.16 73.27 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -178.409 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -68.25 -30.75 69.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.486 0.66 . . . . 0.0 110.07 178.235 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -61.3 -27.31 68.39 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.699 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.15 90.2 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.854 -0.529 . . . . 0.0 111.496 177.822 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -65.86 -41.98 90.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 179.446 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 63.2 mtt -67.68 -29.01 68.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.397 178.299 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.06 -34.07 75.56 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.048 -0.407 . . . . 0.0 111.803 -179.298 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 76.7 ttt-85 -65.41 -46.68 79.06 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 178.476 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.65 -46.07 91.35 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.356 -0.537 . . . . 0.0 109.881 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -60.7 -35.52 76.49 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.328 -178.364 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -65.76 -41.36 92.18 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.538 0.208 . . . . 0.0 111.004 176.826 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.2 mt -66.07 -35.94 81.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.033 0.444 . . . . 0.0 110.109 -179.523 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.5 t -69.77 -42.94 73.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.483 0.659 . . . . 0.0 109.422 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.32 -46.0 90.7 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -177.818 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -58.68 -39.4 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 118.966 0.803 . . . . 0.0 111.986 -175.739 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -73.88 -41.08 62.68 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.165 178.305 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -61.37 -32.9 72.83 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.519 0.676 . . . . 0.0 110.295 178.258 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 46.5 tp60 -57.81 -25.77 61.06 Favored 'General case' 0 C--O 1.205 -1.238 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.273 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -61.54 -37.47 83.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 119.199 0.909 . . . . 0.0 110.607 -179.492 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -77.1 -50.45 13.02 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.731 0.777 . . . . 0.0 109.735 176.41 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -65.74 -36.18 82.85 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -174.614 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -61.3 -17.81 55.46 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -177.229 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 13.6 mmtm -66.08 -51.14 60.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 178.931 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 4.5 p -77.2 -34.33 56.2 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 177.005 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.98 -24.38 67.87 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-O 120.935 0.398 . . . . 0.0 111.578 -177.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.3 -14.02 45.03 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 177.898 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -100.02 5.5 45.08 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -179.147 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.28 146.39 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 179.494 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -144.39 168.15 20.79 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.233 0.54 . . . . 0.0 110.019 -178.435 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -151.19 173.5 14.35 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 104.035 -2.58 . . . . 0.0 104.035 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -125.75 45.73 2.55 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.505 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 141.64 173.02 13.64 Favored Glycine 0 N--CA 1.452 -0.247 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -179.13 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -137.89 147.61 44.59 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 -179.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 96.3 mt -117.54 137.25 52.7 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 104.543 -2.392 . . . . 0.0 104.543 176.167 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -148.72 140.15 23.39 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 105.518 -2.031 . . . . 0.0 105.518 -174.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -151.25 166.42 30.97 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.114 0.415 . . . . 0.0 111.078 -176.031 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -142.51 141.92 32.17 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 102.134 -3.284 . . . . 0.0 102.134 175.298 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -135.25 45.89 2.45 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.63 87.19 4.57 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.804 -178.761 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -165.33 129.73 2.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.103 0.477 . . . . 0.0 110.499 169.726 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -144.26 39.23 1.3 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.517 -173.978 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 115.482 -2.199 . . . . 0.0 105.121 -178.535 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ptt? . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.342 0.592 . . . . 0.0 110.761 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -86.39 157.05 19.94 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.619 -0.676 . . . . 0.0 110.074 -178.516 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 56.0 tp -57.21 -36.22 70.6 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.824 0.821 . . . . 0.0 110.027 177.666 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 36.2 mt -59.9 -35.32 74.6 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.986 -178.853 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 43.4 mt-10 -67.38 -26.0 66.24 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.17 -177.165 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.24 -52.74 63.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.65 -41.89 68.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.899 178.691 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.434 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 77.0 t80 -56.85 -52.16 66.18 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.052 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -73.8 -33.53 64.23 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.653 -0.654 . . . . 0.0 112.269 -179.506 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -69.16 -34.82 75.57 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.417 -0.802 . . . . 0.0 111.034 178.222 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 125' ' ' LEU . 11.8 mm -72.72 -34.05 46.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 177.045 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.09 84.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 175.825 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.81 87.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.568 178.032 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -60.33 -46.06 91.24 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.23 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -64.99 -43.14 93.56 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.523 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.72 -43.01 94.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.28 179.775 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.5 p30 -75.38 -10.56 59.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.3 -0.875 . . . . 0.0 112.079 178.451 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.2 m -89.98 6.05 43.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 173.723 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.92 -0.51 67.1 Favored Glycine 0 CA--C 1.517 0.172 0 N-CA-C 116.353 1.301 . . . . 0.0 116.353 175.623 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -66.39 131.1 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 118.187 0.993 . . . . 0.0 110.0 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.94 131.65 10.56 Favored Glycine 0 N--CA 1.451 -0.357 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 -178.208 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.6 t -74.57 125.82 34.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.363 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 61.3 mt -93.65 -48.43 13.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.58 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -149.49 128.76 12.87 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.302 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.32 105.35 4.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 175.119 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.19 -25.89 0.05 OUTLIER Glycine 0 CA--C 1.508 -0.393 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.062 178.283 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 30.4 mp0 -62.9 -22.89 67.06 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.846 0.858 . . . . 0.0 111.08 -179.246 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.1 t 69.41 -23.52 0.15 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 176.426 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -93.68 -30.19 15.04 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 174.596 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -133.28 152.07 51.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.262 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 25.8 mt -140.55 134.61 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 175.063 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 m95 -109.04 132.25 54.29 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -125.72 135.38 52.02 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.802 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.447 ' HA ' HD23 ' A' ' 43' ' ' LEU . 25.0 tt0 -94.75 133.59 38.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 175.748 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.75 128.17 93.75 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -77.78 -28.54 5.1 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 116.657 -1.762 . . . . 0.0 114.378 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -77.67 -28.62 51.21 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 123.62 0.768 . . . . 0.0 112.033 -178.39 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 55.09 40.6 31.95 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.4 m -66.09 -173.12 0.17 Allowed 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 164.612 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.7 t -41.25 -39.45 1.36 Allowed 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -75.84 123.8 26.26 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -104.82 -26.32 12.28 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 176.955 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 34' ' ' GLU . 96.4 mt -140.35 155.41 46.79 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -176.488 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.4 t -132.83 136.12 56.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 175.176 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -124.8 129.93 51.4 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.8 mt -102.55 131.43 49.28 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 174.448 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -136.4 103.03 5.14 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -174.912 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.9 96.38 7.02 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 178.019 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -151.69 122.73 7.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.125 -173.634 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.04 151.38 28.42 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.1 mt -138.59 110.46 7.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -173.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.26 -40.37 67.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -134.15 155.59 49.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.902 -175.206 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -63.87 -22.92 67.14 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 177.64 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.6 -39.51 88.42 Favored 'General case' 0 C--O 1.211 -0.945 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.424 -179.733 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.26 -37.02 80.32 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.252 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.495 ' O ' HD12 ' A' ' 61' ' ' ILE . 18.1 ttt -60.45 -51.6 68.77 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.379 178.925 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.42 -32.53 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 118.895 0.771 . . . . 0.0 111.116 -179.138 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.1 mtm105 -66.53 -38.1 86.43 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.834 0.349 . . . . 0.0 110.439 -178.823 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -60.34 -39.72 88.12 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.013 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.495 HD12 ' O ' ' A' ' 57' ' ' MET . 2.7 mp -74.18 -34.36 37.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.305 -0.872 . . . . 0.0 111.364 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -63.06 -35.33 79.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -68.7 -43.44 76.03 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 175.66 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -58.42 -40.99 83.97 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 121.663 -0.648 . . . . 0.0 110.539 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.65 -43.4 84.72 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 122.233 -0.292 . . . . 0.0 110.777 -178.962 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -64.64 -47.5 78.3 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.338 0.59 . . . . 0.0 110.017 179.146 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -59.14 -49.41 77.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.955 179.353 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.1 p -72.91 -32.34 39.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.685 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.0 -40.16 94.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 118.984 0.811 . . . . 0.0 111.036 -178.074 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -61.16 -35.3 76.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.232 -178.632 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.08 -50.46 19.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 178.371 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -71.08 -30.35 66.45 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -172.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -56.87 -29.65 63.13 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.613 0.642 . . . . 0.0 110.5 177.24 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.63 -21.19 66.55 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 mp -82.73 -12.35 57.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.912 0.387 . . . . 0.0 110.255 178.592 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.18 11.04 66.74 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.224 -0.513 . . . . 0.0 113.459 -178.437 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -67.26 136.94 55.71 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.258 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -63.18 -35.69 81.15 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -174.682 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.1 ptt85 -153.25 156.55 38.69 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 174.767 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -115.85 154.31 29.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.982 0.513 . . . . 0.0 111.451 -177.823 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -136.51 125.37 24.1 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 167.394 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.59 145.02 42.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.662 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.4 tp -108.64 121.28 44.69 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 172.486 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -115.86 108.69 16.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.035 0.38 . . . . 0.0 110.254 -178.641 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -104.94 107.71 23.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 111.997 -176.433 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -77.17 147.94 36.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.176 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -127.14 114.95 18.38 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 171.038 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -133.55 160.15 38.31 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.34 0.656 . . . . 0.0 109.978 -173.483 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -75.97 -50.14 15.73 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.572 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -124.26 158.39 32.63 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 106.553 -1.647 . . . . 0.0 106.553 -176.231 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.36 150.11 56.63 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 177.229 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -58.2 146.61 87.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 118.152 -0.766 . . . . 0.0 113.353 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.56 -12.43 15.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 115.808 1.781 . . . . 0.0 115.808 -174.035 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -133.34 137.84 46.1 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 121.947 -0.471 . . . . 0.0 112.21 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.9 t0 14.57 59.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 119.087 2.995 . . . . 0.0 119.087 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 22.7 p-90 -87.43 -24.1 24.29 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 121.133 -0.98 . . . . 0.0 109.73 178.413 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -64.17 -35.4 80.67 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 121.392 -0.818 . . . . 0.0 112.905 -174.446 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.8 -20.84 61.08 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.223 178.504 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.7 mm -70.41 -39.09 76.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.557 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.542 0.687 . . . . 0.0 111.153 -179.591 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -89.1 1.17 55.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.174 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -103.31 101.15 11.07 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.8 m -70.19 123.25 21.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 173.967 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -84.22 123.3 29.97 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 178.001 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.82 127.96 48.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.795 0.807 . . . . 0.0 109.302 179.237 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -145.5 122.12 11.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.229 -178.746 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.21 -112.95 5.42 Favored Glycine 0 C--O 1.226 -0.405 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 75.7 p -105.01 -2.9 23.89 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 178.525 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.0 t -96.84 139.47 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.842 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 76.3 p -119.69 140.15 51.11 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.631 -2.359 . . . . 0.0 104.631 168.914 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.32 130.96 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.795 0 CA-C-O 121.984 0.897 . . . . 0.0 110.044 179.106 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -100.59 109.46 57.45 Favored Pre-proline 0 N--CA 1.427 -1.624 0 CA-C-N 113.632 -1.622 . . . . 0.0 109.384 -179.947 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.5 154.61 21.16 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 117.894 -0.937 . . . . 0.0 112.085 178.253 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.89 151.95 30.96 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 175.553 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.7 tt -145.69 132.71 15.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.777 0.799 . . . . 0.0 110.489 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 99.2 t -104.72 126.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 175.696 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.89 142.91 43.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 104.511 -2.403 . . . . 0.0 104.511 176.329 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.5 -20.64 59.27 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.531 -0.366 . . . . 0.0 113.926 -175.555 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 55.6 p -62.49 -27.82 69.4 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.261 0.838 . . . . 0.0 113.261 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 19.5 ptp -146.9 44.46 1.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.71 1.243 . . . . 0.0 107.714 178.231 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tp -42.79 -50.41 5.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.606 -1.634 . . . . 0.0 114.777 -175.473 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -66.99 -36.23 81.7 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.885 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.63 -38.77 64.93 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.876 0.47 . . . . 0.0 110.347 -175.278 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -68.77 -38.97 80.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 176.128 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.447 HD11 HD11 ' A' ' 11' ' ' ILE . 1.8 tm? -59.39 -50.18 74.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.439 -177.615 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -71.92 -14.54 61.96 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.58 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.64 -37.26 50.39 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 122.061 -0.399 . . . . 0.0 109.957 177.123 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.7 p -90.28 -36.99 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -128.67 76.13 79.04 Favored Pre-proline 0 C--N 1.326 -0.44 0 C-N-CA 122.613 0.365 . . . . 0.0 110.657 178.205 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.02 -14.68 41.7 Favored 'Trans proline' 0 C--N 1.349 0.596 0 CA-C-O 121.1 0.375 . . . . 0.0 112.904 178.875 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -76.47 -8.98 58.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.798 177.899 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -72.39 138.54 47.28 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.82 83.15 2.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.738 0.78 . . . . 0.0 112.254 -179.398 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.9 p -70.4 -23.12 62.7 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.436 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -63.57 -26.45 68.7 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.825 0.85 . . . . 0.0 111.176 177.666 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -86.96 7.43 27.52 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.384 0.611 . . . . 0.0 109.903 -179.499 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 65.0 m -128.12 164.13 23.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.028 0.918 . . . . 0.0 112.185 -175.56 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 75.3 m -149.99 162.62 40.01 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 102.85 -3.018 . . . . 0.0 102.85 175.813 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -60.01 -35.94 76.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 118.511 0.596 . . . . 0.0 111.079 -179.772 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -66.71 -24.31 66.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.33 0.586 . . . . 0.0 111.896 179.38 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -79.34 -13.77 59.42 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 121.853 -0.529 . . . . 0.0 109.717 -177.529 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.05 16.83 2.17 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.803 0.335 . . . . 0.0 111.665 179.662 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 43.0 t -55.65 152.06 9.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.53 0.681 . . . . 0.0 111.612 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -57.72 -30.85 65.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.962 -178.776 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -72.38 -35.5 68.47 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -179.964 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -71.3 -38.23 71.77 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 179.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.06 88.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.03 0.443 . . . . 0.0 110.681 177.972 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.9 tm0? -68.53 -49.81 56.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.09 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.5 mtt -64.92 -29.74 70.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -178.308 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.92 -33.24 64.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.518 0.192 . . . . 0.0 111.518 -179.158 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -63.98 -47.43 80.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-O 120.959 0.409 . . . . 0.0 109.925 177.878 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -68.18 -38.95 82.57 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.213 0.53 . . . . 0.0 110.573 -177.496 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -66.11 -38.17 87.53 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.153 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -63.9 -44.04 94.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.872 0.368 . . . . 0.0 111.207 176.88 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.18 -33.29 75.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.991 0.425 . . . . 0.0 110.452 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -76.06 -35.77 59.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.576 0.703 . . . . 0.0 110.954 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.2 tt -65.63 -41.23 92.89 Favored 'General case' 0 C--O 1.218 -0.58 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.655 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.5 p -58.08 -39.5 72.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.149 -0.621 . . . . 0.0 111.248 -176.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -73.96 -40.15 63.23 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.15 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -61.53 -30.06 70.4 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.555 -0.716 . . . . 0.0 111.253 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -56.23 -28.37 58.22 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 121.834 -0.541 . . . . 0.0 110.566 178.474 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 75.5 mt-10 -65.96 -40.39 91.27 Favored 'General case' 0 C--O 1.241 0.638 0 O-C-N 121.587 -0.696 . . . . 0.0 111.497 -178.046 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -76.9 -38.24 53.89 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.245 179.395 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -69.56 -37.72 77.14 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -176.938 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 165' ' ' ARG . . . . . 0.416 ' HA ' ' HB3' ' A' ' 168' ' ' GLU . 48.6 mtp180 -56.65 -18.06 10.91 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -177.225 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 23.8 mtmm -62.72 -60.56 3.33 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 175.019 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 3.6 p -72.44 -32.97 66.74 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 179.393 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 168' ' ' GLU . . . . . 0.416 ' HB3' ' HA ' ' A' ' 165' ' ' ARG . 20.2 tt0 -61.99 -27.77 69.09 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.17 -177.136 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.03 -16.14 40.05 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -179.64 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.91 -28.49 61.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.966 0.413 . . . . 0.0 111.796 178.6 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 31.4 m -118.68 150.62 20.91 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.818 0 CA-C-O 122.984 1.373 . . . . 0.0 111.208 -170.968 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -148.6 167.06 26.45 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.499 -1.682 . . . . 0.0 110.149 179.328 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -135.69 167.34 21.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 176.687 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -145.84 162.64 37.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 118.103 0.41 . . . . 0.0 110.537 -178.891 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 164.35 176.39 36.1 Favored Glycine 0 C--O 1.243 0.668 0 N-CA-C 105.779 -2.929 . . . . 0.0 105.779 -179.338 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -159.21 168.92 25.3 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 179.566 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -111.23 144.02 41.06 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 103.357 -2.831 . . . . 0.0 103.357 175.17 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -126.22 158.88 34.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 105.431 -2.062 . . . . 0.0 105.431 179.454 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -141.66 130.13 22.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.55 0.214 . . . . 0.0 110.928 -176.537 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -104.0 172.32 6.87 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 176.437 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -122.32 144.7 48.85 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 120.854 0.359 . . . . 0.0 111.889 -179.04 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 61.6 tp -83.07 -64.23 1.21 Allowed 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.789 178.149 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -161.72 -85.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 100.0 m-85 54.19 52.43 12.66 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.674 0.749 . . . . 0.0 111.191 -179.383 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 . . . . . 0 C--O 1.244 0.813 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 179.262 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 ttt . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.282 0.087 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -99.25 165.1 11.86 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -178.208 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt -57.02 -32.31 66.03 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -175.821 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.8 tp -57.61 -43.7 84.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.064 0.459 . . . . 0.0 110.886 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.99 -29.82 70.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.336 -179.61 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -59.56 -55.65 31.86 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 179.785 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.9 m -60.41 -40.68 91.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.164 0.507 . . . . 0.0 111.561 -178.023 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -56.85 -43.55 81.27 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 178.778 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -78.84 -35.15 44.44 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 123.086 1.422 . . . . 0.0 109.151 -177.236 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -64.91 -39.11 93.02 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 113.131 -1.85 . . . . 0.0 111.798 -176.912 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 26.0 mm -70.23 -37.68 72.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.174 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.17 -42.54 91.03 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.318 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.19 -41.89 94.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 177.939 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -58.27 -46.71 85.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -67.85 -49.42 62.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.92 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.21 -43.01 88.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.052 -177.894 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -11.28 60.86 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.73 -0.606 . . . . 0.0 112.478 -179.028 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.9 m -95.49 6.79 48.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.998 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.7 -1.2 52.51 Favored Glycine 0 C--O 1.228 -0.247 0 N-CA-C 115.989 1.156 . . . . 0.0 115.989 176.527 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.03 118.85 11.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 118.519 1.159 . . . . 0.0 109.103 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.66 127.52 16.31 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 108.772 -1.731 . . . . 0.0 108.772 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.48 130.51 35.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.539 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.39 -41.41 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.244 -176.867 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -140.71 140.24 34.86 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 103.881 -2.637 . . . . 0.0 103.881 178.509 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HA ' HG23 ' A' ' 31' ' ' ILE . . . -136.84 105.32 5.77 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.206 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 47.26 50.4 17.18 Favored Glycine 0 N--CA 1.45 -0.405 0 N-CA-C 116.513 1.365 . . . . 0.0 116.513 171.736 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -64.1 -32.26 73.75 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.9 m -164.67 -57.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 176.512 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -128.62 -17.0 4.17 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 -174.433 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.97 158.63 28.67 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.461 HG23 ' HA ' ' A' ' 25' ' ' ALA . 7.2 mt -138.33 127.42 32.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.515 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.51 132.47 55.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.988 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -127.62 131.85 49.84 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 123.542 0.526 . . . . 0.0 109.684 -178.421 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -84.15 134.48 34.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.744 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 114.97 34.88 Favored Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.389 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -73.61 -28.07 12.21 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 117.239 -1.374 . . . . 0.0 114.157 -174.174 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -9.88 59.25 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 122.171 -0.331 . . . . 0.0 111.461 -179.502 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.7 mtmm 62.2 39.68 12.44 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 -175.176 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -177.71 0.63 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 111.519 -2.582 . . . . 0.0 115.726 -176.807 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -44.99 -28.09 0.63 Allowed 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 177.962 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -114.51 141.43 47.72 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 174.053 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.06 -36.85 55.62 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -178.739 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.7 mt -140.65 163.02 33.99 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 87.0 t -128.19 136.56 59.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 105.213 -2.144 . . . . 0.0 105.213 174.569 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -123.48 129.19 50.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.881 0.372 . . . . 0.0 110.23 179.289 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.4 mt -109.87 120.86 43.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 176.407 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -136.45 132.85 35.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 117.95 0.341 . . . . 0.0 110.289 -176.194 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -106.96 118.79 37.62 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.212 0.529 . . . . 0.0 110.41 179.518 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -151.55 150.18 30.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.966 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -86.05 143.27 28.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.023 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.9 mt -143.69 103.58 4.09 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.729 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -79.62 -38.41 33.89 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 121.769 0.795 . . . . 0.0 111.99 -178.824 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.1 152.77 48.33 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.952 -0.468 . . . . 0.0 110.116 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -64.02 -20.9 66.24 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.7 -33.49 76.08 Favored 'General case' 0 C--O 1.213 -0.863 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.875 179.301 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.07 -32.28 64.92 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 28.6 ttm -66.23 -51.02 61.64 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.448 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.4 m -61.91 -34.55 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 118.82 0.736 . . . . 0.0 111.291 178.894 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -64.71 -38.25 90.34 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 120.752 0.311 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.75 -44.07 94.0 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.417 HG21 ' HB2' ' A' ' 104' ' ' PHE . 1.3 mm -66.14 -31.15 52.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.54 -0.464 . . . . 0.0 112.13 -177.474 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.14 -39.77 94.72 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 177.793 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -68.52 -44.9 73.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.145 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -57.97 -44.17 86.91 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.87 -43.85 90.94 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 111.477 0.177 . . . . 0.0 111.477 -176.984 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.08 -36.26 77.41 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.88 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -64.21 -45.74 86.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.548 177.405 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.69 -37.87 81.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.648 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -61.6 -41.65 97.74 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 122.211 -0.306 . . . . 0.0 110.643 178.76 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.8 mtt85 -62.98 -44.72 95.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.426 179.139 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.24 -40.81 90.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.485 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.2 OUTLIER -68.0 -40.54 83.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.249 -0.907 . . . . 0.0 111.619 179.659 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -60.16 -35.96 76.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.926 0.393 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -60.75 -31.11 70.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -179.241 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.81 9.06 10.62 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -177.348 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.09 5.67 21.43 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 121.472 3.349 . . . . 0.0 121.472 171.274 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.44 146.61 53.83 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.877 1.839 . . . . 0.0 107.44 178.763 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.8 tpt85 -62.31 -42.67 99.56 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -174.596 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -147.39 152.31 37.95 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 118.918 0.781 . . . . 0.0 110.307 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' MET . . . . . 0.441 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -100.4 163.83 12.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.37 123.08 12.58 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.775 -3.787 . . . . 0.0 100.775 174.746 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.41 114.27 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.879 0.763 . . . . 0.0 111.803 -173.777 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 62.2 tp -81.46 117.26 21.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.011 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -111.47 109.52 19.51 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.28 112.18 35.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 120.866 0.365 . . . . 0.0 111.955 -176.483 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -85.76 117.78 24.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.11 177.744 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -94.23 111.44 23.18 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 174.948 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.2 p -122.16 155.19 36.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.83 0.348 . . . . 0.0 111.111 -176.038 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 16.4 m -67.24 -48.41 67.86 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 176.397 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -148.72 159.81 43.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 -177.572 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.09 159.12 40.45 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.717 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.34 147.84 65.0 Favored 'Trans proline' 0 C--N 1.351 0.699 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 179.151 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.2 m -84.44 -5.24 9.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.4 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -115.03 97.11 6.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.649 0.38 . . . . 0.0 111.316 -177.325 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 14.55 64.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 117.9 2.555 . . . . 0.0 117.9 176.506 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 54.8 p-90 -83.57 -16.74 44.21 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -37.06 71.54 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -173.957 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -66.06 -23.95 66.63 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.644 -0.66 . . . . 0.0 111.686 178.533 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.1 mm -67.07 -37.3 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -176.908 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.99 -22.9 64.95 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.655 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -92.04 3.27 55.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.217 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -102.72 98.45 8.47 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 122.033 -0.417 . . . . 0.0 111.63 -178.23 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.6 m -68.04 126.54 29.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 174.251 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' PHE . . . . . 0.417 ' HB2' HG21 ' A' ' 61' ' ' ILE . 9.5 t80 -82.72 109.03 16.53 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.86 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -111.07 114.43 27.7 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.327 -176.226 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -134.57 80.48 1.85 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.609 -177.774 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.13 -108.48 2.49 Favored Glycine 0 CA--C 1.517 0.185 0 C-N-CA 118.902 -1.618 . . . . 0.0 112.747 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.0 p -86.92 11.59 13.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.221 0.608 . . . . 0.0 111.062 179.489 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 92.6 t -120.68 141.06 42.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -176.317 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.8 t -141.23 127.4 19.63 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 104.45 -2.426 . . . . 0.0 104.45 169.734 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.1 t -133.64 123.49 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -102.89 115.8 63.59 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.046 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -79.86 157.58 24.21 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 116.033 -2.178 . . . . 0.0 112.975 179.257 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.78 151.83 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.615 -2.735 . . . . 0.0 103.615 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.1 tt -146.18 142.68 21.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.1 m -124.34 138.19 54.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 104.478 -2.415 . . . . 0.0 104.478 174.373 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.38 142.35 43.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 178.569 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.86 -19.48 61.02 Favored Glycine 0 C--N 1.323 -0.194 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.806 -176.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.1 p -63.9 -33.38 75.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -178.012 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.4 ptm -138.33 36.63 2.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.738 1.256 . . . . 0.0 108.54 -178.74 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 20.4 tp -49.87 -36.53 27.39 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 -173.238 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.64 -48.2 78.2 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.706 -0.621 . . . . 0.0 110.862 -178.111 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.87 -34.17 66.54 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.294 -177.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.79 -42.64 81.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.961 178.264 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.7 -48.6 81.05 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.703 -177.941 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -68.85 -13.78 62.62 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.529 -177.201 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.05 -32.48 50.91 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.171 -0.33 . . . . 0.0 110.66 176.949 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 6.9 p -95.63 -38.19 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 120.887 0.375 . . . . 0.0 111.078 178.846 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -126.87 76.12 75.55 Favored Pre-proline 0 C--N 1.325 -0.495 0 C-N-CA 122.475 0.31 . . . . 0.0 110.534 178.53 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -13.98 39.59 Favored 'Trans proline' 0 C--N 1.347 0.493 0 CA-C-O 121.195 0.415 . . . . 0.0 112.412 178.443 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.4 m -69.87 -13.71 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.3 177.07 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -105.65 127.88 53.32 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.07 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -85.77 135.36 33.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.167 0.508 . . . . 0.0 112.242 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 28.4 p -67.15 -19.6 65.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.15 0.5 . . . . 0.0 110.073 177.754 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -64.65 -14.96 60.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 178.714 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.84 2.06 6.04 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -175.277 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 48.8 t -149.74 100.79 3.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 173.063 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.4 t -62.02 151.55 34.93 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.618 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -61.9 -34.12 75.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.33 0.586 . . . . 0.0 109.697 178.761 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.89 -32.58 72.96 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 122.117 0.96 . . . . 0.0 110.492 177.411 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -93.93 -4.16 50.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.65 -176.668 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.27 37.79 0.34 Allowed 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -176.916 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 75.7 m -68.8 150.51 47.75 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 178.179 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -60.86 -28.81 69.13 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -177.365 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.67 -26.78 68.82 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 121.908 -0.495 . . . . 0.0 110.714 177.913 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -67.64 -27.57 66.99 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.518 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.29 80.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.979 0.419 . . . . 0.0 110.293 178.535 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -74.26 -45.88 45.03 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.961 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 20.2 mmt -59.14 -31.4 68.93 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.339 179.642 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.2 81.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 122.244 -0.285 . . . . 0.0 111.147 179.453 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -67.85 -47.39 69.08 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.22 -42.86 99.68 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 -176.962 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.39 -34.44 74.53 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.635 178.649 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -66.35 -45.45 80.14 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.075 0.398 . . . . 0.0 110.13 176.963 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.18 -39.72 93.63 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 40.1 m -67.02 -37.47 84.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.675 177.223 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.14 -38.83 91.87 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.278 -179.509 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.3 t -57.75 -47.96 84.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.462 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -70.18 -39.07 75.48 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 121.808 -0.558 . . . . 0.0 110.342 179.928 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -63.11 -29.98 71.23 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 121.965 -0.459 . . . . 0.0 111.837 178.841 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -56.23 -30.72 62.74 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 177.463 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -70.19 -34.94 73.57 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.188 0.518 . . . . 0.0 110.755 -179.412 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -68.66 -40.9 79.99 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 176.647 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -70.48 -38.31 74.38 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -59.28 -17.61 30.24 Favored 'General case' 0 C--O 1.214 -0.806 0 N-CA-C 117.621 2.452 . . . . 0.0 117.621 -171.912 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.4 -22.59 43.95 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.347 -0.845 . . . . 0.0 110.347 173.563 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 1.9 m -72.39 -23.35 61.09 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 177.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -64.23 -24.29 67.62 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.992 0.517 . . . . 0.0 110.444 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.82 -14.21 62.42 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 178.808 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -69.01 142.79 54.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.986 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 24.5 t -76.73 94.22 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.421 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.84 173.99 14.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.498 -177.442 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -147.38 148.66 31.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.749 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -155.48 144.38 20.64 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 179.387 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.04 174.44 30.58 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.186 -179.204 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -164.3 127.88 2.54 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.552 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.2 mp -131.28 150.1 52.29 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 176.18 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 179.42 152.34 0.4 Allowed 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 177.491 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 47.1 mtt85 61.35 -121.95 0.81 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 -177.056 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 52.66 36.92 22.14 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.173 0.589 . . . . 0.0 111.152 177.342 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -144.03 157.43 44.33 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -175.42 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 11.8 tp 67.91 167.91 0.26 Allowed 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.871 1.357 . . . . 0.0 112.653 178.226 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -151.3 157.82 43.03 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 105.471 -2.048 . . . . 0.0 105.471 -178.856 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -152.54 5.67 0.39 Allowed 'General case' 0 C--N 1.323 -0.552 0 O-C-N 123.191 0.307 . . . . 0.0 110.922 179.362 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 117.03 -1.462 . . . . 0.0 111.11 -177.103 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.2 mtm . . . . . 0 N--CA 1.497 1.92 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -67.99 -2.54 7.8 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -177.484 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.01 -44.93 83.31 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.544 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.02 -35.28 78.02 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.332 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.64 -33.03 74.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -176.275 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -60.38 -48.59 81.09 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.577 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.0 m -68.84 -40.11 79.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.046 0.45 . . . . 0.0 111.198 179.362 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -54.44 -52.23 62.45 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -70.14 -27.01 64.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.604 -0.685 . . . . 0.0 111.339 -179.885 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -68.51 -36.75 79.32 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.796 -0.565 . . . . 0.0 110.23 176.452 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.8 mm -67.0 -45.09 87.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 177.421 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.34 77.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.221 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.5 99.28 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -35.71 77.37 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.889 -178.308 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -69.72 -47.25 63.78 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.62 -41.59 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.168 177.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -75.05 -6.65 50.58 Favored 'General case' 0 C--O 1.217 -0.618 0 O-C-N 121.026 -1.046 . . . . 0.0 112.34 179.45 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.3 m -92.6 10.3 31.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 173.583 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.62 -3.55 56.25 Favored Glycine 0 C--N 1.329 0.167 0 N-CA-C 116.147 1.219 . . . . 0.0 116.147 175.716 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -67.53 125.23 25.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.649 0.724 . . . . 0.0 110.246 -179.902 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.71 131.24 10.29 Favored Glycine 0 C--O 1.225 -0.437 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.135 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.6 t -73.55 126.69 34.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 179.334 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.491 HD11 HD22 ' A' ' 43' ' ' LEU . 71.8 mt -92.72 -43.12 13.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 177.305 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -149.16 121.03 8.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.607 -176.075 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.24 122.86 16.26 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 171.501 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.28 -54.82 0.06 OUTLIER Glycine 0 CA--C 1.504 -0.6 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 178.438 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -68.97 139.88 55.04 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 105.072 -2.196 . . . . 0.0 105.072 176.143 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.6 m -74.74 -8.95 57.98 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -174.027 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -111.14 -9.8 14.34 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 -175.305 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.69 129.72 20.75 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -177.896 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 89.1 mt -135.89 131.78 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.077 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.8 m95 -109.17 138.74 45.06 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.046 0.45 . . . . 0.0 110.882 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mp -132.57 137.97 47.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.131 0.972 . . . . 0.0 109.963 -178.31 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -86.57 133.92 33.68 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.375 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 119.76 77.93 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 103.393 -2.818 . . . . 0.0 103.393 174.964 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.55 -23.32 27.32 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 116.356 -1.962 . . . . 0.0 112.807 -173.545 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -71.35 -34.82 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 179.632 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 58.05 41.08 24.66 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.818 1.771 . . . . 0.0 108.652 -169.22 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -75.12 -172.78 1.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 110.939 -2.846 . . . . 0.0 105.681 172.816 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.2 m -41.22 -27.79 0.08 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -108.58 133.84 52.16 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.085 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -87.69 -44.73 10.96 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.185 0.516 . . . . 0.0 111.152 -178.224 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.491 HD22 HD11 ' A' ' 23' ' ' ILE . 76.2 mt -137.07 160.64 38.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.674 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.1 t -130.7 135.61 59.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 177.683 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 135.66 52.54 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 174.588 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -106.04 130.21 54.0 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 -179.591 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -130.27 124.74 33.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.846 0.355 . . . . 0.0 111.54 -176.823 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -103.3 94.52 5.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -149.36 133.85 17.58 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -175.779 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -78.28 144.64 35.95 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.739 -1.119 . . . . 0.0 108.439 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -135.93 110.05 8.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.762 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -81.42 -39.66 24.58 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.661 0.743 . . . . 0.0 111.4 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -127.0 149.78 49.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.567 -178.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -66.29 -18.86 65.6 Favored 'General case' 0 CA--C 1.504 -0.803 0 O-C-N 122.341 -0.225 . . . . 0.0 111.378 -178.732 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -62.99 -33.42 75.37 Favored 'General case' 0 C--O 1.211 -0.97 0 C-N-CA 119.616 -0.834 . . . . 0.0 108.874 178.054 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.36 -38.26 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.964 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.5 ttm -59.8 -51.18 70.83 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.802 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 15.1 m -64.55 -31.83 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-O 121.166 0.508 . . . . 0.0 111.496 -178.112 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -70.06 -41.47 74.12 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.55 -177.64 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -58.57 -41.99 86.94 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.9 mm -70.07 -33.69 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 119.776 -0.769 . . . . 0.0 111.788 -178.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -31.05 69.98 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.763 -178.772 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -45.33 58.77 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 175.15 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -57.49 -35.05 69.7 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.176 179.525 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.72 -34.48 74.45 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 122.354 -0.216 . . . . 0.0 111.261 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -69.91 -38.97 76.42 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.229 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -61.59 -43.43 98.88 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.679 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.421 HG11 HG13 ' A' ' 109' ' ' VAL . 70.8 t -64.98 -44.24 96.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 179.41 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.41 -46.06 87.2 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.746 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm105 -61.33 -42.3 98.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -177.719 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.3 -38.54 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.695 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -30.21 70.1 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.151 -0.968 . . . . 0.0 111.533 -177.959 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -40.24 78.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.759 0.314 . . . . 0.0 110.415 179.354 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -67.18 -39.38 86.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.917 -178.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.11 -8.13 59.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.892 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.38 19.44 68.6 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 114.029 0.372 . . . . 0.0 114.029 179.787 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.2 mtp85 -67.39 141.23 57.13 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 121.761 -0.846 . . . . 0.0 111.936 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.35 -35.14 78.77 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 178.002 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -155.72 147.56 23.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -122.45 139.91 53.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 178.104 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -113.46 121.39 44.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.92 0.39 . . . . 0.0 111.033 177.703 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -110.95 130.54 55.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.363 -178.121 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -93.05 121.13 34.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.607 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -115.89 128.33 55.71 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.742 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.4 t -125.45 113.87 37.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.969 0.414 . . . . 0.0 110.676 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -80.05 146.21 32.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.056 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -123.85 111.85 16.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 173.209 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 46.3 t -135.41 161.08 36.44 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.465 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -75.17 -29.06 60.32 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.799 -0.563 . . . . 0.0 110.042 -177.615 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -152.76 167.35 29.3 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.73 160.76 27.09 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.84 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -55.24 149.77 43.64 Favored 'Trans proline' 0 C--N 1.35 0.626 0 N-CA-C 115.609 1.35 . . . . 0.0 115.609 -179.339 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -76.27 -15.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -176.706 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -119.2 98.44 6.16 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 116.118 1.896 . . . . 0.0 116.118 -175.087 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 45.42 29.1 0.55 Allowed 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 118.549 2.796 . . . . 0.0 118.549 170.967 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -61.73 -22.25 65.22 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 121.089 -1.007 . . . . 0.0 111.283 178.776 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.69 -31.42 72.31 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 121.839 -0.538 . . . . 0.0 111.01 -178.026 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.47 -35.56 76.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.8 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.58 -40.06 83.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -176.627 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.68 -15.85 63.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.56 0.56 50.24 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 122.054 -0.404 . . . . 0.0 110.912 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -123.8 116.01 22.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.791 0.805 . . . . 0.0 111.466 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.1 m -68.19 128.3 36.06 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 176.19 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -82.74 107.81 15.65 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -178.32 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -117.11 137.63 52.17 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.894 0.854 . . . . 0.0 111.926 -176.312 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -137.21 75.29 1.52 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 177.467 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.42 -111.09 3.9 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 119.491 -1.338 . . . . 0.0 112.221 178.767 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.5 p -73.43 8.9 1.53 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.547 1.139 . . . . 0.0 113.39 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.421 HG13 HG11 ' A' ' 68' ' ' VAL . 67.6 t -127.82 143.79 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 C-N-CA 122.793 0.437 . . . . 0.0 111.307 -177.687 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.8 p -143.62 131.32 21.33 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 171.56 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.0 t -136.77 138.9 45.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 122.178 -0.326 . . . . 0.0 110.284 -179.033 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.25 122.62 53.45 Favored Pre-proline 0 CA--C 1.535 0.381 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.672 175.557 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -83.31 65.28 7.73 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 121.829 1.686 . . . . 0.0 113.708 178.151 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -79.26 153.69 29.72 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 tt -149.37 143.23 18.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.5 t -116.41 112.31 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 173.222 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.413 ' HE ' ' CG ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -94.52 136.18 35.12 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.353 0.597 . . . . 0.0 109.7 178.995 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.94 -37.82 93.22 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -176.699 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.5 t -57.04 -17.77 11.44 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.298 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -146.48 31.97 0.98 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tt -46.71 -40.09 12.73 Favored 'General case' 0 C--O 1.209 -1.073 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -173.496 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -59.24 -50.23 74.81 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.985 -176.756 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -73.76 -39.45 64.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.1 0.953 . . . . 0.0 111.817 179.168 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.413 ' CG ' ' HE ' ' A' ' 117' ' ' ARG . 1.8 t0 -67.11 -35.23 79.3 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.73 0.776 . . . . 0.0 112.136 -176.454 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.23 -43.34 74.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.105 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -69.92 -16.96 63.3 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.92 -175.954 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.25 -25.73 61.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.905 0.383 . . . . 0.0 110.294 177.356 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.06 -41.5 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.203 0.525 . . . . 0.0 110.545 179.735 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -127.05 75.91 76.37 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 123.113 0.565 . . . . 0.0 111.434 -178.635 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.91 -17.49 41.49 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.759 1.023 . . . . 0.0 114.759 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.1 m -85.61 0.99 51.02 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -179.911 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -72.48 134.72 45.46 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.646 0.736 . . . . 0.0 112.877 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -82.18 97.68 8.34 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.902 177.674 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 41.8 p -68.21 -18.62 64.63 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.954 178.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.0 -36.02 82.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.913 0.387 . . . . 0.0 111.049 177.566 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -75.75 -13.92 60.31 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.757 0.789 . . . . 0.0 109.854 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 24.6 t -131.1 50.58 2.22 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.369 -176.22 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 76.6 p -64.59 157.16 27.75 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.367 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.78 -34.52 74.61 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.121 0.486 . . . . 0.0 112.071 -176.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -70.34 -31.2 68.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.432 0.634 . . . . 0.0 111.132 -179.544 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -79.51 -11.82 59.88 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.82 -176.374 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -77.51 34.25 0.17 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -176.15 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 58.7 m -65.32 151.65 45.72 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -64.05 -37.53 87.77 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -174.109 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.47 -30.19 65.71 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.662 0.744 . . . . 0.0 109.287 178.47 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.92 -24.32 64.27 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.15 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.34 -38.22 90.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -42.8 95.07 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.656 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 80.9 mtp -64.2 -28.94 70.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 178.397 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.39 69.38 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.59 -0.694 . . . . 0.0 110.373 178.125 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -68.85 -46.43 68.55 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.06 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.81 -40.95 97.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.764 0.792 . . . . 0.0 109.579 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 58.9 ttt85 -59.14 -45.49 90.81 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.387 176.77 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.21 -41.44 85.79 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.583 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.65 -39.13 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.332 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.1 m -69.58 -38.44 77.37 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.445 176.983 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.69 -49.07 74.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.863 -178.355 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.1 p -62.43 -38.91 82.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 118.343 0.52 . . . . 0.0 110.809 -177.371 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.06 -40.48 68.29 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 119.857 -0.737 . . . . 0.0 110.028 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -65.18 -31.76 73.1 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.261 -0.899 . . . . 0.0 110.797 178.57 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.15 -28.47 62.78 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.257 -0.277 . . . . 0.0 110.749 179.094 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -62.02 -37.38 84.69 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.474 -179.726 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -76.92 -51.01 11.97 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.891 0.377 . . . . 0.0 110.031 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -60.12 -45.47 92.89 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -174.194 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -63.54 -17.77 63.15 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -177.084 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -68.84 -43.94 74.44 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.79 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 19.5 m -72.31 -45.82 58.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.611 178.636 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.71 -24.48 67.79 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.033 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -54.87 -29.24 55.05 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -179.197 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 40.16 57.62 2.37 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.817 0.817 . . . . 0.0 112.47 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 171' ' ' VAL . . . . . 0.422 HG23 ' H ' ' A' ' 171' ' ' VAL . 1.7 t -51.14 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -174.055 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -154.24 163.82 39.52 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.939 -1.875 . . . . 0.0 105.939 178.759 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -71.16 -25.16 62.43 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.565 179.22 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 58.63 -168.64 0.14 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.728 0.811 . . . . 0.0 113.007 177.869 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 173.28 102.88 0.16 Allowed Glycine 0 C--O 1.225 -0.421 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 179.472 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -143.99 131.28 20.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -177.723 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -148.67 114.56 5.73 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.551 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -160.98 167.86 25.7 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 -178.502 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -145.81 122.0 10.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.262 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -73.33 157.08 37.66 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 176.557 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -145.52 98.57 3.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 178.722 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -156.03 162.51 40.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.503 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -148.27 154.46 40.07 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 178.831 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -149.99 39.26 0.76 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 177.45 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 116.275 -1.821 . . . . 0.0 106.764 -176.724 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 119.577 -0.249 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -137.54 155.14 49.58 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 117.908 0.322 . . . . 0.0 111.472 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 72.4 mt -66.37 -32.32 73.63 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 173.05 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.72 -40.39 92.12 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 114.508 -1.224 . . . . 0.0 110.328 177.247 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -67.84 -38.42 83.17 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.071 0.548 . . . . 0.0 109.988 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -60.27 -46.63 89.14 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.83 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.7 m -68.01 -40.71 82.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.511 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -55.55 -52.14 64.72 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.497 0.719 . . . . 0.0 111.907 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.33 -28.35 67.07 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.661 -0.649 . . . . 0.0 111.571 -178.928 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp -69.71 -38.2 76.84 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.906 -0.496 . . . . 0.0 109.684 176.333 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.662 HD11 HD11 ' A' ' 125' ' ' LEU . 12.4 mm -62.48 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 177.357 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.85 -41.91 75.04 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.132 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.32 96.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 178.518 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -62.84 -45.69 91.41 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.259 -178.874 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.84 -46.92 76.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.277 -176.644 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.4 t -57.38 -43.43 82.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.511 0.672 . . . . 0.0 109.537 178.798 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -78.88 3.75 16.05 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -178.04 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 60.6 m -107.58 11.21 28.85 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.645 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.24 7.06 62.49 Favored Glycine 0 CA--C 1.516 0.148 0 N-CA-C 115.528 0.971 . . . . 0.0 115.528 177.499 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -69.91 129.65 40.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.382 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.77 133.31 15.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 109.139 -1.585 . . . . 0.0 109.139 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -84.44 115.66 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 117.83 0.815 . . . . 0.0 108.999 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 73.9 mt -90.19 -44.54 14.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 178.237 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -149.86 132.43 15.78 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.514 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.26 132.47 28.14 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 172.395 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -168.96 -59.99 0.03 OUTLIER Glycine 0 C--N 1.322 -0.224 0 C-N-CA 119.744 -1.217 . . . . 0.0 115.317 176.975 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -132.2 163.81 27.73 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 -176.609 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.0 m -65.81 -8.11 19.82 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -65.47 -49.24 69.83 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.953 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -151.05 124.91 9.15 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 175.181 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -124.65 120.61 59.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 169.131 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -107.28 121.79 45.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -178.615 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -120.47 128.94 53.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.1 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -84.67 126.13 33.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.24 178.443 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.56 135.32 95.71 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -178.839 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.82 -24.85 20.82 Favored 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 115.903 -2.265 . . . . 0.0 112.641 178.08 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -74.94 -29.6 60.99 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.073 0.549 . . . . 0.0 112.124 179.422 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.0 mttm 57.04 39.69 29.09 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.188 0.994 . . . . 0.0 112.641 178.701 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.24 -177.61 0.3 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 113.892 -1.504 . . . . 0.0 110.474 176.322 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -51.87 -34.02 39.11 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 175.306 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -90.63 112.12 23.72 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 103.495 -2.78 . . . . 0.0 103.495 170.069 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -105.49 -35.14 7.57 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.12 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -127.43 154.99 44.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 122.046 -0.409 . . . . 0.0 111.81 -175.939 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.7 p -131.79 137.57 54.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 175.406 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.48 114.19 22.48 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 175.404 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tp -79.37 132.71 36.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -136.46 150.52 48.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -174.745 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -125.76 110.5 13.8 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -151.74 150.32 30.06 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 178.825 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -114.09 134.79 54.64 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 177.601 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.25 134.35 55.18 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -175.312 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -84.21 -36.58 22.67 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.678 0.752 . . . . 0.0 110.912 176.23 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -135.61 164.63 27.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.476 -176.619 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.413 ' HD2' HD11 ' A' ' 99' ' ' ILE . 19.4 ptt-85 -64.38 -22.75 67.06 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.787 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -67.72 -33.15 74.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.007 -177.237 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -65.75 -41.32 92.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 175.794 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.9 ttm -62.22 -51.88 66.01 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.828 -179.407 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.9 m -60.87 -31.85 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.813 0.733 . . . . 0.0 111.099 -178.133 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -68.6 -38.71 80.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.283 -178.02 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -65.77 -35.71 81.48 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.276 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.4 mm -67.27 -34.67 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.864 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.25 -29.09 67.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.481 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -69.75 -42.82 73.37 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.164 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -57.73 -39.7 77.91 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.411 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -37.12 79.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.591 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.49 -44.96 89.33 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.891 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -60.96 -43.09 99.24 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.404 179.09 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.65 -31.25 51.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 122.038 -0.414 . . . . 0.0 110.399 -179.05 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.76 -33.55 75.39 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 121.513 -0.742 . . . . 0.0 109.476 175.825 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -72.4 -46.89 53.18 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 174.096 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.96 -47.29 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.912 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.91 -30.25 67.67 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.815 -0.553 . . . . 0.0 110.804 -179.237 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -73.58 -39.99 64.24 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.111 -0.368 . . . . 0.0 110.636 176.678 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.41 -48.6 72.26 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.13 5.7 49.78 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.351 0.596 . . . . 0.0 112.124 -178.764 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.55 -3.08 6.58 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 119.297 2.479 . . . . 0.0 119.297 173.331 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.4 mtp180 -64.24 132.87 51.56 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.144 1.472 . . . . 0.0 108.767 -178.807 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -64.71 -24.34 67.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.977 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -147.0 148.89 32.16 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.094 -2.928 . . . . 0.0 103.094 178.841 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 8.9 mmm -136.77 148.48 47.25 Favored 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.47 0.481 . . . . 0.0 111.155 -176.968 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 110' ' ' SER . 85.7 tttt -126.61 133.94 50.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 171.865 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -126.84 133.76 50.67 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.525 0.73 . . . . 0.0 109.039 -176.075 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.9 tp -94.66 126.26 39.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.893 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -116.5 108.7 16.33 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.1 t -105.83 114.87 46.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.237 -176.71 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -83.3 156.08 23.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 176.62 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -128.18 111.48 13.48 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 172.145 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.9 m -130.11 158.72 38.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.576 0.547 . . . . 0.0 111.453 -173.543 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.9 m -67.06 -47.3 71.7 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.71 0.767 . . . . 0.0 109.051 -179.834 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -148.48 174.39 12.13 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.012 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.55 145.32 29.73 Favored Pre-proline 0 C--N 1.313 -0.992 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.798 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 146.25 97.48 Favored 'Trans proline' 0 C--N 1.346 0.43 0 O-C-N 122.246 0.603 . . . . 0.0 112.759 176.714 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.9 m -81.8 -21.61 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -86.68 83.3 7.62 Favored 'General case' 0 C--O 1.216 -0.667 0 O-C-N 121.986 -0.446 . . . . 0.0 110.906 -177.618 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 t0 14.81 78.9 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 116.996 2.221 . . . . 0.0 116.996 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -90.08 -13.63 35.45 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.326 -1.306 . . . . 0.0 109.995 177.752 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -65.49 -31.3 72.3 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 107.535 -1.284 . . . . 0.0 107.535 -179.133 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 tp10 -59.24 -34.76 72.6 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 173.835 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.413 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.0 mm -71.2 -40.09 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.91 -22.2 65.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 111.256 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -87.97 0.47 55.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -125.99 130.27 50.87 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.953 0.882 . . . . 0.0 113.064 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.0 m -74.37 128.88 36.66 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 173.766 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -82.91 124.29 30.21 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.38 129.09 45.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.624 0.726 . . . . 0.0 109.537 178.959 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -143.1 122.74 13.29 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.5 179.868 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.09 -112.7 5.21 Favored Glycine 0 C--O 1.225 -0.418 0 N-CA-C 108.8 -1.72 . . . . 0.0 108.8 -178.813 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 9.7 t -122.87 22.67 9.62 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-O 121.722 0.772 . . . . 0.0 109.641 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.24 156.72 5.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.521 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 31.5 t -138.51 127.96 24.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 103.657 -2.72 . . . . 0.0 103.657 178.114 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.98 136.5 58.72 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-O 122.296 1.046 . . . . 0.0 109.223 179.12 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -112.3 114.96 50.32 Favored Pre-proline 0 N--CA 1.429 -1.5 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.939 -177.677 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -79.56 151.69 22.56 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 116.701 -1.733 . . . . 0.0 112.204 178.269 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 149.74 29.85 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 102.639 -3.097 . . . . 0.0 102.639 174.018 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 tt -149.43 122.29 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 118.431 0.559 . . . . 0.0 109.63 -176.732 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.7 t -95.32 110.36 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 177.704 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.63 136.23 37.44 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 178.778 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.43 -25.46 57.91 Favored Glycine 0 C--O 1.229 -0.211 0 CA-C-N 116.359 -0.382 . . . . 0.0 113.99 -177.396 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -58.0 -30.4 66.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.829 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -139.19 25.14 2.49 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.315 0.579 . . . . 0.0 110.292 -177.837 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.5 tt -44.41 -37.63 3.53 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -174.541 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -56.93 -49.36 75.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.845 0.748 . . . . 0.0 111.772 -178.976 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -78.66 -39.24 37.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 122.362 1.077 . . . . 0.0 111.141 178.735 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -63.35 -38.14 90.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.776 -175.268 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.662 HD11 HD11 ' A' ' 11' ' ' ILE . 1.9 tm? -66.59 -48.36 69.81 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.006 -0.434 . . . . 0.0 110.18 -178.628 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -69.35 -17.04 63.66 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.961 -176.899 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.87 62.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.695 -0.23 . . . . 0.0 110.929 178.723 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 p -109.06 -37.32 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 120.794 0.33 . . . . 0.0 111.137 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.38 80.5 72.04 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 121.954 -0.466 . . . . 0.0 111.247 178.963 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -71.29 0.29 6.98 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 114.294 0.844 . . . . 0.0 114.294 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 42.8 p -82.4 -2.63 53.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.166 0.508 . . . . 0.0 110.942 177.622 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -70.5 120.57 16.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.442 0.639 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.9 ttt85 -84.09 102.79 12.8 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.352 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.5 p -62.28 -23.2 66.58 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.162 0.506 . . . . 0.0 111.875 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -65.27 -28.56 69.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.005 0.431 . . . . 0.0 111.491 177.74 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -81.52 -1.76 47.35 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.511 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.3 t -132.84 51.42 2.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.5 -175.739 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 87.7 p -68.29 162.73 24.5 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 177.528 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -61.58 -26.1 67.75 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -176.694 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -63.71 -30.21 71.34 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.708 0.766 . . . . 0.0 110.619 177.771 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -95.07 -2.67 49.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.334 -177.338 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.31 32.19 0.45 Allowed 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.928 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.7 t -82.8 151.21 26.2 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.74 -0.6 . . . . 0.0 109.859 177.714 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -65.83 -31.19 72.01 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 179.792 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -68.84 -26.46 65.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.432 0.634 . . . . 0.0 110.901 -178.11 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -68.89 -23.28 64.18 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.974 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.47 -43.74 71.96 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.12 -31.33 65.92 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.698 -179.395 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 76.6 mtp -70.51 -28.93 65.34 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.733 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.01 72.05 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.872 -0.517 . . . . 0.0 110.241 177.556 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -67.07 -44.67 79.52 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -65.06 -40.24 94.41 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.763 0.792 . . . . 0.0 109.57 -178.98 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -58.85 -44.62 91.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.195 177.295 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -68.35 -43.33 77.7 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 178.994 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.3 mt -63.28 -34.88 78.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.865 0.364 . . . . 0.0 110.042 -179.367 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 26.2 m -72.72 -38.57 67.43 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.516 0.674 . . . . 0.0 110.166 175.526 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.6 tt -64.75 -39.11 93.07 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.121 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.88 -42.93 90.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 119.056 0.843 . . . . 0.0 111.561 -177.607 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -72.87 -31.41 64.71 Favored 'General case' 0 C--O 1.217 -0.62 0 O-C-N 121.372 -0.83 . . . . 0.0 108.861 178.323 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -64.3 -36.14 83.14 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 176.526 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -67.56 -35.02 78.23 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.509 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -68.34 -36.94 80.01 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.53 0.681 . . . . 0.0 109.226 178.173 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -66.48 -37.46 85.15 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.458 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -61.61 -46.89 87.89 Favored 'General case' 0 C--O 1.211 -0.926 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.53 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -56.51 -34.85 67.39 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.587 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -67.07 -51.97 47.95 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.092 -0.38 . . . . 0.0 110.911 177.22 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 14.7 t -72.3 -19.58 61.65 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 -179.478 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.61 -24.36 65.44 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.591 0.757 . . . . 0.0 112.25 179.386 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.52 -14.22 39.48 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 176.72 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.92 146.61 43.84 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 176.702 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 23.4 t -73.55 96.79 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -178.809 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.18 179.99 7.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.43 -177.804 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -150.89 160.42 43.91 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.816 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -156.96 142.99 17.92 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.283 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -159.92 27.96 0.35 Allowed Glycine 0 C--O 1.228 -0.262 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 177.518 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -82.4 86.83 6.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.096 0.474 . . . . 0.0 111.818 -175.997 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 56.5 tp -67.83 -40.87 83.71 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.417 179.125 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 54.07 33.83 18.58 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 179.301 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -138.13 104.57 5.26 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 175.913 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -140.92 -171.75 3.32 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -177.338 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 36.0 t30 56.6 37.37 28.76 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 177.616 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.29 166.09 14.55 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 175.072 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -149.53 164.45 35.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -175.468 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -159.31 166.45 31.19 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 103.715 -2.698 . . . . 0.0 103.715 177.687 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 . . . . . 0 C--O 1.243 0.742 0 N-CA-C 104.649 -2.352 . . . . 0.0 104.649 179.405 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.2 mtp . . . . . 0 N--CA 1.484 1.244 0 CA-C-O 119.9 -0.095 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -69.14 138.63 54.35 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -56.98 -32.07 65.7 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 120.888 0.375 . . . . 0.0 110.414 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 78.0 mt -53.74 -35.23 60.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 179.091 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.466 ' HB2' ' HB1' ' A' ' 147' ' ' ALA . 40.0 mt-10 -61.34 -28.89 69.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.662 0.268 . . . . 0.0 110.734 -178.215 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -60.31 -55.1 37.81 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -41.34 68.69 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.921 -179.484 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -56.23 -55.76 29.24 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -177.833 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -69.83 -30.85 68.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -176.747 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -75.43 -25.76 57.76 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.183 -1.007 . . . . 0.0 112.038 178.158 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mm -73.13 -39.13 56.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 174.686 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.64 85.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.043 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.68 80.68 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.472 177.45 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -57.09 -43.88 82.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.582 -179.407 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -65.2 -44.71 87.52 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 0.0 110.133 179.177 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.91 -40.06 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.711 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -66.06 -29.17 69.46 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.636 -0.665 . . . . 0.0 110.346 179.492 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t -76.07 3.71 9.91 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.637 0.375 . . . . 0.0 111.574 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.28 -0.15 59.96 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 115.138 0.815 . . . . 0.0 115.138 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -67.22 125.77 27.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.044 0.922 . . . . 0.0 109.131 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.53 124.46 8.11 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.519 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -75.8 124.52 34.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.098 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.8 mt -90.06 -41.52 13.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -177.447 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -147.82 123.34 10.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.542 -177.475 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 139.84 35.79 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 174.198 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 146.09 -31.4 1.58 Allowed Glycine 0 CA--C 1.505 -0.554 0 N-CA-C 107.408 -2.277 . . . . 0.0 107.408 179.135 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -65.72 154.5 38.78 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 175.094 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.4 p -88.76 -19.22 26.31 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.761 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -133.41 4.52 3.69 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -172.27 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.12 138.36 31.58 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 117.937 0.335 . . . . 0.0 110.567 178.687 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -140.12 132.7 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 176.624 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -109.03 135.33 50.37 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 178.602 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -129.43 137.21 50.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 124.067 0.947 . . . . 0.0 109.19 -176.655 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -101.24 137.3 39.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 176.911 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.05 106.42 7.91 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.836 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.45 -28.57 26.57 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 117.049 -1.501 . . . . 0.0 114.646 -176.362 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -78.01 -1.81 34.02 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.579 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.7 mtmt 58.28 43.31 20.38 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.1 m -64.56 -177.63 0.33 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.328 -1.76 . . . . 0.0 113.098 -178.651 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -41.43 -26.98 0.07 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 178.178 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 33.5 m80 -130.17 135.69 48.45 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.827 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -70.41 -37.7 74.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.412 0.625 . . . . 0.0 110.858 -178.64 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.9 mt -137.68 157.37 46.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.003 -177.607 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.44 137.18 53.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 176.682 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.03 135.95 49.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 173.118 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -102.1 132.88 47.71 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 179.338 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.35 115.78 12.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -179.187 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -86.8 96.37 10.17 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.881 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -147.34 128.79 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.663 0.744 . . . . 0.0 111.67 -176.606 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.13 147.25 36.68 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 125.081 1.352 . . . . 0.0 108.769 175.263 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.6 mt -143.8 118.2 9.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -177.282 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -87.43 -43.73 11.86 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 122.077 0.942 . . . . 0.0 111.467 -179.58 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -127.34 148.76 50.25 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.04 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.574 ' HD2' HD11 ' A' ' 99' ' ' ILE . 38.2 ptt180 -65.05 -16.0 62.97 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.307 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -63.05 -33.55 75.67 Favored 'General case' 0 C--O 1.216 -0.68 0 C-N-CA 119.702 -0.799 . . . . 0.0 109.675 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -77.57 -31.86 53.41 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 121.602 -0.687 . . . . 0.0 109.883 176.335 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.8 ttt -62.44 -51.84 65.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.372 178.008 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.8 m -61.07 -36.3 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-O 120.718 0.294 . . . . 0.0 111.59 179.849 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.5 -38.44 89.89 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.169 -177.147 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -59.47 -45.18 92.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.212 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.443 HG23 HG11 ' A' ' 111' ' ' VAL . 2.6 mp -73.16 -34.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.753 -0.592 . . . . 0.0 111.534 -178.318 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -59.23 -35.8 74.3 Favored 'General case' 0 C--O 1.244 0.803 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -45.64 29.99 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.657 178.825 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -55.2 -41.51 72.07 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.285 179.346 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.5 73.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 122.201 -0.312 . . . . 0.0 111.705 -178.342 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -73.16 -36.09 66.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.742 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -44.76 95.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 175.852 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.61 -36.04 72.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -60.42 -40.18 90.08 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.321 -0.862 . . . . 0.0 109.68 176.994 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -67.64 -33.64 75.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.486 178.4 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.2 t -73.87 -47.97 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 122.299 -0.251 . . . . 0.0 111.431 177.678 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -62.22 -30.36 71.03 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.618 -0.677 . . . . 0.0 111.781 -177.912 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -59.46 -45.62 91.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.632 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -73.3 -42.39 62.46 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 179.563 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.3 mp -78.35 -18.08 55.63 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 -175.256 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.34 9.25 60.68 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 116.751 1.46 . . . . 0.0 116.751 177.176 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -69.99 141.68 52.92 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.202 1.001 . . . . 0.0 109.03 -178.877 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.19 -34.73 77.0 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -174.874 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -144.37 161.86 37.92 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 101.837 -3.394 . . . . 0.0 101.837 176.545 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.3 mmm -135.69 112.54 10.22 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 123.552 0.533 . . . . 0.0 109.799 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -93.72 132.25 38.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.855 177.484 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -128.06 121.83 30.63 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.6 tp -89.52 121.61 31.9 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.469 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -112.04 113.29 25.49 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.0 t -112.76 106.27 20.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-O 121.253 0.549 . . . . 0.0 111.301 -178.724 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -74.6 152.06 39.3 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.597 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -128.48 109.01 11.01 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.436 -1.69 . . . . 0.0 106.436 172.623 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 89.2 p -131.88 164.96 24.94 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.196 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 t -77.48 -29.01 52.42 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.674 -0.641 . . . . 0.0 109.55 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -152.59 165.52 34.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 179.714 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.95 154.61 40.74 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.534 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -57.03 145.31 86.44 Favored 'Trans proline' 0 C--N 1.351 0.66 0 N-CA-C 114.829 1.05 . . . . 0.0 114.829 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.3 m -77.62 -21.37 13.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.223 0.535 . . . . 0.0 111.331 -179.693 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -90.85 99.12 12.21 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.972 179.571 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 14.72 58.8 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 176.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -68.34 -18.72 64.56 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.446 0.641 . . . . 0.0 110.486 179.044 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.74 -36.36 82.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.884 -177.467 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -37.67 74.11 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.614 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.574 HD11 ' HD2' ' A' ' 54' ' ' ARG . 5.3 mm -66.55 -39.99 85.27 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.604 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.267 -178.205 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.15 -23.92 65.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.514 0.674 . . . . 0.0 110.987 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.6 mtmt -94.9 6.16 49.83 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.773 179.295 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -118.94 95.94 5.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -176.833 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -68.34 124.97 24.97 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.515 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -85.72 107.44 17.59 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.944 0.878 . . . . 0.0 109.83 -178.501 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -99.53 123.53 43.88 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.824 -1.08 . . . . 0.0 108.662 -178.578 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -130.17 75.4 1.65 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -178.775 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.38 -112.68 3.7 Favored Glycine 0 C--O 1.223 -0.574 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -178.334 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.7 p -83.04 -20.82 34.27 Favored 'General case' 0 C--N 1.322 -0.59 0 O-C-N 122.217 -0.578 . . . . 0.0 110.367 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 53.1 t -74.92 140.62 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.9 m -130.79 112.85 13.42 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 171.081 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.443 HG11 HG23 ' A' ' 61' ' ' ILE . 54.1 t -106.29 129.65 59.26 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.504 0 O-C-N 121.527 -0.733 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.64 104.0 22.01 Favored Pre-proline 0 N--CA 1.435 -1.22 0 CA-C-N 113.995 -1.457 . . . . 0.0 108.039 178.458 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -78.24 142.91 19.48 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 116.721 -1.719 . . . . 0.0 112.13 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 153.28 38.42 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 178.05 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.6 tt -146.86 123.57 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.143 0.497 . . . . 0.0 109.766 -177.334 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 1.9 t -89.87 126.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 104.098 -2.556 . . . . 0.0 104.098 174.592 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.61 136.27 54.45 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 175.907 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -22.44 66.38 Favored Glycine 0 C--O 1.227 -0.298 0 C-N-CA 121.178 -0.534 . . . . 0.0 113.899 -176.445 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.7 p -57.35 -26.74 61.44 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -177.253 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.5 ptm -141.16 30.58 1.78 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.546 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -44.37 -42.45 6.88 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 116.417 2.006 . . . . 0.0 116.417 -171.612 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -58.56 -51.33 70.34 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.685 -0.634 . . . . 0.0 112.395 -178.366 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -75.22 -33.06 61.33 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.582 0.706 . . . . 0.0 111.334 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -72.08 -42.02 66.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.998 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 20.8 tp -64.27 -41.81 96.75 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 121.717 -0.615 . . . . 0.0 111.272 -176.734 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.63 -13.31 60.33 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.648 -178.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.317 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.0 t -91.64 -40.35 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 121.33 0.586 . . . . 0.0 110.234 179.096 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -123.02 77.21 50.86 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.602 -179.398 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.25 -13.86 38.94 Favored 'Trans proline' 0 C--N 1.348 0.543 0 N-CA-C 114.127 0.78 . . . . 0.0 114.127 -177.841 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.5 m -77.83 -7.22 56.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.719 0.295 . . . . 0.0 111.57 177.308 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -99.4 132.98 44.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.236 0.541 . . . . 0.0 110.674 -178.736 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -84.41 105.76 15.48 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.824 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 16.8 p -68.66 -26.69 65.45 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -177.744 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -73.07 -24.43 60.67 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 122.104 -0.373 . . . . 0.0 111.349 178.743 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -67.49 -30.47 70.16 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 122.083 0.944 . . . . 0.0 111.399 179.09 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 73.8 m -139.57 50.91 1.76 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.652 -174.189 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 23.1 m -64.6 159.94 20.78 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.098 0.475 . . . . 0.0 112.04 -178.746 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -61.49 -35.74 78.53 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.955 -176.193 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -65.92 -11.81 50.03 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 178.735 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -97.88 -4.82 35.82 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.711 0.767 . . . . 0.0 110.537 177.472 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -81.13 167.34 19.8 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.645 0.736 . . . . 0.0 110.79 -178.741 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 13.4 t -160.06 155.65 25.62 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 178.286 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -58.81 -37.25 75.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.783 0.801 . . . . 0.0 109.509 179.0 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -72.54 -47.12 50.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.098 179.663 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -60.67 -32.51 71.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.524 0.678 . . . . 0.0 109.417 -178.489 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.466 ' HB1' ' HB2' ' A' ' 5' ' ' GLU . . . -63.29 -44.93 93.64 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 179.192 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.76 -31.33 56.99 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.465 -179.42 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.3 mmt -65.3 -28.78 69.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.142 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.89 70.26 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.53 -0.271 . . . . 0.0 111.298 178.401 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -65.52 -51.28 61.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.48 177.694 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.11 -42.12 97.93 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.163 0.982 . . . . 0.0 108.6 -178.211 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -58.9 -40.15 83.64 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.995 178.839 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -64.91 -43.19 93.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.317 0.508 . . . . 0.0 112.063 177.152 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.7 -41.31 98.13 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.346 -179.496 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.6 t -65.86 -38.82 89.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 0.0 110.466 177.423 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.31 -45.92 92.45 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 123.103 0.561 . . . . 0.0 110.908 179.749 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 56.0 t -56.79 -50.12 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.782 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -65.07 -39.37 93.14 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.965 0.412 . . . . 0.0 110.497 -178.662 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -64.75 -33.93 77.14 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.667 -0.646 . . . . 0.0 112.502 179.927 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -59.99 -23.81 63.94 Favored 'General case' 0 C--O 1.21 -1.005 0 C-N-CA 120.26 -0.576 . . . . 0.0 111.605 179.478 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -63.76 -39.48 94.37 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 178.581 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.62 -44.73 70.07 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 177.402 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -66.79 -53.17 35.63 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -176.1 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -67.45 -27.35 66.96 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -174.342 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 17.6 ttpp -63.18 -45.8 90.1 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 175.805 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 14.7 m -72.36 -45.43 59.87 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.363 -178.679 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -66.37 -24.47 66.5 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.653 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -75.69 -14.06 60.33 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 178.167 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.47 145.14 45.91 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 174.177 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 13.2 m 32.66 64.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.97 1 N-CA-C 121.949 4.055 . . . . 0.0 121.949 170.567 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -114.4 14.81 17.98 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 121.086 -1.009 . . . . 0.0 112.236 -178.744 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 62.24 -136.86 0.48 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.911 -175.748 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -152.99 151.75 30.64 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.9 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 157.84 128.8 1.05 Allowed Glycine 0 C--O 1.226 -0.354 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 177.864 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -159.48 151.56 20.8 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 179.206 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 2.1 pp -154.79 163.29 40.48 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 176.388 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 68.7 tt0 -147.62 164.53 33.2 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 104.106 -2.553 . . . . 0.0 104.106 177.677 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.32 135.65 35.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 118.025 0.375 . . . . 0.0 110.011 -177.305 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -146.02 173.36 12.23 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 175.505 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -150.76 145.35 25.69 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 173.708 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 2.2 tt -146.59 150.86 36.31 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -177.736 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -154.31 171.99 18.39 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 -179.672 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -151.64 156.45 40.43 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 104.965 -2.235 . . . . 0.0 104.965 179.402 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 . . . . . 0 C--O 1.244 0.763 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -177.958 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 mmt . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.005 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 54.69 34.26 21.21 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 123.82 0.7 . . . . 0.0 111.242 -178.046 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pp -61.87 -32.21 72.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.577 0.703 . . . . 0.0 111.1 -177.106 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.78 -35.2 64.93 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.306 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -65.78 -29.33 69.81 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.364 0.602 . . . . 0.0 110.272 -176.924 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -62.23 -45.16 94.6 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.196 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 m -70.54 -40.31 73.5 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.302 178.867 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -55.35 -51.15 67.72 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.018 0.927 . . . . 0.0 111.082 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.664 -0.647 . . . . 0.0 111.769 178.659 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 55.6 mttt -66.71 -37.56 84.95 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.855 -0.528 . . . . 0.0 110.955 176.665 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 mm -71.19 -39.35 73.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.009 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.32 -44.58 80.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.51 -47.24 79.61 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.56 178.018 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 34.8 t60 -55.46 -45.56 76.89 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.683 0.393 . . . . 0.0 111.415 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.7 mt -70.44 -47.89 58.57 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.588 -178.839 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.85 -40.29 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-N 118.422 0.556 . . . . 0.0 109.983 175.639 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -64.17 -27.22 68.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.147 -0.346 . . . . 0.0 111.511 179.151 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 m -86.62 10.25 16.14 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 177.971 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.85 0.28 58.98 Favored Glycine 0 C--O 1.229 -0.159 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 175.602 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.408 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 26.0 m-85 -67.81 129.25 39.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.311 1.056 . . . . 0.0 109.748 178.611 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.17 109.41 2.98 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 179.318 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.8 p -70.32 129.15 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.192 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 85.9 mt -94.89 -47.11 13.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.773 -1.103 . . . . 0.0 108.358 -177.321 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -142.36 139.95 31.92 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 -177.226 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -137.52 124.4 21.3 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.111 0.414 . . . . 0.0 110.262 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.49 40.11 94.22 Favored Glycine 0 C--O 1.221 -0.707 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 178.217 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -59.49 -35.72 74.66 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 122.356 1.074 . . . . 0.0 109.213 -178.948 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.8 t -166.84 -67.68 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 101.287 -3.597 . . . . 0.0 101.287 174.922 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -138.95 15.21 2.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.792 174.984 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 45' ' ' ARG . 47.8 mt-10 -112.92 144.69 42.04 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.674 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 90.8 mt -135.36 127.78 47.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 172.71 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -110.84 133.11 53.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.068 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 mp -131.72 129.69 41.01 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.213 0.605 . . . . 0.0 109.788 -178.383 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -81.43 132.76 35.34 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.491 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.85 117.77 60.82 Favored Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 177.662 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 79.2 Cg_endo -72.6 -26.12 16.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 115.892 -2.272 . . . . 0.0 112.807 -175.899 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -72.49 -26.5 61.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.701 -179.859 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.8 mttp 59.24 41.95 19.26 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.646 1.688 . . . . 0.0 108.113 -178.83 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 96.4 p -71.09 -177.61 1.73 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 111.042 -2.799 . . . . 0.0 108.39 176.85 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.2 p -45.85 -26.63 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 176.268 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 6.6 m80 -101.51 127.19 48.31 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 174.367 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -89.8 -37.7 14.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -178.523 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.9 mt -137.36 161.61 35.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.7 t -127.29 134.53 65.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.915 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.402 HH21 ' CD ' ' A' ' 30' ' ' GLU . 31.6 ttt180 -122.46 112.99 18.72 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.176 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.79 131.12 35.2 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 175.069 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -136.36 114.67 11.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.217 0.532 . . . . 0.0 111.416 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -82.56 94.71 7.56 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 178.541 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -151.62 136.59 17.31 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.26 146.11 24.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.234 -178.729 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.26 119.35 26.14 Favored 'General case' 0 C--O 1.22 -0.45 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 -177.236 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -79.12 -43.5 23.92 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 122.661 1.219 . . . . 0.0 109.845 178.316 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -127.83 164.67 21.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.87 -178.592 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -64.21 -15.82 60.75 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.579 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -62.4 -41.37 98.62 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.6 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -66.59 -39.37 88.39 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.7 ttm -63.11 -51.85 64.93 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.396 -178.878 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.87 -31.85 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.641 0.655 . . . . 0.0 112.585 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -68.51 -35.03 76.92 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.667 -178.138 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.72 -41.73 91.5 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.297 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -67.12 -30.88 50.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.077 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -58.45 -40.06 81.58 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.097 179.529 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -76.63 -43.91 36.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.423 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.45 -36.52 69.13 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.934 -178.536 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.478 ' HA ' HG11 ' A' ' 109' ' ' VAL . . . -64.17 -40.43 96.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 O-C-N 121.938 -0.476 . . . . 0.0 111.102 179.463 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -76.02 -29.68 58.21 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.313 -0.867 . . . . 0.0 109.638 178.385 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -60.7 -41.48 95.26 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 173.62 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.456 HG11 HG13 ' A' ' 109' ' ' VAL . 45.9 t -64.83 -39.67 86.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.05 177.275 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -54.56 -37.95 66.06 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.779 0.718 . . . . 0.0 111.69 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -61.68 -48.08 82.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.996 179.579 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.3 t -70.63 -41.41 77.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.564 0.697 . . . . 0.0 110.943 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -41.67 93.54 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.971 -0.456 . . . . 0.0 109.942 179.719 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -64.59 -45.82 85.33 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.106 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -58.64 -42.28 87.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.433 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.75 -3.69 58.02 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -179.489 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.68 20.1 67.83 Favored Glycine 0 C--O 1.242 0.615 0 C-N-CA 121.508 -0.377 . . . . 0.0 113.654 179.656 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -73.04 147.84 44.69 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.825 -0.809 . . . . 0.0 110.944 -176.709 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -69.45 -37.52 77.37 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.47 159.62 39.94 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 171.569 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.9 ttp -134.15 147.19 50.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.745 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 110' ' ' SER . 83.6 tttt -116.0 136.67 52.81 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 179.482 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.4 tp -119.81 134.0 55.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 123.056 0.543 . . . . 0.0 110.699 178.448 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.78 109.85 22.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.066 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -97.71 127.34 43.59 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.053 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.9 t -122.08 109.31 24.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.177 0.513 . . . . 0.0 110.937 179.055 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -81.24 151.83 27.94 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 176.489 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -127.29 107.63 10.16 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 103.61 -2.737 . . . . 0.0 103.61 171.658 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.3 m -127.17 158.65 36.53 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.683 0.614 . . . . 0.0 110.896 -174.039 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.5 m -67.06 -45.21 78.07 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -177.434 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -146.81 176.74 9.65 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.711 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.19 143.39 29.6 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.395 -0.821 . . . . 0.0 108.874 -176.119 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.71 147.06 73.81 Favored 'Trans proline' 0 C--N 1.35 0.622 0 N-CA-C 114.93 1.088 . . . . 0.0 114.93 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 26.9 m -81.17 -10.23 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 N-CA-C 114.525 1.305 . . . . 0.0 114.525 -177.092 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -112.67 95.77 5.61 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 119.339 -0.362 . . . . 0.0 111.559 -178.378 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.9 t0 14.83 67.33 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 176.978 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 56.6 p-90 -83.99 -13.99 51.9 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.195 179.424 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -66.65 -31.48 72.19 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.119 -0.988 . . . . 0.0 111.905 -175.21 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -65.31 -21.74 66.75 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.958 175.615 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.502 HG22 ' HG3' ' A' ' 113' ' ' PRO . 15.5 mm -72.7 -40.48 61.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.3 -5.03 33.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.983 179.22 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -111.35 3.14 18.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.797 -179.383 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -126.74 128.42 46.62 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.88 0.847 . . . . 0.0 112.142 179.068 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 26.5 m -78.46 126.79 31.26 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 176.819 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -82.64 111.44 18.61 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 177.016 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -118.17 120.99 39.39 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.461 0.648 . . . . 0.0 109.76 -178.392 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -116.69 75.31 0.96 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 178.38 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.31 -112.7 4.85 Favored Glycine 0 C--O 1.225 -0.466 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.774 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.0 p -81.96 24.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.561 0.744 . . . . 0.0 112.173 -178.662 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.478 HG11 ' HA ' ' A' ' 65' ' ' ALA . 86.2 t -134.83 140.63 45.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.264 -178.957 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.404 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 33.8 t -130.62 126.49 36.78 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 175.67 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.9 t -136.7 136.42 48.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 176.802 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -125.56 131.33 24.01 Favored Pre-proline 0 C--N 1.317 -0.841 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 175.865 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.502 ' HG3' HG22 ' A' ' 99' ' ' ILE . 47.9 Cg_endo -84.56 154.73 12.05 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 CA-C-O 122.101 0.792 . . . . 0.0 113.774 -177.61 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.78 150.73 39.0 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 174.438 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.7 tt -146.42 124.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -176.774 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 52.1 t -97.44 115.95 38.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 175.057 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.35 138.17 39.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.061 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.86 -25.88 53.48 Favored Glycine 0 C--O 1.223 -0.591 0 N-CA-C 114.728 0.651 . . . . 0.0 114.728 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.7 p -59.66 -27.2 66.17 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.545 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.8 ptm -143.07 18.42 1.94 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.925 0.869 . . . . 0.0 109.906 -177.831 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tt -42.08 -42.41 2.91 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 118.418 2.747 . . . . 0.0 118.418 -170.613 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -60.79 -51.54 68.91 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 119.562 -0.855 . . . . 0.0 112.278 -174.078 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -78.54 -33.27 48.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 176.301 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -58.86 -32.15 69.18 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.432 1.111 . . . . 0.0 110.818 -178.829 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.63 -36.35 73.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.953 -1.021 . . . . 0.0 113.178 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -75.33 -15.0 60.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -176.269 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.55 -28.56 62.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.163 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 22.7 t -95.56 -41.63 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.858 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -126.22 80.19 68.89 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.33 -178.908 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -67.55 -14.53 42.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 118.08 -0.813 . . . . 0.0 112.774 179.752 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.2 m -75.72 -5.71 46.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.923 176.461 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -99.48 135.5 40.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.706 0.765 . . . . 0.0 110.575 -179.022 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 -69.3 119.78 14.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.344 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 36.7 p -70.36 -20.41 62.97 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.767 -0.583 . . . . 0.0 110.856 178.66 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -81.01 -10.77 59.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.705 0.288 . . . . 0.0 111.226 176.665 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -84.59 -24.62 29.1 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.079 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 14.1 t -87.98 125.46 34.54 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.743 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.7 t -144.32 132.32 21.55 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -176.635 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -68.2 -32.63 73.0 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.551 0.691 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -62.14 -17.26 57.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.634 -179.188 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -117.13 10.93 14.01 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.214 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -95.08 67.86 3.09 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.948 0.88 . . . . 0.0 110.574 -177.505 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 83.3 p -125.06 171.95 9.85 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.886 -178.569 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -66.72 -39.77 88.12 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-O 120.959 0.409 . . . . 0.0 111.703 -177.654 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 145' ' ' GLU . . . . . 0.563 ' CD ' ' H ' ' A' ' 145' ' ' GLU . 2.0 mp0 -63.02 -39.93 96.23 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.85 0.833 . . . . 0.0 108.801 -179.597 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -71.74 -35.1 70.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.655 178.566 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.49 90.69 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.404 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -62.73 -51.08 68.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 21.5 ptp -65.33 -28.84 69.59 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.353 179.419 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.05 -37.37 85.68 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.456 -0.778 . . . . 0.0 110.034 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 44.5 ttt180 -65.64 -45.86 81.39 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.595 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -65.01 -40.31 94.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.843 0.83 . . . . 0.0 110.316 -178.821 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -64.71 -40.0 94.62 Favored 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.872 178.491 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.34 -41.22 98.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.83 0.348 . . . . 0.0 111.639 176.568 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.8 mt -65.17 -33.13 75.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.043 0.449 . . . . 0.0 109.823 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.05 -34.81 61.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.624 0.726 . . . . 0.0 110.571 175.086 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -65.06 -44.15 89.92 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.639 -178.624 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.7 p -62.16 -36.78 76.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.014 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.24 -50.67 64.92 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.024 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -60.36 -30.13 69.35 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.864 -0.734 . . . . 0.0 112.489 -178.577 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -56.97 -28.57 62.42 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -179.615 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -66.95 -38.1 85.52 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -179.165 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -69.46 -38.49 77.79 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 176.722 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -59.58 -44.11 93.45 Favored 'General case' 0 C--O 1.212 -0.895 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.804 177.695 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -68.95 -34.39 75.27 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.395 0.516 . . . . 0.0 112.395 -178.189 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.25 -37.32 86.88 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.296 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 22.9 m -72.3 -38.77 68.65 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.269 0.557 . . . . 0.0 110.597 178.402 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -58.59 -25.41 62.58 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.708 1.203 . . . . 0.0 112.529 -179.276 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.34 -14.12 54.43 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 178.105 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -123.22 -39.73 2.45 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 179.344 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 12.1 m -90.91 154.05 3.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 122.649 1.214 . . . . 0.0 114.099 -172.798 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -142.94 164.09 31.01 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 175.854 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -135.47 -16.13 1.84 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 53.9 m-20 53.44 -137.12 1.26 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.127 0.571 . . . . 0.0 109.882 -178.387 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 86.76 179.34 49.09 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 121.205 -0.521 . . . . 0.0 112.152 179.408 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -156.55 136.75 12.85 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 -178.792 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 60.4 tp -153.0 141.67 20.96 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 105.526 -2.028 . . . . 0.0 105.526 176.513 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -161.04 168.34 24.65 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 178.61 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 1.2 ttm105 -154.0 152.89 31.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 179.101 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -139.19 145.99 40.0 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 103.517 -2.772 . . . . 0.0 103.517 175.974 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 52.8 t-20 -151.59 107.29 3.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.952 0.342 . . . . 0.0 111.693 -179.318 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 29.6 tp -133.72 144.51 49.16 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 177.368 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 12.1 p90 -151.34 161.85 41.97 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -174.853 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -132.28 33.43 3.86 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -178.239 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 . . . . . 0 C--O 1.247 0.97 0 CA-C-N 113.903 -1.499 . . . . 0.0 109.254 -174.784 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.0 mtp . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -59.56 -37.53 78.71 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 -171.801 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.77 -45.41 86.47 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.212 -0.93 . . . . 0.0 108.797 179.441 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.25 -35.3 80.61 Favored 'General case' 0 C--O 1.208 -1.084 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.277 178.507 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -65.14 -42.21 94.03 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 178.575 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 177.484 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -59.12 -43.69 91.97 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.613 -178.216 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -57.26 -52.31 65.84 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 123.073 0.549 . . . . 0.0 110.363 179.906 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -69.3 -33.32 73.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.979 -179.268 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.69 -31.48 69.55 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.683 -0.636 . . . . 0.0 111.018 178.803 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.8 mm -77.06 -39.2 28.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.18 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.1 80.94 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.746 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.09 -45.85 86.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.915 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.95 -47.45 77.57 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.454 0.302 . . . . 0.0 110.623 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 34.4 mt -67.1 -51.03 59.29 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -178.64 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.2 t -57.33 -42.71 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.979 178.886 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -19.09 65.7 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.351 -0.843 . . . . 0.0 111.814 -179.642 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.4 t -87.53 8.1 26.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.021 0.439 . . . . 0.0 111.046 177.876 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.59 1.24 56.53 Favored Glycine 0 C--O 1.228 -0.266 0 N-CA-C 116.033 1.173 . . . . 0.0 116.033 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.463 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 38.3 m-85 -71.9 110.52 6.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 118.046 0.923 . . . . 0.0 109.018 178.215 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.41 134.48 30.89 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.945 -177.454 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -75.79 125.81 35.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.717 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.437 HD11 HD22 ' A' ' 43' ' ' LEU . 45.3 mt -92.22 -43.83 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.014 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -153.41 127.55 9.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.793 175.661 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.21 129.65 24.06 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 174.352 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 158.95 -31.97 0.46 Allowed Glycine 0 CA--C 1.506 -0.493 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 176.206 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -66.22 147.51 53.22 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.599 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.4 m -82.08 -11.87 58.55 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.136 -0.353 . . . . 0.0 111.428 -178.635 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -108.17 -39.38 5.5 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 -173.704 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -136.39 146.97 47.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 178.839 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 83.6 mt -134.92 134.23 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.681 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -110.41 135.57 50.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.0 0.429 . . . . 0.0 111.45 -179.229 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 4.1 mp -132.37 143.02 49.55 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.105 0.962 . . . . 0.0 109.226 -177.58 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -102.47 135.56 43.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.76 115.62 39.73 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.976 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 93.9 Cg_endo -73.56 -24.43 16.09 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 117.373 -1.285 . . . . 0.0 112.547 -177.509 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -76.28 -24.45 54.43 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.971 178.78 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.69 42.72 6.09 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -178.378 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 m -59.87 -177.52 0.06 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 112.559 -2.11 . . . . 0.0 115.078 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.4 m -52.98 -28.84 25.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.652 173.603 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.436 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 14.4 p-80 -100.53 140.48 34.74 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 172.101 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -97.42 -43.83 7.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.032 0.444 . . . . 0.0 111.761 -172.818 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.437 HD22 HD11 ' A' ' 23' ' ' ILE . 51.1 mt -130.5 158.1 40.86 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.959 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.8 t -127.6 136.63 59.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 177.777 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.48 134.26 35.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.871 0.843 . . . . 0.0 109.371 173.032 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -97.55 137.06 37.05 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -178.937 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -136.01 108.81 7.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -175.381 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.22 94.78 6.12 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 179.505 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -151.52 118.88 5.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.342 0.592 . . . . 0.0 111.657 -175.555 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -87.16 151.48 23.15 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.47 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.3 mt -141.19 143.53 34.25 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.856 -172.788 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -98.11 -39.46 8.89 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.102 0.477 . . . . 0.0 110.356 176.628 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -133.77 151.09 51.49 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -176.835 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.411 ' H ' ' HB3' ' A' ' 94' ' ' ASP . 9.3 ptt180 -64.48 -21.13 66.57 Favored 'General case' 0 C--O 1.212 -0.908 0 O-C-N 121.528 -0.733 . . . . 0.0 112.535 179.937 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.15 -33.05 72.78 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.914 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -72.49 -45.51 59.12 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.517 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.0 ttt -55.0 -49.03 72.5 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.591 -178.584 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.6 m -65.06 -35.25 75.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.758 178.529 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -71.13 -32.99 69.66 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.214 -177.106 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.4 -38.02 76.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 175.897 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.1 mm -71.58 -30.91 40.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.745 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.89 -40.18 87.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.873 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -74.55 -42.7 58.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 178.816 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.22 -43.71 87.82 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.012 -0.43 . . . . 0.0 110.683 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.7 -40.27 84.32 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.633 -178.529 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -64.17 -49.37 72.33 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.294 -0.563 . . . . 0.0 109.59 177.883 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -40.61 95.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.89 -33.33 43.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.675 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -66.74 -38.23 86.24 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -60.32 -43.83 96.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.092 -176.398 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.23 -35.82 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.626 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -30.31 66.51 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.888 -1.133 . . . . 0.0 113.552 -178.542 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -58.18 -31.75 67.59 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.554 179.494 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -20.47 65.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.705 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.01 9.37 34.47 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.927 0.394 . . . . 0.0 110.195 177.503 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.79 29.19 71.56 Favored Glycine 0 C--O 1.236 0.24 0 N-CA-C 115.754 1.062 . . . . 0.0 115.754 175.81 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 38.2 ttt85 -69.89 128.29 35.87 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 121.728 -0.866 . . . . 0.0 108.678 -178.819 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.73 -36.16 82.95 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.326 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.22 149.17 29.82 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 176.932 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -120.66 147.98 44.53 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.66 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -134.96 117.47 15.83 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.257 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 tp -112.89 128.31 56.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.13 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -94.26 104.1 16.11 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 174.232 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -101.85 128.48 48.2 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.319 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.6 t -123.48 109.38 23.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.316 176.551 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -72.9 141.91 47.88 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 175.247 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -118.27 103.75 10.12 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 174.261 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 83.5 p -123.07 158.74 29.97 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.991 0.424 . . . . 0.0 110.557 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -75.94 -28.87 58.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 121.482 -0.761 . . . . 0.0 108.999 -179.335 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -155.32 166.61 33.01 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 177.247 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.18 150.31 43.0 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 110.507 -0.183 . . . . 0.0 110.507 -176.008 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.87 145.23 85.49 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 118.03 -0.847 . . . . 0.0 112.046 177.614 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 m -76.25 -19.74 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -172.56 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.411 ' HB3' ' H ' ' A' ' 54' ' ' ARG . 43.7 t0 -84.31 87.43 7.2 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-O 119.484 -0.293 . . . . 0.0 111.333 -177.526 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 27.56 48.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 118.041 2.608 . . . . 0.0 118.041 176.221 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 34.1 p-90 -62.06 -20.21 63.74 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.03 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -61.03 -31.23 70.86 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.841 -0.537 . . . . 0.0 110.356 -179.253 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -60.03 -35.19 74.56 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.744 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.7 mm -72.45 -43.52 63.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.94 -176.06 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.33 64.52 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.755 -0.591 . . . . 0.0 112.244 -178.525 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -101.92 17.06 24.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -131.02 104.25 7.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.601 -176.507 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.0 m -68.25 125.9 27.87 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.355 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -82.71 127.79 33.75 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 179.255 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -126.03 133.06 51.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.795 0.807 . . . . 0.0 111.311 179.351 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -142.26 111.47 6.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.441 -1.254 . . . . 0.0 108.08 178.354 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.75 -115.94 8.26 Favored Glycine 0 C--N 1.322 -0.195 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.091 179.102 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 60.7 p -87.46 -12.61 45.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.442 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.6 t -94.1 141.33 15.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -174.163 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.3 m -120.76 138.45 54.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 167.234 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 25.2 t -132.39 134.03 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -96.09 114.48 64.28 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 176.818 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -84.28 59.63 5.97 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 121.987 1.792 . . . . 0.0 114.209 -177.555 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.33 153.01 44.27 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.88 -178.328 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.7 tt -147.46 135.43 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.0 m -112.18 132.72 60.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.2 141.17 50.16 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -176.307 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.1 -26.44 55.82 Favored Glycine 0 C--O 1.227 -0.283 0 N-CA-C 114.808 0.683 . . . . 0.0 114.808 -176.559 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.0 p -55.3 -29.6 58.54 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -179.345 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.7 ptm -141.63 26.49 1.93 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.348 0.594 . . . . 0.0 110.298 -178.025 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 12.1 tp -45.35 -37.75 5.2 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 119.328 3.084 . . . . 0.0 119.328 -169.301 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -65.98 -43.37 88.01 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.301 0.955 . . . . 0.0 110.778 -179.235 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -73.7 -36.0 65.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 122.218 1.009 . . . . 0.0 109.495 178.562 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -62.81 -42.72 99.84 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 11.2 mt -62.13 -43.93 97.76 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -75.07 -15.24 60.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.355 -177.311 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.61 -40.85 48.13 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.232 -0.292 . . . . 0.0 110.716 178.123 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 128' ' ' VAL . . . . . 0.422 HG13 ' CD2' ' A' ' 129' ' ' PHE . 12.2 p -92.25 -32.91 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 120.995 0.426 . . . . 0.0 111.252 179.975 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 129' ' ' PHE . . . . . 0.422 ' CD2' HG13 ' A' ' 128' ' ' VAL . 38.5 m-85 -127.24 80.67 71.29 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.396 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -65.5 -11.84 32.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 N-CA-C 114.694 0.998 . . . . 0.0 114.694 -177.704 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.9 m -77.97 -2.85 38.97 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.123 -0.361 . . . . 0.0 111.666 176.332 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -77.0 127.43 32.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.596 0.712 . . . . 0.0 111.85 -179.1 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 59.9 mtt180 -88.7 97.1 10.94 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.701 178.795 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.5 t -80.09 -16.6 54.66 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.25 178.193 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -73.92 -36.17 64.67 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 179.155 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -59.21 -29.67 67.67 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -177.792 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 65.0 m 62.04 176.81 0.13 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.962 0.905 . . . . 0.0 111.513 -176.219 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 66.9 m -154.6 173.9 15.71 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.207 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.4 -18.63 18.72 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 179.774 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -58.78 -23.53 60.34 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.854 0.359 . . . . 0.0 111.933 177.572 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 -81.04 -7.31 59.53 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.731 0.3 . . . . 0.0 111.161 -179.06 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -101.52 -52.96 3.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.112 -179.334 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 63.0 m -151.01 150.19 30.47 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 121.695 0.76 . . . . 0.0 112.583 179.401 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -66.64 -28.76 68.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.829 178.978 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -62.01 -26.34 68.18 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.379 0.609 . . . . 0.0 111.786 -177.723 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -56.91 -22.54 38.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.751 178.253 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -32.49 57.53 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.96 -0.463 . . . . 0.0 111.759 178.43 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -62.99 -41.05 99.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.635 0.731 . . . . 0.0 109.41 177.959 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtp -70.84 -29.01 65.03 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.567 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.36 -40.42 95.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.164 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.2 ttt180 -63.43 -46.63 85.45 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.94 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -59.43 -42.7 92.47 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.301 0.572 . . . . 0.0 110.317 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -58.73 -44.68 90.52 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.951 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -65.9 -46.2 79.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 179.171 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.7 -41.51 86.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.219 0.533 . . . . 0.0 109.667 -178.156 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.7 m -69.76 -35.73 75.18 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.418 178.585 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.7 tt -65.47 -39.44 91.97 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -177.126 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 88.7 t -53.68 -54.01 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.586 0.63 . . . . 0.0 112.696 -174.715 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.88 -38.7 64.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.342 0.592 . . . . 0.0 109.833 -179.555 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -58.8 -29.76 67.09 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.577 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -55.07 -30.49 59.75 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.49 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -65.48 -38.44 89.79 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 120.992 0.425 . . . . 0.0 110.76 -179.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -77.04 -34.39 57.26 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.639 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -61.63 -43.45 98.83 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.994 -0.441 . . . . 0.0 110.426 179.508 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -71.63 -23.15 61.65 Favored 'General case' 0 C--O 1.217 -0.614 0 O-C-N 121.923 -0.485 . . . . 0.0 111.299 177.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.7 -21.41 62.57 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 121.435 0.636 . . . . 0.0 111.406 178.649 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -63.46 -9.86 14.74 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 175.75 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -47.23 -29.79 2.61 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.883 2.179 . . . . 0.0 116.883 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.24 -22.81 67.08 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.102 0.477 . . . . 0.0 111.872 178.242 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -86.73 96.94 10.33 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.63 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 4.8 t -64.85 99.92 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.302 -178.932 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -152.78 170.26 20.74 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -176.873 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -154.9 -34.01 0.1 Allowed 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.076 178.229 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 21.6 t30 61.78 20.32 11.3 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.71 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 76.73 -158.24 48.36 Favored Glycine 0 C--O 1.223 -0.551 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.043 179.185 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -152.16 -29.51 0.16 Allowed 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.593 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 63.33 5.93 2.23 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 179.175 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -62.78 128.5 36.23 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.57 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.6 ttp85 -158.69 89.58 0.96 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -176.908 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -142.34 154.93 45.09 Favored 'General case' 0 C--N 1.32 -0.676 0 O-C-N 122.028 -0.42 . . . . 0.0 111.269 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -169.79 125.46 0.83 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 177.219 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 26.3 tp -156.76 152.47 27.01 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.341 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -160.52 169.85 22.14 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 179.727 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -137.18 150.19 47.75 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 177.177 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 . . . . . 0 C--O 1.245 0.818 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 -178.881 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.488 ' H2 ' ' HB3' ' A' ' 147' ' ' ALA . 94.9 mmm . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 119.515 -0.279 . . . . 0.0 111.421 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -78.08 151.19 33.55 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.033 0.833 . . . . 0.0 108.893 179.934 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.8 tt -65.89 -36.47 83.5 Favored 'General case' 0 C--O 1.218 -0.573 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 175.019 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.79 -35.3 80.31 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.315 179.255 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.14 -32.15 70.75 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.149 0.5 . . . . 0.0 109.793 -179.817 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.78 -54.47 38.54 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.6 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.8 m -64.17 -38.13 89.96 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.196 0.522 . . . . 0.0 111.381 -179.646 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -56.23 -52.98 62.47 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.46 0.704 . . . . 0.0 110.538 178.234 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -70.72 -28.09 64.46 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.211 -0.931 . . . . 0.0 111.744 179.094 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -65.26 -43.43 91.33 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 176.557 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.403 HD11 HD11 ' A' ' 125' ' ' LEU . 18.0 mm -69.28 -38.55 77.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.835 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 -45.18 80.08 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.15 -42.5 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.954 0.407 . . . . 0.0 111.382 178.98 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -60.15 -46.81 88.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.399 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 mt -65.1 -53.52 44.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.86 0.362 . . . . 0.0 111.132 -179.911 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.6 t -59.41 -43.57 90.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.465 -175.226 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -14.2 62.71 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.513 -0.742 . . . . 0.0 112.592 -179.385 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.9 m -89.71 1.49 56.0 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 177.914 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.05 -3.0 27.04 Favored Glycine 0 C--O 1.224 -0.48 0 N-CA-C 115.588 0.995 . . . . 0.0 115.588 176.806 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -67.35 118.33 10.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 118.284 1.042 . . . . 0.0 109.427 178.571 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.64 133.95 14.52 Favored Glycine 0 C--O 1.226 -0.403 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -177.727 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.4 t -77.1 132.62 32.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.34 0.591 . . . . 0.0 110.154 179.457 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 53.7 mt -105.5 -48.51 9.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 174.436 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -141.64 116.2 9.63 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.09 129.03 23.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 118.25 0.477 . . . . 0.0 111.597 178.19 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 125.97 -17.62 6.72 Favored Glycine 0 CA--C 1.51 -0.25 0 C-N-CA 121.12 -0.562 . . . . 0.0 112.645 176.778 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -22.16 63.59 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.69 0.396 . . . . 0.0 111.394 -179.647 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.8 m 72.78 -28.94 0.19 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.526 1.53 . . . . 0.0 114.595 176.223 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -80.69 -53.01 6.9 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 172.822 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -116.66 151.9 35.36 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.365 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.8 mt -137.62 126.48 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 104.597 -2.372 . . . . 0.0 104.597 165.082 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -108.09 125.48 51.63 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.427 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.71 135.24 54.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.821 -177.874 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -84.88 132.95 34.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 175.238 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.11 124.95 91.87 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.259 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -74.52 -23.67 14.68 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 116.591 -1.806 . . . . 0.0 112.486 -179.79 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -67.96 -37.24 81.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.792 -178.633 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.7 mttt 59.07 28.13 17.3 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 123.548 1.642 . . . . 0.0 109.858 -176.073 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -77.38 -173.13 2.75 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 110.871 -2.877 . . . . 0.0 108.5 173.802 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.48 -28.84 0.14 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 117.418 2.377 . . . . 0.0 117.418 -174.576 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.553 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 11.6 p80 -107.69 131.54 54.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.004 1.275 . . . . 0.0 108.709 169.871 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -87.12 -39.79 15.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.837 -1.529 . . . . 0.0 111.582 -172.267 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.3 mt -135.37 164.08 28.58 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.333 -178.6 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 96.6 t -128.68 136.76 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 175.678 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -120.95 116.48 25.19 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.002 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -93.68 130.08 39.76 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 175.459 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -136.2 124.39 23.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -174.92 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.87 94.87 5.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.213 0.53 . . . . 0.0 110.076 -179.315 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -144.16 141.64 30.07 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.561 -0.904 . . . . 0.0 108.561 178.188 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -99.17 137.0 38.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 -177.939 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.84 145.59 47.92 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 -174.903 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -107.36 -39.69 5.59 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.172 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -122.47 161.26 23.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.878 179.411 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -66.19 -15.47 63.17 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.095 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.74 -43.15 94.38 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.53 -46.8 88.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.367 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.424 ' O ' HD12 ' A' ' 61' ' ' ILE . 81.0 mtp -56.64 -51.96 66.7 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.34 -179.426 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.9 m -67.08 -31.84 55.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.325 -175.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.0 mtt-85 -67.53 -43.77 79.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.478 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -58.37 -45.22 88.67 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.602 -179.378 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.424 HD12 ' O ' ' A' ' 57' ' ' MET . 2.5 mt -74.12 -34.2 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.313 -0.867 . . . . 0.0 112.067 -177.446 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.33 -37.68 72.92 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 177.321 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -76.62 -46.22 26.91 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.925 179.219 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.428 ' O ' HG23 ' A' ' 68' ' ' VAL . 50.7 mt-30 -55.29 -43.8 75.12 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.244 -178.557 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.72 -39.68 81.53 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.382 0.537 . . . . 0.0 111.312 -177.518 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.411 ' HB3' HH21 ' A' ' 70' ' ' ARG . 26.1 mt-10 -73.42 -30.23 63.1 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 121.436 -0.79 . . . . 0.0 111.094 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -40.03 78.55 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 174.918 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 64' ' ' GLN . 73.0 t -65.9 -36.45 77.54 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.731 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -54.35 -38.72 66.4 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.902 0.774 . . . . 0.0 111.69 178.726 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.411 HH21 ' HB3' ' A' ' 66' ' ' GLU . 6.8 mmt180 -67.31 -43.27 82.1 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.847 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.76 -42.89 90.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.78 -44.34 86.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 123.101 0.56 . . . . 0.0 109.999 178.573 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -65.61 -42.22 91.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.656 0.265 . . . . 0.0 110.467 179.605 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -62.54 -40.59 97.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 0.0 111.161 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.94 0.97 41.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -179.929 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.31 22.59 71.17 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 114.24 0.456 . . . . 0.0 114.24 178.761 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -76.68 140.25 40.82 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.972 -0.722 . . . . 0.0 110.8 -176.931 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.64 -35.72 62.88 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 178.869 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -150.65 162.37 40.79 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 102.631 -3.1 . . . . 0.0 102.631 176.399 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.6 mtp -137.31 152.93 50.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.496 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.553 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 7.0 tttp -129.75 133.7 47.17 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 176.588 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.23 125.44 34.88 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.387 0.43 . . . . 0.0 110.588 -174.571 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.8 tp -88.04 107.81 18.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 176.601 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -101.96 128.65 48.28 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.3 t -121.31 110.0 26.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 117.945 0.338 . . . . 0.0 111.232 178.443 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -75.04 149.41 39.22 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.785 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -128.79 103.67 7.19 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 174.351 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 88.8 p -130.24 150.57 51.43 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.84 0.352 . . . . 0.0 111.823 -175.946 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -67.08 -29.36 69.11 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -178.083 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -138.61 167.4 22.02 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 -178.099 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.13 144.02 27.37 Favored Pre-proline 0 C--N 1.318 -0.787 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 177.609 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.47 149.47 66.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 114.802 1.039 . . . . 0.0 114.802 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 15.1 m -76.64 -15.34 14.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 117.209 2.3 . . . . 0.0 117.209 -174.71 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -123.73 98.31 5.76 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -176.857 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.4 t0 38.07 50.02 1.3 Allowed 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 170.924 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' TRP . . . . . 0.427 ' HA ' HG12 ' A' ' 99' ' ' ILE . 53.0 p-90 -80.03 -14.39 58.59 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 176.849 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -66.84 -31.79 72.63 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 121.489 -0.757 . . . . 0.0 110.625 -177.439 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.12 -20.66 66.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 109.99 173.951 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.427 HG12 ' HA ' ' A' ' 96' ' ' TRP . 12.3 mm -79.27 -45.52 23.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.897 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 -179.299 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.03 -24.42 67.48 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.74 0.781 . . . . 0.0 110.184 178.09 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -77.6 -16.11 58.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.373 -179.29 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -113.1 126.58 55.62 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -176.039 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 46.5 m -70.44 126.41 29.57 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 103.496 -2.779 . . . . 0.0 103.496 171.545 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -82.82 119.31 24.21 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.012 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -121.73 122.68 40.1 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.912 0.863 . . . . 0.0 109.51 178.913 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -143.79 129.25 19.01 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.81 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.11 -127.0 32.21 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 107.899 -2.08 . . . . 0.0 107.899 -176.962 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -104.46 7.89 35.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.171 0.51 . . . . 0.0 110.228 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.9 t -97.72 147.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -176.088 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 m -125.22 138.78 54.12 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 171.196 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.1 t -137.29 134.61 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -99.63 114.27 65.51 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.769 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -81.52 77.18 4.04 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.515 2.143 . . . . 0.0 114.644 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -86.15 155.25 20.83 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 115' ' ' ILE . . . . . 0.411 HG21 ' CZ3' ' A' ' 96' ' ' TRP . 11.6 tt -147.83 146.16 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -176.617 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 72.7 t -114.48 118.16 57.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.85 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -73.4 143.27 46.84 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.01 175.42 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.42 -41.96 8.14 Favored Glycine 0 C--O 1.223 -0.548 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 169.666 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.9 t -57.74 -23.9 54.33 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -178.278 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.8 ptm -139.94 40.35 1.98 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 122.151 0.977 . . . . 0.0 109.721 177.759 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.79 -45.79 59.41 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -172.615 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 23.3 mtm105 -57.06 -51.31 69.8 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.967 0.803 . . . . 0.0 111.686 -178.301 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -73.79 -35.22 64.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.551 -175.8 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.7 -38.23 54.75 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -178.5 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.403 HD11 HD11 ' A' ' 11' ' ' ILE . 3.2 tm? -63.35 -41.98 98.89 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.745 -0.597 . . . . 0.0 110.964 -177.381 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -69.72 -13.38 62.26 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.235 -177.961 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.42 49.94 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.684 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -93.01 -36.57 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 120.872 0.367 . . . . 0.0 110.373 179.383 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -127.83 75.67 77.94 Favored Pre-proline 0 C--N 1.326 -0.434 0 O-C-N 122.149 -0.344 . . . . 0.0 111.246 178.229 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 -15.04 42.14 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-O 121.276 0.448 . . . . 0.0 112.953 178.881 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.5 m -79.99 -7.14 58.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 178.771 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -75.87 132.91 40.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.451 0.643 . . . . 0.0 110.72 -179.461 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -77.06 95.58 4.23 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 175.353 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 23.8 p -62.71 -25.4 68.15 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.727 0.299 . . . . 0.0 110.907 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -62.42 -14.61 42.51 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.138 0.975 . . . . 0.0 112.544 177.711 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -71.2 -6.13 37.2 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.811 -0.556 . . . . 0.0 110.642 178.869 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.8 p -154.24 -179.87 8.32 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 122.711 0.404 . . . . 0.0 109.976 -178.958 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 2.3 p -146.56 156.24 43.09 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 103.324 -2.843 . . . . 0.0 103.324 173.635 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -68.29 -32.41 72.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.377 0.608 . . . . 0.0 110.921 -176.054 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.8 mp0 -68.02 -33.12 74.0 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.694 0.759 . . . . 0.0 109.696 179.028 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -83.54 -3.42 57.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.935 -178.221 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -78.03 38.18 0.27 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.504 0.669 . . . . 0.0 112.094 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 75.1 m -67.48 157.13 34.98 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.24 0.543 . . . . 0.0 110.676 -179.157 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -55.35 -33.38 63.34 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -177.082 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -72.61 -39.47 67.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.666 0.746 . . . . 0.0 111.176 178.945 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -66.25 -24.41 66.58 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.024 -0.423 . . . . 0.0 110.972 -176.836 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.488 ' HB3' ' H2 ' ' A' ' 1' ' ' MET . . . -59.88 -37.62 79.87 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.71 0.29 . . . . 0.0 110.682 175.304 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.5 -42.29 68.23 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.527 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 23.9 mmt -60.28 -33.8 72.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 0.0 110.137 178.424 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.69 -38.64 87.18 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.056 -0.403 . . . . 0.0 110.328 178.003 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.25 -43.89 85.23 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.023 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.05 -41.59 97.33 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.2 0.524 . . . . 0.0 109.886 -178.517 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -63.01 -42.31 99.78 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.881 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -62.15 -41.53 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.168 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.0 mt -63.58 -37.68 88.25 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.098 0.475 . . . . 0.0 110.034 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.9 m -69.83 -35.16 74.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.695 0.76 . . . . 0.0 110.505 176.146 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.85 -47.32 69.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.621 -178.728 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.1 p -64.99 -40.3 88.6 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.639 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.226 -178.623 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.64 -39.34 90.99 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.913 -179.418 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -65.47 -40.91 93.74 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 121.705 -0.622 . . . . 0.0 110.338 176.225 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -59.59 -28.36 67.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.021 -179.38 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -61.19 -36.04 78.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.115 0.483 . . . . 0.0 110.397 -178.813 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 43.5 tp10 -68.37 -34.04 75.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.402 0.62 . . . . 0.0 109.693 178.062 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -70.83 -49.76 42.83 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 121.948 -0.47 . . . . 0.0 111.715 178.711 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.61 -17.64 62.27 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -174.421 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -60.41 -17.96 47.58 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 118.763 0.71 . . . . 0.0 111.566 -179.617 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 68.5 p -70.29 -14.09 62.44 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 178.917 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -63.82 -24.37 67.72 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.95 -0.469 . . . . 0.0 111.077 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -68.76 -14.37 62.98 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 178.827 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -108.72 13.42 25.08 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -176.775 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.48 141.9 17.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 122.202 1.001 . . . . 0.0 110.931 -179.949 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 18.5 p90 -115.63 24.97 11.13 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 179.53 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -150.04 165.56 32.36 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -177.379 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -152.12 143.97 23.69 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.791 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -168.75 176.36 43.01 Favored Glycine 0 C--O 1.226 -0.398 0 N-CA-C 109.979 -1.249 . . . . 0.0 109.979 -179.456 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -140.93 -16.44 0.87 Allowed 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -179.16 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.7 tp 53.53 -166.94 0.07 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -173.503 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -166.24 162.38 17.37 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 103.001 -2.962 . . . . 0.0 103.001 177.071 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -148.99 -63.84 0.23 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -175.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.41 171.53 17.91 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.518 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -151.03 142.61 23.58 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 173.606 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 39.3 tp -163.35 157.55 20.19 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 178.307 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -162.77 162.91 26.86 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -178.24 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -138.74 135.96 35.26 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 176.524 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 . . . . . 0 C--O 1.254 1.298 0 N-CA-C 104.037 -2.579 . . . . 0.0 104.037 -178.084 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 ptm . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.818 0.342 . . . . 25.0 110.939 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -111.11 157.0 20.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 25.0 110.929 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.731 HD13 ' CE2' ' A' ' 144' ' ' PHE . 10.7 tp -70.56 -36.63 73.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 25.0 110.834 -179.88 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 88' ' ' SER . 3.5 mm? -73.73 -55.25 6.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.442 . . . . 25.0 110.958 179.877 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.04 -35.45 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 25.0 110.851 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.68 ' HB2' ' HB2' ' A' ' 147' ' ' ALA . 14.7 t80 -52.46 -46.1 66.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 25.0 110.948 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.497 ' CG2' HD11 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -71.22 -54.32 11.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.093 -179.977 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -51.19 -38.94 55.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.421 . . . . 25.0 110.926 -179.893 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -75.63 -48.26 22.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -48.3 74.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.84 -48.09 81.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 25.0 111.138 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.49 -44.15 62.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.552 ' HB1' HD13 ' A' ' 157' ' ' LEU . . . -72.0 -33.09 67.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.087 179.941 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 13.3 t-80 -64.85 -51.86 59.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.484 ' CB ' HD13 ' A' ' 33' ' ' LEU . 3.8 mt -56.66 -56.13 25.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 25.0 110.903 -179.947 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -56.57 -33.0 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 25.0 111.134 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.97 -17.88 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.283 -0.417 . . . . 25.0 110.891 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.0 33.87 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.86 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.82 94.86 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.713 -0.756 . . . . 25.0 112.457 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -103.4 104.06 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.857 0.36 . . . . 25.0 110.878 -179.764 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -50.9 111.42 1.26 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.798 -0.715 . . . . 25.0 112.438 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.548 HG11 ' HB2' ' A' ' 25' ' ' ALA . 21.7 t -69.98 106.53 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.763 0.316 . . . . 25.0 111.078 -179.926 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.56 HD11 HD22 ' A' ' 43' ' ' LEU . 3.9 mt -69.12 -34.77 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.138 -0.483 . . . . 25.0 111.106 179.905 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -169.28 116.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.863 179.957 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.548 ' HB2' HG11 ' A' ' 22' ' ' VAL . . . -108.57 104.47 13.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.079 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.08 29.77 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.752 -0.737 . . . . 25.0 112.487 -179.925 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 52.24 -96.81 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 25.0 110.882 -179.833 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.7 t 69.11 -70.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.839 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -141.29 -44.84 0.37 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.134 -0.485 . . . . 25.0 110.869 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.57 173.12 15.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.916 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.9 mt -103.65 130.24 54.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.18 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -109.76 135.73 50.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.124 -0.489 . . . . 25.0 110.918 179.94 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.484 HD13 ' CB ' ' A' ' 15' ' ' LEU . 11.3 mt -146.03 124.51 12.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 25.0 110.942 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.24 133.64 42.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 25.0 110.9 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.4 104.04 38.97 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.594 0.711 . . . . 25.0 111.112 179.907 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -32.35 18.68 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.627 2.218 . . . . 25.0 112.328 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -25.63 60.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 25.0 110.823 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 66.27 39.7 4.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.93 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.07 -176.52 1.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 25.0 110.843 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.07 -34.54 13.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 25.0 110.945 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -105.51 122.8 46.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 25.0 110.909 179.848 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.12 -56.03 5.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.56 HD22 HD11 ' A' ' 23' ' ' ILE . 63.0 mt -119.59 155.26 32.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 25.0 110.895 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.9 148.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 25.0 111.169 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.634 ' HG3' HD11 ' A' ' 82' ' ' LEU . 1.3 mtt180 -132.23 140.15 48.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 25.0 110.827 -179.909 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.522 HD12 ' O ' ' A' ' 45' ' ' ARG . 4.5 mp -134.35 126.56 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.891 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -126.71 150.01 49.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 25.0 110.987 -179.967 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 94.84 4.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.164 -0.471 . . . . 25.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -151.57 148.95 28.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 25.0 110.875 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -92.99 140.06 29.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 25.0 110.874 179.958 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.34 152.09 35.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 25.0 110.871 -179.878 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.32 -36.25 7.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 25.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -135.97 -175.13 3.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 25.0 110.932 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt85 -80.38 -30.54 37.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 25.0 110.796 -179.894 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -35.1 62.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 25.0 110.917 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -34.87 61.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 25.0 110.905 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' MET . . . . . 0.568 ' O ' HD12 ' A' ' 61' ' ' ILE . 1.8 tpp -72.57 -52.28 16.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.877 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.502 ' CG1' HD12 ' A' ' 99' ' ' ILE . 34.2 m -58.95 -34.26 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.268 -0.424 . . . . 25.0 111.154 179.911 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 mtm-85 -66.51 -37.68 85.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.165 -0.47 . . . . 25.0 110.868 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -54.13 46.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 25.0 110.879 179.949 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.568 HD12 ' O ' ' A' ' 57' ' ' MET . 2.4 mp -60.73 -37.85 77.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.288 -0.414 . . . . 25.0 111.139 179.948 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -51.43 -34.89 37.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 25.0 110.942 179.944 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -76.78 -35.67 57.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 25.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.74 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.8 mp0 -54.42 -59.72 4.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 25.0 110.924 -179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.507 ' HB1' ' CB ' ' A' ' 106' ' ' LYS . . . -52.22 -38.35 57.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.083 179.924 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.89 -42.04 97.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 25.0 110.886 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.48 -37.2 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.884 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 68' ' ' VAL . . . . . 0.744 HG11 HG13 ' A' ' 109' ' ' VAL . 68.1 t -52.85 -35.74 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 25.0 111.124 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -53.93 -36.69 63.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.813 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -72.29 -37.12 69.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.176 -0.466 . . . . 25.0 110.842 -179.891 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 86.5 t -70.87 -52.8 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 25.0 111.166 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -36.36 75.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.806 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -58.25 -45.27 88.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.818 -179.924 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -72.54 -37.55 68.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 25.0 110.9 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mp -70.98 -19.63 62.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.896 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.32 33.34 58.2 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.773 -0.727 . . . . 25.0 112.501 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.03 175.34 6.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 25.0 110.897 -179.89 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -71.27 -52.83 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -148.74 163.86 36.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 25.0 110.859 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 mmm -134.9 130.97 36.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 25.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.7 120.12 39.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 25.0 110.901 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.661 ' O ' HG13 ' A' ' 111' ' ' VAL . 0.6 OUTLIER -111.57 130.99 55.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.314 -0.403 . . . . 25.0 110.967 179.878 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.62 ' N ' HD13 ' A' ' 82' ' ' LEU . 2.3 tp -104.08 97.72 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.917 179.856 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -100.21 126.68 46.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 25.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.544 HG23 ' CB ' ' A' ' 114' ' ' ALA . 7.0 p -129.6 154.87 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 25.0 111.133 179.971 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -122.56 127.4 49.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.866 -179.953 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -98.39 114.61 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.865 -179.938 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.598 ' O ' HD11 ' A' ' 4' ' ' LEU . 60.2 p -143.76 169.52 17.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.862 -179.778 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.8 m -89.86 -51.22 5.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 25.0 111.157 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -120.58 135.24 55.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.837 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.773 ' HB2' ' HD2' ' A' ' 117' ' ' ARG . . . -69.24 160.15 80.1 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.54 0.686 . . . . 25.0 111.092 179.959 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.571 ' HD2' ' HB1' ' A' ' 91' ' ' ALA . 54.3 Cg_endo -69.58 -170.48 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.753 2.302 . . . . 25.0 112.383 -179.997 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.6 m -145.79 80.67 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 25.0 111.151 179.83 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -172.98 45.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.786 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.9 t70 63.51 55.85 1.7 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.858 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 24.3 p-90 -84.39 -29.63 26.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 25.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -50.7 -48.2 58.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.199 -0.455 . . . . 25.0 110.846 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.92 -33.57 37.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.847 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' ILE . . . . . 0.557 HG22 ' HG3' ' A' ' 113' ' ' PRO . 21.6 mm -59.99 -46.4 94.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 25.0 111.098 -179.98 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.82 -31.11 71.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.02 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -73.0 -38.07 66.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 25.0 110.932 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt -89.08 156.54 18.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.881 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.3 m -122.81 143.98 49.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.445 . . . . 25.0 111.161 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -90.75 104.16 16.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -112.43 101.09 9.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 25.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 106' ' ' LYS . . . . . 0.507 ' CB ' ' HB1' ' A' ' 65' ' ' ALA . 0.2 OUTLIER -98.01 103.28 15.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 25.0 110.823 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 52.75 -112.41 2.14 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.725 . . . . 25.0 112.437 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.1 p -95.08 29.81 2.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 25.0 111.125 -179.824 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.744 HG13 HG11 ' A' ' 68' ' ' VAL . 17.5 t -122.46 151.61 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 25.0 111.096 179.917 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.8 t -137.73 112.5 8.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 25.0 110.893 -179.818 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 111' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 82' ' ' LEU . 18.9 t -140.94 138.9 34.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 25.0 111.082 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.04 141.86 38.21 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.648 0.737 . . . . 25.0 110.885 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 113' ' ' PRO . . . . . 0.557 ' HG3' HG22 ' A' ' 99' ' ' ILE . 54.6 Cg_endo -69.65 135.61 31.16 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.669 2.246 . . . . 25.0 112.351 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.544 ' CB ' HG23 ' A' ' 85' ' ' VAL . . . -134.26 135.14 42.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 25.0 111.111 179.875 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.98 137.93 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 25.0 111.165 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 116' ' ' VAL . . . . . 0.695 HG12 ' HB3' ' A' ' 124' ' ' ASP . 4.7 m -130.74 101.85 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 25.0 111.203 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.773 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -95.2 154.73 17.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.889 -179.961 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.65 -29.46 18.37 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.765 -0.731 . . . . 25.0 112.482 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.1 p -57.51 -45.37 85.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 25.0 111.172 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 1.7 mtm -134.59 46.93 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.819 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.453 ' CD1' HD12 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -61.31 -59.19 5.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 25.0 110.85 -179.963 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.72 -35.58 80.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.91 179.908 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.57 -41.09 89.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 25.0 110.8 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 124' ' ' ASP . . . . . 0.695 ' HB3' HG12 ' A' ' 116' ' ' VAL . 1.1 m-20 -77.43 -33.25 54.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 25.0 110.897 -179.964 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 125' ' ' LEU . . . . . 0.497 HD11 ' CG2' ' A' ' 7' ' ' THR . 0.2 OUTLIER -52.66 -33.8 48.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.495 . . . . 25.0 110.932 -179.954 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -75.36 -30.2 60.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 25.0 110.846 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.54 -37.83 65.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 25.0 111.17 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -90.34 -60.63 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.441 . . . . 25.0 111.108 179.979 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 129' ' ' PHE . . . . . 0.478 ' HZ ' HD11 ' A' ' 46' ' ' LEU . 31.0 m-85 -112.44 77.54 2.32 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.586 0.708 . . . . 25.0 110.881 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 -29.45 23.44 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.643 2.229 . . . . 25.0 112.321 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 43.3 t -69.44 -16.04 63.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 25.0 110.799 -179.813 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -54.24 146.17 15.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.854 -179.877 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -91.06 122.63 33.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.854 -179.93 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.81 -33.6 18.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 25.0 111.176 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.0 -32.4 21.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.851 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -35.57 52.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 25.0 110.875 179.989 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 34.9 t -62.81 94.4 0.07 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.195 -0.457 . . . . 25.0 110.828 -179.818 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.66 -173.25 4.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 25.0 110.873 -179.745 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.26 -31.75 14.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.949 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -34.59 44.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 25.0 110.939 -179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 141' ' ' HIS . . . . . 0.447 ' O ' ' HB3' ' A' ' 142' ' ' ALA . 42.7 m170 -79.15 -28.38 42.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.154 -0.475 . . . . 25.0 110.888 -179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 142' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 141' ' ' HIS . . . 68.91 -77.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 25.0 111.098 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -165.38 -169.88 1.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 25.0 110.858 -179.876 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 144' ' ' PHE . . . . . 0.731 ' CE2' HD13 ' A' ' 3' ' ' LEU . 13.8 m-85 -52.13 -29.34 21.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.834 -179.868 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.17 -34.71 32.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.877 -179.915 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.26 -33.01 62.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 25.0 110.969 -179.974 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 147' ' ' ALA . . . . . 0.68 ' HB2' ' HB2' ' A' ' 6' ' ' TYR . . . -53.88 -35.39 61.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 25.0 111.154 179.763 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -61.47 -44.76 96.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.852 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.2 mmt -76.93 -35.73 57.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.437 . . . . 25.0 110.852 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.65 66.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.252 -0.431 . . . . 25.0 111.132 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.3 ttt180 -65.13 -53.81 39.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -43.79 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 25.0 110.877 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -39.5 93.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.959 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.588 ' O ' HG23 ' A' ' 158' ' ' VAL . 38.9 t80 -53.57 -44.23 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.861 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -51.93 -46.12 64.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 25.0 110.884 -179.908 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.5 m -76.15 -36.22 58.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.869 -179.933 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 157' ' ' LEU . . . . . 0.552 HD13 ' HB1' ' A' ' 13' ' ' ALA . 10.5 tt -57.17 -34.99 69.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.89 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 158' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 154' ' ' PHE . 84.1 t -52.63 -54.5 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.101 179.795 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 159' ' ' LEU . . . . . 0.653 HD13 ' O ' ' A' ' 159' ' ' LEU . 3.3 tm? -75.25 -33.35 61.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 25.0 110.886 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -60.74 -36.25 78.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.257 -0.429 . . . . 25.0 110.838 179.85 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.37 -30.09 50.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 25.0 110.986 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.58 -43.26 84.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.858 -179.898 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -77.07 -35.97 56.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 25.0 110.793 -179.876 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -66.44 -35.6 80.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 25.0 110.885 -179.88 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -51.88 -36.0 47.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 25.0 110.885 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -51.84 -51.64 55.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 25.0 110.901 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -35.55 68.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 25.0 111.174 179.982 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -51.92 -36.0 47.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.186 -0.461 . . . . 25.0 110.921 179.93 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -51.55 -35.62 41.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 25.0 111.13 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -51.65 125.54 15.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 25.0 111.098 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 34.2 m -51.8 139.02 8.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 25.0 111.084 -179.994 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -148.82 -170.66 3.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 25.0 110.908 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.48 134.47 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 25.0 110.897 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -177.64 163.1 1.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 25.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 112.0 -176.42 18.02 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.846 -0.692 . . . . 25.0 112.555 -179.96 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 7.0 mttt -141.79 178.63 7.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.781 0.324 . . . . 25.0 110.924 -179.949 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 2.2 tt -142.53 -43.4 0.32 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 25.0 110.915 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -53.8 136.14 40.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.872 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 7.2 ttp180 -175.71 139.52 0.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 25.0 110.908 -179.93 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -140.72 157.75 44.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.153 -0.476 . . . . 25.0 110.831 -179.885 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -133.39 177.04 7.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 25.0 110.903 -179.969 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.25 137.02 50.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 25.0 110.954 179.936 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -51.2 159.87 0.59 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.94 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -145.02 134.08 22.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.485 . . . . 25.0 110.878 -179.943 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 185' ' ' GLN . . . . . 0.548 ' HG3' ' OXT' ' A' ' 185' ' ' GLN . 12.1 pt20 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 25.0 110.903 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 C--O 1.22 -0.467 0 CA-C-O 121.312 0.577 . . . . 0.0 109.996 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.68 -34.63 78.3 Favored 'General case' 0 C--O 1.215 -0.763 0 O-C-N 122.017 -0.427 . . . . 0.0 110.976 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -61.62 -32.95 73.12 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.602 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -63.15 -52.44 62.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.2 m -59.38 -40.82 87.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.371 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.452 ' HH ' ' N ' ' A' ' 29' ' ' ASP . 14.0 t80 -55.26 -48.35 74.12 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.425 0.69 . . . . 0.0 110.983 178.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -70.49 -34.08 71.96 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.718 -0.614 . . . . 0.0 111.749 178.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -67.97 -34.88 77.4 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.095 -0.378 . . . . 0.0 111.397 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 24.2 mm -71.85 -41.1 69.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.86 78.04 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.51 -49.8 73.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.519 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -37.92 89.26 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.28 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.47 -48.79 63.56 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.2 p -65.22 -30.61 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.202 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -78.17 -8.56 58.45 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.971 -0.455 . . . . 0.0 111.312 178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 55.4 m -101.25 9.94 41.27 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.95 0.83 61.76 Favored Glycine 0 N--CA 1.452 -0.282 0 N-CA-C 116.836 1.494 . . . . 0.0 116.836 176.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.42 132.08 46.41 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.13 131.29 10.28 Favored Glycine 0 C--O 1.22 -0.753 0 N-CA-C 110.271 -1.132 . . . . 0.0 110.271 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.44 106.23 7.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 118.332 1.066 . . . . 0.0 109.329 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 74.3 mt -72.78 -42.46 61.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -148.7 116.34 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.5 0 O-C-N 123.189 0.306 . . . . 0.0 111.035 179.022 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.452 ' N ' ' HH ' ' A' ' 8' ' ' TYR . 12.5 p-10 . . . . . 0 C--O 1.222 -0.352 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -131.6 131.68 43.45 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.8 mt -136.6 132.79 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 175.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -108.17 129.2 55.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.88 126.26 48.28 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 123.434 0.694 . . . . 0.0 109.565 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -76.32 132.26 39.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.29 116.62 50.93 Favored Pre-proline 0 CA--C 1.546 0.809 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.28 -23.58 20.7 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 117.592 -1.139 . . . . 0.0 113.812 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.9 -27.49 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.654 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.7 mttt 54.83 39.54 31.5 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.952 1.834 . . . . 0.0 108.353 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 t -73.95 -176.26 2.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 110.816 -2.902 . . . . 0.0 107.927 176.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.2 m -47.22 -30.62 3.1 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -90.03 129.9 36.28 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 172.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -89.15 -37.36 15.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.956 0.408 . . . . 0.0 111.891 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.49 166.42 30.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.257 0.551 . . . . 0.0 111.534 -175.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 49.1 t -127.16 136.39 60.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -114.98 126.35 54.66 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mp -95.87 129.46 43.11 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 102.98 -2.97 . . . . 0.0 102.98 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -136.45 113.43 10.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.644 0.735 . . . . 0.0 112.478 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -87.67 96.88 10.59 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.82 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -151.62 139.19 19.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -93.68 137.82 32.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -121.81 120.1 33.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.353 0.121 . . . . 0.0 111.115 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -80.09 -48.63 12.94 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.559 0.695 . . . . 0.0 111.297 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -120.2 156.33 31.36 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.256 0.551 . . . . 0.0 112.4 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HE ' ' CB ' ' A' ' 95' ' ' ASP . 8.4 ptt85 -64.33 -15.52 60.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.249 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -65.11 -45.66 84.2 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -72.52 -36.29 68.29 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -178.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 20.5 ttt -57.46 -48.08 80.12 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -72.29 -31.81 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.744 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.48 -36.43 84.16 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -60.81 -41.23 95.28 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -66.34 -30.93 51.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 O-C-N 122.12 -0.363 . . . . 0.0 111.527 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -61.04 -39.44 89.81 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -76.55 -41.83 45.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.019 0.437 . . . . 0.0 110.168 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -55.99 -43.23 77.45 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.79 88.68 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -71.78 -34.18 69.2 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 121.72 -0.613 . . . . 0.0 109.989 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -63.28 -42.16 99.07 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.44 HG11 HG13 ' A' ' 109' ' ' VAL . 45.5 t -67.17 -32.24 56.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.782 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.9 -33.56 68.87 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.239 -0.913 . . . . 0.0 110.447 177.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.87 -40.45 79.26 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.99 0.424 . . . . 0.0 109.97 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.73 -36.75 75.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.082 0.468 . . . . 0.0 109.746 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -55.79 -39.44 71.28 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.113 -0.367 . . . . 0.0 110.668 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -59.28 -50.86 72.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.048 -178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -73.37 -22.45 60.27 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -82.59 -18.06 42.61 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 122.015 -0.428 . . . . 0.0 112.032 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.09 2.06 12.05 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -75.58 152.71 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 118.108 0.954 . . . . 0.0 112.976 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.5 ttt85 -69.11 -22.84 63.95 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.903 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 -147.35 151.85 37.23 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 104.16 -2.533 . . . . 0.0 104.16 177.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -119.99 135.79 54.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.882 -1.895 . . . . 0.0 105.882 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -126.13 126.13 43.65 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 53.8 tp -114.13 134.47 54.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.817 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.6 tp -95.08 120.43 35.28 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 169.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -114.24 114.79 26.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.312 0.505 . . . . 0.0 110.362 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.5 t -109.08 111.01 34.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.004 0.431 . . . . 0.0 112.048 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -77.21 141.69 39.94 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -116.11 103.68 10.8 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.7 m -128.36 150.62 50.02 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.546 0.529 . . . . 0.0 111.141 -174.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.3 t -70.61 -29.0 65.27 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.511 -0.743 . . . . 0.0 110.458 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -148.54 164.06 35.35 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.64 157.51 49.37 Favored Pre-proline 0 C--N 1.319 -0.718 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.87 147.33 62.8 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.44 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 19.8 m -65.84 -14.16 16.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -152.0 146.64 25.73 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -177.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.48 ' CB ' ' HE ' ' A' ' 54' ' ' ARG . 60.1 m-20 47.22 6.28 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 120.243 3.423 . . . . 0.0 120.243 176.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -58.95 -25.89 63.93 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.86 -1.15 . . . . 0.0 112.61 -175.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.67 -32.24 73.27 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.996 -0.44 . . . . 0.0 112.18 -177.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.07 -33.49 75.54 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.853 0.835 . . . . 0.0 109.187 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.3 mm -69.21 -41.14 81.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.483 -173.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.87 -12.55 61.02 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.082 0.468 . . . . 0.0 111.469 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -98.56 0.24 44.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.416 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -121.88 135.75 54.9 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.479 0.656 . . . . 0.0 112.346 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.8 m -82.59 126.95 32.88 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -85.42 119.0 25.29 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 176.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -123.45 131.79 53.75 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -139.31 103.6 4.78 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.738 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.96 -112.7 4.35 Favored Glycine 0 C--O 1.224 -0.497 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.0 p -108.59 8.31 27.06 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.171 0.51 . . . . 0.0 110.578 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.44 HG13 HG11 ' A' ' 68' ' ' VAL . 86.1 t -95.38 141.49 15.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.6 t -127.35 135.67 50.84 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 175.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.4 t -134.25 134.94 54.88 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.603 0 CA-C-O 122.107 0.956 . . . . 0.0 109.284 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -103.18 101.88 24.94 Favored Pre-proline 0 N--CA 1.427 -1.582 0 CA-C-N 113.26 -1.791 . . . . 0.0 108.207 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.31 145.43 24.02 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 116.941 -1.573 . . . . 0.0 112.451 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.36 154.57 40.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 tt -147.33 128.78 6.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.36 121.53 60.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.45 140.03 42.34 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -175.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.56 -32.54 53.42 Favored Glycine 0 C--O 1.229 -0.176 0 CA-C-N 115.568 -0.742 . . . . 0.0 114.188 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 32.9 p -53.35 -30.19 38.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 115.718 1.747 . . . . 0.0 115.718 -178.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.5 ptm -140.94 26.92 2.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.86 0.838 . . . . 0.0 109.44 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.7 tp -47.86 -40.88 22.69 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 118.263 2.69 . . . . 0.0 118.263 -168.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -41.75 94.93 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.675 1.125 . . . . 0.0 112.028 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.55 -40.25 35.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.981 0.896 . . . . 0.0 110.878 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -61.69 -41.86 98.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.589 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.96 -42.48 89.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.44 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -76.64 -15.09 59.91 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.626 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.35 -34.63 63.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.4 t -90.18 -43.17 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 109.903 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -120.49 78.89 28.78 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.773 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -69.68 -9.12 25.36 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 117.669 -1.087 . . . . 0.0 112.515 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 p -74.28 -14.92 60.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.396 176.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -96.72 134.17 40.34 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 . . . . . 0 C--N 1.323 -0.573 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -177.866 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 . . . . . 0 C--O 1.214 -0.797 0 CA-C-O 120.554 0.216 . . . . 0.0 111.506 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -31.72 55.91 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.112 -0.368 . . . . 0.0 111.662 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -64.58 -48.31 75.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.0 mmt -66.4 -35.64 80.83 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.913 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.55 -38.33 77.57 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.33 -0.231 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -65.34 -45.9 82.41 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.29 -43.43 98.88 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.148 0.499 . . . . 0.0 111.029 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.9 mmt-85 -63.17 -44.01 96.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.14 -41.56 88.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 177.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 80.2 mt -65.48 -35.8 81.96 Favored 'General case' 0 C--N 1.321 -0.657 0 O-C-N 121.646 -0.658 . . . . 0.0 111.2 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 87.6 p -75.81 -27.81 58.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.487 -0.758 . . . . 0.0 110.53 175.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.69 -43.68 65.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.474 -177.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.3 -33.07 57.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.1 tm? . . . . . 0 C--N 1.327 -0.387 0 O-C-N 121.719 -0.613 . . . . 0.0 109.584 176.124 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 23.8 tp -63.08 -42.19 99.59 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.448 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -64.63 -41.05 96.43 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -58.59 -48.14 81.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.9 m -66.12 -43.46 87.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.352 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -55.09 -51.63 65.78 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.622 0.369 . . . . 0.0 110.984 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -72.3 -29.95 64.34 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.728 -0.607 . . . . 0.0 112.143 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -71.1 -35.54 71.84 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.557 -0.715 . . . . 0.0 111.166 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.1 mm -71.29 -37.83 67.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.14 -45.15 87.87 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 176.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.66 -40.8 96.07 Favored 'General case' 0 C--O 1.208 -1.123 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -58.94 -49.81 76.44 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.2 mp -68.35 -45.42 72.9 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.089 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.76 -42.77 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.937 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -61.97 -26.53 68.26 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 121.915 -0.491 . . . . 0.0 111.72 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -82.53 5.24 21.44 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 122.575 0.35 . . . . 0.0 111.763 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.12 -1.51 44.06 Favored Glycine 0 CA--C 1.517 0.164 0 N-CA-C 115.483 0.953 . . . . 0.0 115.483 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.01 123.05 19.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.817 0.808 . . . . 0.0 109.393 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.01 129.39 9.66 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.31 133.99 29.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.07 -41.94 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -149.2 142.24 24.87 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 104.804 -2.295 . . . . 0.0 104.804 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.432 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -179.403 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 . . . . . 0 N--CA 1.466 0.332 0 CA-C-O 121.183 0.516 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -133.18 152.28 51.95 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 93.2 mt -135.21 133.48 52.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -114.44 136.11 53.37 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.14 0.576 . . . . 0.0 109.654 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mp -132.91 137.97 46.8 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.349 0.66 . . . . 0.0 109.923 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -93.86 135.82 34.78 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.77 111.93 15.38 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -73.59 -24.96 15.48 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.523 -1.184 . . . . 0.0 114.173 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.19 -8.3 55.72 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt 58.15 43.95 19.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -68.19 -177.66 0.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 113.273 -1.785 . . . . 0.0 110.915 -177.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 p -56.27 -27.64 55.97 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.484 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -105.76 133.4 50.55 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -80.11 -39.81 28.77 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 120.96 0.409 . . . . 0.0 109.933 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.4 mt -137.38 160.35 39.32 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.716 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 58.5 t -131.51 137.43 55.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -123.35 132.27 53.93 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.2 124.08 47.92 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 174.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -136.54 150.0 48.4 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -125.81 119.91 29.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 118.181 0.446 . . . . 0.0 112.019 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.71 140.43 20.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -92.61 111.98 23.76 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.7 mt -104.09 125.19 50.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -87.22 -34.7 18.89 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.18 0.514 . . . . 0.0 110.708 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -130.29 148.01 52.07 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -177.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 95' ' ' ASP . 14.1 ptt180 -67.38 -21.05 65.63 Favored 'General case' 0 CA--C 1.505 -0.768 0 O-C-N 121.088 -1.008 . . . . 0.0 111.803 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -62.11 -28.52 69.69 Favored 'General case' 0 C--O 1.213 -0.865 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.69 -45.07 25.95 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 175.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.4 ttm -54.56 -49.97 69.07 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.484 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.17 -31.87 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.25 -34.57 76.45 Favored 'General case' 0 CA--C 1.506 -0.745 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.238 -176.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -42.24 89.71 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -74.18 -34.43 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 122.019 -0.426 . . . . 0.0 111.355 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -41.54 92.05 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -76.3 -33.73 59.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.948 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -58.2 -46.62 85.51 Favored 'General case' 0 C--O 1.219 -0.52 0 O-C-N 121.966 -0.459 . . . . 0.0 109.798 176.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.05 -32.68 74.11 Favored 'General case' 0 N--CA 1.444 -0.755 0 O-C-N 122.403 -0.185 . . . . 0.0 110.623 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -46.54 85.35 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -61.67 -41.31 97.38 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.422 HG11 HG13 ' A' ' 109' ' ' VAL . 86.7 t -61.31 -35.34 65.56 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.74 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.986 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -55.48 -38.99 69.85 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.493 1.042 . . . . 0.0 110.597 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -73.93 -45.79 48.3 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.705 0.288 . . . . 0.0 111.118 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.06 -44.33 95.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.652 0.263 . . . . 0.0 111.698 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -30.1 70.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.151 -0.968 . . . . 0.0 110.167 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -68.89 -43.15 75.86 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.12 -30.99 70.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.879 0.371 . . . . 0.0 111.246 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -83.33 -14.0 53.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.489 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.98 -3.09 30.63 Favored Glycine 0 CA--C 1.522 0.469 0 N-CA-C 114.191 0.437 . . . . 0.0 114.191 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -71.0 136.02 48.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -64.24 -45.79 86.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 122.124 -0.36 . . . . 0.0 111.785 -176.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -119.98 162.26 19.52 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 178.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.4 ttp -145.31 138.84 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.363 174.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -113.63 143.46 44.53 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 123.647 0.592 . . . . 0.0 109.863 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.1 tt -139.47 136.85 35.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.0 tp -99.22 106.35 18.49 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -97.31 108.52 21.26 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.41 116.31 46.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -175.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -85.98 151.37 23.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -126.3 129.43 48.85 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 172.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.5 p -147.62 163.02 37.94 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.017 0.198 . . . . 0.0 110.784 -174.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.0 m -67.09 -48.96 66.59 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 173.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -151.41 165.99 32.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 105.188 -2.153 . . . . 0.0 105.188 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.16 158.14 36.5 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.14 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -54.48 146.01 54.7 Favored 'Trans proline' 0 C--N 1.349 0.571 0 N-CA-C 116.902 1.847 . . . . 0.0 116.902 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.6 m -77.18 -19.51 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.01 177.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -87.71 87.22 7.31 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.755 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 54' ' ' ARG . 68.8 m-20 19.84 51.25 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 119.054 2.983 . . . . 0.0 119.054 176.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -63.05 -20.59 65.48 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.519 -0.738 . . . . 0.0 112.875 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.35 -31.29 69.06 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 122.246 -0.284 . . . . 0.0 111.451 -177.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.73 -30.35 71.46 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.685 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.4 HD11 ' HD2' ' A' ' 54' ' ' ARG . 9.4 mm -73.46 -38.51 53.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.86 0.362 . . . . 0.0 110.3 -176.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.07 -25.3 67.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.101 0.953 . . . . 0.0 110.441 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -97.69 21.71 10.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.215 -177.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.3 ttmm -139.36 98.02 3.41 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 65.1 m -68.24 127.07 31.58 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -86.39 112.12 21.16 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -108.4 131.98 54.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.809 0.814 . . . . 0.0 110.103 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -128.86 84.51 2.24 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.94 -110.44 3.15 Favored Glycine 0 C--O 1.22 -0.78 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 71.7 p -98.09 -1.32 42.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.422 HG13 HG11 ' A' ' 68' ' ' VAL . 95.9 t -89.52 138.55 19.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.0 m -133.98 112.72 11.46 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 173.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.9 t -121.53 130.58 74.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -113.58 133.0 22.28 Favored Pre-proline 0 C--O 1.244 0.808 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -81.58 160.88 19.4 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 O-C-N 122.253 0.607 . . . . 0.0 112.446 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.86 152.59 36.72 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 102.444 -3.169 . . . . 0.0 102.444 174.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 tt -147.76 135.46 14.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 51.7 t -108.98 117.32 54.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.41 146.91 42.54 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.295 177.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.49 -41.5 8.35 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 172.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.3 t -65.51 -19.75 66.06 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -177.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 24.4 ptm -136.63 32.0 2.78 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 122.095 0.95 . . . . 0.0 109.355 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -49.19 -43.83 42.58 Favored 'General case' 0 C--O 1.213 -0.821 0 N-CA-C 116.545 2.054 . . . . 0.0 116.545 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.4 ptt-85 -54.69 -51.35 65.82 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.309 0.504 . . . . 0.0 112.052 -177.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -75.05 -39.66 60.81 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.951 -177.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -70.37 -32.12 69.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -175.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.45 -41.22 93.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.721 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.11 -21.23 66.77 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.7 -22.69 60.86 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.648 0.261 . . . . 0.0 110.91 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.0 t -109.06 -42.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.167 0.508 . . . . 0.0 111.554 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -125.54 73.88 68.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.366 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.83 -12.38 32.65 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 117.991 -0.873 . . . . 0.0 113.362 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.0 m -80.39 -5.08 55.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -103.6 132.95 49.41 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 39.5 mtp85 . . . . . 0 C--N 1.325 -0.473 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.74 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 . . . . . 0 C--O 1.215 -0.732 0 N-CA-C 110.688 -0.115 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -39.85 72.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.731 0.3 . . . . 0.0 111.524 177.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -68.67 -41.94 78.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.531 0.681 . . . . 0.0 109.266 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 46.3 mtt -64.41 -37.0 86.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.84 -37.55 87.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.447 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -64.61 -52.6 56.64 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -63.85 -36.02 82.55 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.373 0.606 . . . . 0.0 111.148 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -63.86 -39.67 94.75 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -66.95 -42.14 85.74 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.129 0.171 . . . . 0.0 111.289 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.37 -34.84 75.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.177 0.513 . . . . 0.0 109.822 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 24.0 m -75.97 -35.69 59.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.392 0.615 . . . . 0.0 111.477 176.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 5.7 tt -65.56 -43.16 90.74 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.5 p -57.72 -40.76 77.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.739 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.6 tm? . . . . . 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.539 . . . . 0.0 110.265 179.525 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tt . . . . . 0 C--O 1.214 -0.766 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -60.99 -32.41 71.98 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.649 0.737 . . . . 0.0 112.052 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -56.98 -27.15 61.13 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -61.29 -52.3 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 178.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 m -69.45 -40.22 77.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.141 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -52.82 -58.03 8.24 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -68.01 -28.07 67.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.476 -0.765 . . . . 0.0 111.905 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -73.18 -29.87 63.14 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 122.09 -0.381 . . . . 0.0 111.455 178.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.424 HD11 HD11 ' A' ' 125' ' ' LEU . 12.9 mm -69.87 -41.88 79.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.56 80.28 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.42 98.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.094 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -39.32 86.33 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.644 -0.423 . . . . 0.0 111.27 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.45 -44.23 83.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.84 -42.58 89.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.027 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -77.96 -2.41 36.79 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.358 -0.839 . . . . 0.0 112.692 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -98.37 7.96 45.5 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 173.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.54 -1.32 57.02 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 116.694 1.437 . . . . 0.0 116.694 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.445 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 12.8 m-85 -69.69 125.32 26.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 118.336 1.068 . . . . 0.0 110.442 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.46 133.67 13.1 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.6 t -78.25 117.09 22.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.465 HD11 HD22 ' A' ' 43' ' ' LEU . 75.3 mt -87.24 -44.74 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -149.56 123.26 9.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.827 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.628 0 N-CA-C 104.115 -2.55 . . . . 0.0 104.115 172.389 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.462 0.162 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -135.53 141.02 45.17 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 42.3 mt -136.1 131.69 49.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -106.83 128.74 54.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.09 133.45 53.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.564 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -87.52 137.03 32.69 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.03 107.25 11.03 Favored Pre-proline 0 CA--C 1.549 0.921 0 O-C-N 123.034 0.209 . . . . 0.0 111.554 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 90.2 Cg_endo -73.49 -20.23 20.92 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 118.009 -0.861 . . . . 0.0 112.418 -178.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.88 -25.45 66.4 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.708 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mttt 59.59 40.75 19.86 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 -173.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.0 p -75.79 -177.52 3.82 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 112.498 -2.137 . . . . 0.0 108.728 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.2 -1.56 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -136.08 133.57 37.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -76.91 -35.75 57.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.449 0.643 . . . . 0.0 109.898 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.465 HD22 HD11 ' A' ' 23' ' ' ILE . 54.8 mt -136.24 162.62 32.47 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.0 t -126.4 133.7 68.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -118.47 115.67 25.1 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 tp -90.24 123.31 33.93 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -136.35 141.9 43.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 117.902 0.319 . . . . 0.0 111.548 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -111.39 119.73 39.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 t-160 -151.71 123.62 8.06 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.21 121.0 26.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.42 108.3 18.28 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -176.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -70.29 -46.84 63.49 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 122.458 1.123 . . . . 0.0 109.856 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -119.78 155.46 32.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.051 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -62.56 -22.29 66.23 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -65.58 -32.26 73.75 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -69.96 -49.12 54.94 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.534 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -66.48 -32.07 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -71.24 -27.65 63.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.303 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -68.5 -37.52 80.14 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.84 -30.64 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.334 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.88 -42.13 98.69 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -70.05 -41.8 73.71 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.029 0.919 . . . . 0.0 109.187 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.59 -37.11 77.67 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.005 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.34 -41.92 96.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.853 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -64.26 -39.95 94.99 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.95 -44.52 97.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.3 t -67.08 -40.86 86.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.666 0 CA-C-O 119.737 -0.173 . . . . 0.0 110.57 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -35.01 72.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.262 0.553 . . . . 0.0 109.932 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -73.6 -45.73 51.29 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.803 -0.561 . . . . 0.0 110.786 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.68 -42.69 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -59.36 -30.23 68.26 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.341 -0.849 . . . . 0.0 110.729 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -66.16 -36.73 83.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -70.27 -39.66 74.82 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 121.315 0.579 . . . . 0.0 109.689 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.6 mt -75.38 -7.79 54.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.264 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.53 10.53 63.64 Favored Glycine 0 CA--C 1.522 0.485 0 CA-C-O 121.316 0.398 . . . . 0.0 113.368 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -76.23 137.67 40.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.366 0.603 . . . . 0.0 110.333 -176.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -72.0 -30.53 65.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.994 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -151.46 149.34 29.14 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 103.791 -2.67 . . . . 0.0 103.791 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.7 ttp -131.42 143.15 50.24 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 118.913 0.779 . . . . 0.0 109.901 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.1 mtpt -107.57 136.94 46.49 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.0 tp -125.75 137.31 53.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.3 tp -94.81 121.27 36.23 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.36 135.53 42.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.0 t -132.79 111.62 17.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -82.75 150.58 26.59 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.584 0.553 . . . . 0.0 110.541 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -128.94 115.87 18.5 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 173.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 96.2 p -137.06 160.8 37.88 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 123.478 0.486 . . . . 0.0 110.6 -177.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.7 t -70.55 -30.89 67.74 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.909 -0.495 . . . . 0.0 110.992 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -152.93 170.82 19.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.85 154.8 61.45 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -58.73 148.41 83.06 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 117.469 -1.221 . . . . 0.0 111.902 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 25.6 m -61.41 -22.22 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -155.49 147.2 23.14 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 48.4 9.24 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 120.027 3.343 . . . . 0.0 120.027 172.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.2 p-90 -63.46 -23.11 67.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 114.252 1.205 . . . . 0.0 114.252 -176.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -60.58 -31.35 70.49 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.927 -0.483 . . . . 0.0 112.006 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -58.47 -32.93 69.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.622 0.725 . . . . 0.0 109.873 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.6 mm -69.85 -39.37 77.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.91 -8.02 53.7 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -112.0 2.82 17.06 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.439 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -112.73 133.68 54.63 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.405 0.621 . . . . 0.0 111.426 -178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 54.2 m -79.39 125.0 28.96 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -86.34 121.05 28.37 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -128.07 139.89 52.27 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 122.024 0.916 . . . . 0.0 113.448 -177.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -140.34 75.27 1.5 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.056 -1.429 . . . . 0.0 108.831 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.13 -110.8 3.6 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 119.575 -1.298 . . . . 0.0 112.331 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.3 p -73.82 10.53 1.11 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.164 0.985 . . . . 0.0 112.941 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.8 t -130.46 142.94 42.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 121.869 -0.52 . . . . 0.0 111.079 -177.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.0 t -142.22 131.52 23.54 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 173.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.8 t -134.02 138.83 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.111 0 CA-C-O 121.942 0.877 . . . . 0.0 110.27 -177.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -111.89 110.07 54.67 Favored Pre-proline 0 N--CA 1.435 -1.178 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.485 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.19 157.68 20.08 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 115.878 -2.281 . . . . 0.0 113.345 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.1 156.76 37.85 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.2 tt -146.88 132.88 12.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.47 0.653 . . . . 0.0 111.517 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.1 119.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.6 136.36 53.12 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.09 -35.95 42.62 Favored Glycine 0 C--O 1.221 -0.669 0 N-CA-C 117.182 1.633 . . . . 0.0 117.182 -174.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -22.54 57.18 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -147.58 40.66 1.01 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.735 1.255 . . . . 0.0 108.631 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.2 tt -48.48 -54.17 15.24 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.0 ttt180 -57.32 -36.19 70.82 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.785 1.175 . . . . 0.0 113.931 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.06 -41.23 64.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.069 0.462 . . . . 0.0 110.425 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -66.04 -39.09 89.89 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.396 1.093 . . . . 0.0 109.362 178.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.424 HD11 HD11 ' A' ' 11' ' ' ILE . 1.1 tm? -62.77 -48.66 78.19 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.316 -176.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -72.33 -16.07 61.88 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.432 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.1 -36.2 55.85 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.407 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.05 -44.08 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.435 0.635 . . . . 0.0 110.443 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -128.5 77.16 77.67 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.931 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -66.69 -16.04 49.25 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 118.195 -0.736 . . . . 0.0 112.896 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.5 m -74.8 -10.52 59.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 178.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -71.35 129.31 38.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.892 0.853 . . . . 0.0 110.868 -178.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 . . . . . 0 C--N 1.322 -0.606 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.704 -177.363 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 . . . . . 0 N--CA 1.467 0.393 0 CA-C-O 121.122 0.487 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.36 -30.86 69.82 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -68.28 -39.54 82.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.4 mtt -68.16 -28.92 67.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.71 -35.21 79.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.342 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -65.27 -49.54 69.19 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 178.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -60.38 -42.15 95.24 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.492 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -61.46 -40.72 95.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.66 -43.46 93.55 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 70.4 mt -65.02 -37.94 89.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.164 0.507 . . . . 0.0 110.148 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 35.4 m -69.25 -34.67 75.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.409 0.623 . . . . 0.0 110.382 177.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.28 -45.88 78.93 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.353 -178.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.7 p -63.78 -34.04 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.068 0.849 . . . . 0.0 110.959 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.4 tm? . . . . . 0 C--O 1.218 -0.586 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.591 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.1 tp . . . . . 0 N--CA 1.472 0.634 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.62 -37.96 80.04 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.905 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -62.52 -35.9 80.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.545 -175.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -62.52 -48.28 80.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 21.0 m -69.35 -37.33 77.6 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.412 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -57.17 -51.3 69.86 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.518 0.727 . . . . 0.0 110.296 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -69.29 -29.75 67.69 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.625 -0.672 . . . . 0.0 111.098 178.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -68.48 -36.06 78.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.814 -0.554 . . . . 0.0 111.044 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.491 HD11 HD11 ' A' ' 125' ' ' LEU . 13.9 mm -72.34 -38.88 62.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.86 84.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.0 95.41 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.612 178.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -60.67 -45.6 93.52 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 122.708 0.403 . . . . 0.0 110.619 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.11 -46.32 78.03 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.711 0.291 . . . . 0.0 110.562 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.57 -37.91 80.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.951 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -63.98 -31.87 73.21 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.997 -0.439 . . . . 0.0 110.479 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.2 t -79.17 9.42 4.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 122.883 0.473 . . . . 0.0 111.52 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 92.17 1.05 70.07 Favored Glycine 0 N--CA 1.453 -0.189 0 N-CA-C 116.295 1.278 . . . . 0.0 116.295 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -64.74 126.08 26.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.278 1.039 . . . . 0.0 109.454 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.93 132.11 11.58 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.8 t -77.34 117.51 22.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.45 HD11 HD22 ' A' ' 43' ' ' LEU . 63.4 mt -87.02 -47.01 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -149.78 123.15 9.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.297 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.532 0 N-CA-C 104.137 -2.542 . . . . 0.0 104.137 173.488 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t0 . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -141.92 150.36 41.38 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -178.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.3 mt -138.19 127.65 33.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -103.6 130.0 50.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.51 138.13 54.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 123.626 0.77 . . . . 0.0 110.239 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -92.37 134.72 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 112.12 15.42 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 122.133 0.173 . . . . 0.0 110.74 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.81 -26.98 9.14 Favored 'Trans proline' 0 C--N 1.352 0.759 0 N-CA-C 114.932 1.089 . . . . 0.0 114.932 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -73.77 -5.02 38.22 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 57.62 42.19 24.38 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -176.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 p -70.0 -177.68 1.4 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 113.338 -1.755 . . . . 0.0 112.367 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.1 m -56.18 -30.36 62.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.091 176.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' A' ' 81' ' ' LYS . 84.3 m-70 -92.78 134.54 34.95 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -78.53 -45.45 21.88 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.45 HD22 HD11 ' A' ' 23' ' ' ILE . 84.6 mt -141.84 164.74 29.37 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.548 -174.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 85.6 t -133.59 138.88 50.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -121.91 128.15 51.23 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -98.17 131.97 44.09 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -136.19 141.31 44.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 118.134 0.425 . . . . 0.0 110.204 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.8 95.59 4.48 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -176.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -151.67 146.26 25.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 178.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -86.7 151.57 23.29 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.3 mt -138.73 129.12 25.86 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 122.251 0.22 . . . . 0.0 110.645 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -91.51 -37.3 13.22 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.974 0.416 . . . . 0.0 110.302 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -129.56 147.79 51.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.422 ' HD2' HD11 ' A' ' 99' ' ' ILE . 24.2 ptt-85 -65.38 -22.16 66.76 Favored 'General case' 0 CA--C 1.507 -0.708 0 O-C-N 121.645 -0.659 . . . . 0.0 111.945 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -62.09 -31.04 71.43 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.01 -39.35 63.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.7 ttm -62.51 -50.48 71.24 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.489 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.9 m -60.36 -31.97 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.39 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -69.16 -34.0 74.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.664 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -63.99 -40.7 96.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.403 0.62 . . . . 0.0 109.669 177.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.431 HG23 HG11 ' A' ' 111' ' ' VAL . 3.1 mt -70.88 -33.3 51.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.777 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -62.61 -32.75 73.82 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 176.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -67.91 -49.88 59.35 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.42 -39.25 70.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.231 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.97 -37.28 81.88 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.06 -42.22 80.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.602 0.715 . . . . 0.0 109.186 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -62.43 -42.49 99.49 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.407 0.622 . . . . 0.0 109.738 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.73 -42.96 83.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.953 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -66.99 -33.47 75.64 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.101 -179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -41.78 86.81 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 176.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 95.3 t -73.02 -38.76 56.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.49 -35.33 77.37 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.288 -0.882 . . . . 0.0 111.595 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 -58.33 -39.94 80.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 109.87 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -73.41 -20.67 60.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.0 mp -106.01 -15.73 14.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.09 4.43 42.46 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.778 1.071 . . . . 0.0 115.778 178.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -76.89 135.63 38.83 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.632 -0.922 . . . . 0.0 109.338 -178.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -66.84 -20.66 65.97 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 -175.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.424 HH21 ' CD ' ' A' ' 105' ' ' GLU . 40.6 ttt180 -152.06 154.08 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.6 151.39 50.25 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 177.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.429 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 85.7 mttt -126.11 117.46 23.21 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 170.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -116.81 126.75 53.53 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.69 123.92 34.68 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 176.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -119.26 109.64 16.07 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.83 112.84 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -176.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.16 133.03 35.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 122.87 0.468 . . . . 0.0 110.066 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -108.38 110.12 21.6 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 95.0 p -130.89 152.75 49.88 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 24.1 m -67.22 -46.51 73.6 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.864 0.84 . . . . 0.0 109.226 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -147.24 161.11 41.6 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.96 158.65 34.63 Favored Pre-proline 0 C--N 1.312 -1.058 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.797 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -54.02 150.84 29.54 Favored 'Trans proline' 0 C--N 1.349 0.563 0 N-CA-C 116.254 1.598 . . . . 0.0 116.254 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.5 m -76.5 -11.96 14.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.88 101.66 8.03 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 40.14 27.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 119.442 3.127 . . . . 0.0 119.442 172.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.4 p-90 -59.72 -20.97 59.86 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.47 -0.769 . . . . 0.0 112.88 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -60.08 -31.29 69.88 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -175.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -66.15 -34.63 78.48 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.422 HD11 ' HD2' ' A' ' 54' ' ' ARG . 11.7 mm -65.37 -43.89 94.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.502 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.33 -1.27 20.08 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -111.98 -2.82 14.99 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -103.31 115.23 30.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.91 -175.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.1 m -68.24 126.59 30.03 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 172.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -88.32 128.05 35.49 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.424 ' CD ' HH21 ' A' ' 79' ' ' ARG . 8.0 mt-10 -126.91 140.65 52.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.453 0.644 . . . . 0.0 111.433 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -140.87 75.49 1.51 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.179 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.89 -111.97 4.14 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 119.897 -1.144 . . . . 0.0 111.609 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 41.1 p -80.23 13.21 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.83 137.97 55.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.0 m -133.58 133.6 42.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.431 HG11 HG23 ' A' ' 61' ' ' ILE . 84.2 t -123.59 138.58 52.93 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.875 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -102.46 99.64 13.62 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.84 120.01 2.99 Favored 'Trans proline' 0 C--N 1.349 0.597 0 CA-C-O 121.395 0.498 . . . . 0.0 113.035 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -127.22 145.4 50.78 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.5 tt -138.72 139.16 41.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.3 m -116.83 133.71 62.68 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-O 122.109 0.957 . . . . 0.0 108.484 174.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.46 152.64 27.27 Favored 'General case' 0 C--O 1.207 -1.152 0 CA-C-N 114.363 -1.289 . . . . 0.0 108.456 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.4 -41.21 8.55 Favored Glycine 0 C--N 1.317 -0.509 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.8 t -61.74 -26.19 67.91 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 27.0 ptm -131.41 32.87 4.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.201 1.001 . . . . 0.0 110.573 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 28.1 tp -51.3 -41.49 60.53 Favored 'General case' 0 C--O 1.211 -0.959 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -174.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.744 -176.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -78.37 -40.14 37.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.618 0.723 . . . . 0.0 111.936 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.49 -39.06 85.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.5 0.667 . . . . 0.0 112.508 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.491 HD11 HD11 ' A' ' 11' ' ' ILE . 3.0 tm? -63.47 -43.32 97.66 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.061 -0.399 . . . . 0.0 111.268 -177.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -72.58 -14.7 61.68 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.678 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.2 -32.09 62.91 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.3 t -92.08 -43.65 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-O 121.245 0.545 . . . . 0.0 110.264 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -124.66 78.05 63.73 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.187 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.11 -11.17 31.03 Favored 'Trans proline' 0 C--N 1.346 0.446 0 N-CA-C 114.197 0.807 . . . . 0.0 114.197 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 19.3 t -78.0 -14.85 59.37 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.278 0.561 . . . . 0.0 110.426 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -80.88 124.93 29.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.314 0.578 . . . . 0.0 110.254 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 38.3 mtp-105 . . . . . 0 C--O 1.218 -0.599 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.197 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 52.7 m-20 . . . . . 0 N--CA 1.467 0.413 0 CA-C-O 120.791 0.329 . . . . 0.0 110.667 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.19 90.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.81 0.338 . . . . 0.0 110.608 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.37 -43.46 70.08 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 74.4 mtp -61.35 -27.61 68.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.265 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.859 -0.526 . . . . 0.0 110.683 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -64.41 -45.95 85.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.08 -42.54 94.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.42 0.628 . . . . 0.0 110.184 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 70.5 mmt-85 -66.5 -40.16 89.1 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.814 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -62.68 -42.52 99.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.229 0.468 . . . . 0.0 111.262 176.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.34 -39.42 94.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 84.8 p -71.58 -27.84 63.42 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.744 -0.598 . . . . 0.0 110.804 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.1 tt -72.33 -43.29 64.33 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.838 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 8.8 p -63.62 -36.19 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 118.935 0.789 . . . . 0.0 108.883 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.222 -0.356 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.657 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.466 0.366 0 CA-C-O 121.129 0.49 . . . . 0.0 111.041 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.62 -46.94 80.47 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.55 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.483 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 8.2 pt-20 -73.81 -29.14 61.99 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.698 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -56.93 -45.46 82.72 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.211 -1.404 . . . . 0.0 107.211 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.9 m -71.66 -44.52 64.15 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.292 0.568 . . . . 0.0 111.519 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.483 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 73.0 t80 -55.51 -51.25 67.65 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 123.873 0.869 . . . . 0.0 113.15 -178.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -68.64 -31.28 70.31 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.98 -0.45 . . . . 0.0 110.341 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -70.84 -35.14 72.32 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.902 -0.499 . . . . 0.0 111.259 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 mm -69.06 -40.75 81.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 176.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.7 90.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.17 84.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.002 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -57.06 -47.28 81.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -68.69 -46.18 69.72 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.544 0.202 . . . . 0.0 111.544 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.11 -44.49 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-O 121.319 0.58 . . . . 0.0 110.153 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -72.44 -7.62 50.78 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -97.97 9.05 43.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.49 -6.17 45.16 Favored Glycine 0 CA--C 1.517 0.202 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 175.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -66.6 133.74 50.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 118.091 0.945 . . . . 0.0 109.598 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.5 115.65 4.36 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 107.47 -2.252 . . . . 0.0 107.47 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.5 p -71.08 130.13 34.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.9 mt -94.34 -42.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 -178.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -147.57 138.48 23.47 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.441 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.597 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 . . . . . 0 N--CA 1.461 0.122 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -125.64 139.31 53.67 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.857 -1.065 . . . . 0.0 112.919 -172.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 80.8 mt -135.03 133.81 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -112.14 135.61 52.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -131.14 129.95 42.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -83.92 132.73 34.75 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.26 118.85 71.02 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -76.81 -23.99 10.44 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 117.408 -1.261 . . . . 0.0 115.089 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -75.49 -17.95 59.97 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -177.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt 61.03 37.77 17.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.484 1.135 . . . . 0.0 110.266 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -173.34 0.07 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 112.754 -2.021 . . . . 0.0 110.653 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.8 p -49.88 -42.61 48.21 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 89.1 m-70 -78.8 138.25 38.11 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.068 0.461 . . . . 0.0 111.168 174.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -101.71 -37.2 8.43 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.058 176.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.4 mt -139.78 163.79 31.67 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -172.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -131.52 134.95 60.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 174.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -119.57 113.72 21.15 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 84.9 mt -95.61 125.0 39.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -136.35 130.47 32.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.624 0.193 . . . . 0.0 110.598 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -107.95 114.18 27.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.072 0.463 . . . . 0.0 109.959 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -151.64 142.71 23.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.105 -176.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -93.05 98.72 11.51 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -87.06 103.31 15.25 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.946 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -68.49 -42.6 78.42 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.784 0.802 . . . . 0.0 111.958 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -121.71 156.4 33.17 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.859 -0.525 . . . . 0.0 111.478 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -66.73 -16.06 63.98 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.147 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -63.74 -40.16 96.06 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -69.96 -36.73 75.48 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 55.7 ttm -61.33 -50.24 73.74 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.86 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.7 m -70.09 -31.95 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.243 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 -66.9 -34.65 78.25 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.206 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -64.56 -33.97 77.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mm -71.84 -30.89 39.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 O-C-N 121.634 -0.666 . . . . 0.0 110.956 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -64.23 -40.34 95.85 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.38 -44.25 91.95 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 121.935 0.874 . . . . 0.0 109.21 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -62.68 -39.67 94.69 Favored 'General case' 0 C--O 1.206 -1.222 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.233 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.49 -40.44 82.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 118.998 0.817 . . . . 0.0 111.518 -177.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -66.8 -41.47 87.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.565 0.697 . . . . 0.0 109.832 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.78 -47.29 84.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.522 0.677 . . . . 0.0 110.141 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.86 -42.64 97.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.258 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.42 -31.7 72.07 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 119.97 1.259 . . . . 0.0 111.401 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -64.72 -44.1 91.31 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.2 t -68.99 -36.03 71.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.185 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ttp-105 -59.24 -35.2 73.24 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.801 -0.562 . . . . 0.0 110.687 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -62.11 -39.04 91.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -73.4 -39.86 64.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.378 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.28 -17.96 61.26 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.17 -2.98 32.82 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 116.163 1.225 . . . . 0.0 116.163 177.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -71.39 152.6 43.0 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.384 1.092 . . . . 0.0 108.681 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.62 -27.19 61.99 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.795 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -142.03 159.43 42.24 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -122.19 141.78 51.11 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 53.5 tttp -123.35 127.95 49.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.4 tp -129.3 123.71 32.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -86.46 109.43 19.06 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -98.84 127.54 44.79 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 22.7 t -124.21 113.5 36.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-O 121.169 0.509 . . . . 0.0 111.469 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -84.18 142.81 30.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.78 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.55 109.82 16.16 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 173.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.0 p -125.59 161.09 27.99 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -173.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.3 m -67.17 -49.28 65.29 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -148.72 156.88 42.97 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 101.798 -3.408 . . . . 0.0 101.798 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.29 159.19 86.05 Favored Pre-proline 0 C--N 1.313 -0.989 0 O-C-N 124.268 0.98 . . . . 0.0 109.294 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.16 154.12 29.82 Favored 'Trans proline' 0 C--N 1.353 0.765 0 N-CA-C 115.081 1.147 . . . . 0.0 115.081 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.1 m -63.26 -24.48 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 118.089 2.626 . . . . 0.0 118.089 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -155.44 145.03 21.2 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 t0 45.88 19.48 0.06 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 117.896 2.554 . . . . 0.0 117.896 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 29.9 p-90 -76.08 -23.54 55.01 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 120.864 -1.147 . . . . 0.0 111.967 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.65 -37.7 76.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -18.4 64.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 111.832 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.7 mm -72.93 -40.17 59.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.88 0.61 17.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.153 0.501 . . . . 0.0 111.566 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -111.85 3.13 17.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.426 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -122.17 155.87 34.89 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.293 0.568 . . . . 0.0 111.396 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -102.0 126.04 48.82 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -83.46 112.56 20.07 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -118.29 123.14 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.518 0.675 . . . . 0.0 112.337 -176.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -124.24 75.49 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.57 -112.32 4.89 Favored Glycine 0 C--O 1.226 -0.401 0 C-N-CA 119.912 -1.137 . . . . 0.0 111.504 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 50.9 p -72.85 11.92 0.6 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 87.5 t -127.83 140.51 48.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 -178.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.2 p -138.05 125.39 21.8 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 105.77 -1.937 . . . . 0.0 105.77 169.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -128.85 133.4 66.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -113.45 116.74 45.94 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.74 156.13 27.47 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 118.109 -0.794 . . . . 0.0 112.892 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -147.54 155.05 41.48 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 102.889 -3.004 . . . . 0.0 102.889 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 16.3 tt -145.98 138.58 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.262 0.553 . . . . 0.0 109.733 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 8.2 m -115.9 142.06 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.868 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 172.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.95 150.72 40.05 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.593 -2.373 . . . . 0.0 104.593 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.98 -22.68 64.99 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.339 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.0 p -72.83 -30.05 63.72 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -176.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 mtm -129.25 20.84 5.75 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.378 0.609 . . . . 0.0 110.593 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.4 tt -42.18 -42.49 3.02 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 116.817 2.154 . . . . 0.0 116.817 -173.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 52.4 ptt85 -62.82 -40.53 97.68 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.632 -0.667 . . . . 0.0 111.934 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -78.66 -40.11 35.0 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.705 0.764 . . . . 0.0 109.867 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -59.22 -42.72 91.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.484 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.3 mt -62.22 -43.5 98.68 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -75.35 -14.14 60.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.965 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.59 -39.74 62.03 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.417 HG13 ' CD1' ' A' ' 129' ' ' PHE . 5.7 p -95.8 -38.54 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . 0.417 ' CD1' HG13 ' A' ' 128' ' ' VAL . 49.1 m-85 -125.21 77.32 67.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 123.14 0.576 . . . . 0.0 110.393 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.49 -7.45 20.31 Favored 'Trans proline' 0 C--N 1.345 0.393 0 N-CA-C 114.211 0.812 . . . . 0.0 114.211 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.4 m -92.67 1.68 57.13 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -81.45 140.37 34.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.061 0.458 . . . . 0.0 110.237 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 . . . . . 0 C--N 1.327 -0.37 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.446 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 . . . . . 0 C--O 1.216 -0.672 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.19 81.4 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 122.057 -0.402 . . . . 0.0 110.188 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.43 -43.99 84.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 38.0 mmt -62.63 -36.7 83.64 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.412 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.25 -41.98 85.42 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.101 -0.374 . . . . 0.0 110.288 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -65.2 -50.41 66.0 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.791 0.329 . . . . 0.0 110.311 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -61.18 -41.86 97.54 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.378 0.608 . . . . 0.0 111.669 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -67.49 -36.49 81.2 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.84 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -62.33 -44.67 95.96 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.253 0.933 . . . . 0.0 111.365 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.61 -38.51 87.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 19.5 m -69.98 -35.2 74.25 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.448 0.642 . . . . 0.0 111.428 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.92 -37.7 86.76 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 123.794 0.838 . . . . 0.0 110.514 -178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.2 t -57.45 -47.29 85.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.321 -0.634 0 CA-C-O 121.487 0.66 . . . . 0.0 109.914 179.87 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.5 mm? . . . . . 0 C--O 1.215 -0.731 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.57 -33.22 75.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.359 0.599 . . . . 0.0 111.82 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.28 -30.07 71.28 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -62.06 -41.07 97.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.482 ' HA ' ' HE3' ' A' ' 10' ' ' LYS . 44.6 m -69.41 -44.11 72.06 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.461 -0.149 . . . . 0.0 110.973 176.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -52.35 -47.4 66.11 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.588 0.355 . . . . 0.0 110.557 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -67.8 -43.47 79.58 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 7' ' ' THR . 19.9 pttp -73.51 -25.31 60.37 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.029 -1.044 . . . . 0.0 112.243 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.0 mm -72.31 -38.6 61.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 174.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.23 -40.91 78.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.5 -42.67 99.14 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.504 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -34.18 75.92 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.745 -0.597 . . . . 0.0 112.45 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.8 -44.46 63.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.9 t -53.64 -42.73 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.149 171.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.51 -31.07 70.14 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.72 -0.613 . . . . 0.0 110.66 178.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.3 m -82.56 9.31 9.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.17 1.26 62.9 Favored Glycine 0 CA--C 1.517 0.173 0 N-CA-C 115.827 1.091 . . . . 0.0 115.827 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.429 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 32.7 m-85 -71.04 126.6 30.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.773 0.787 . . . . 0.0 109.662 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.23 113.72 3.78 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 107.338 -2.305 . . . . 0.0 107.338 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.9 p -70.31 128.67 33.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 75.8 mt -86.78 -38.84 12.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -144.16 134.64 24.68 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.594 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.977 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 . . . . . 0 C--O 1.232 0.174 0 N-CA-C 111.502 0.186 . . . . 0.0 111.502 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -135.11 137.18 42.56 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.4 mt -125.3 131.5 72.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -111.38 139.57 46.68 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.01 129.73 42.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.997 0.919 . . . . 0.0 108.742 -177.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -82.05 130.61 35.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.72 113.03 22.91 Favored Pre-proline 0 CA--C 1.549 0.904 0 CA-C-N 117.715 0.234 . . . . 0.0 110.486 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 88.0 Cg_endo -74.7 -18.71 19.32 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 117.825 -0.983 . . . . 0.0 113.36 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.84 -23.34 60.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.851 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.0 mttt 60.42 38.84 19.11 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.2 p -71.7 -177.63 1.98 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 112.963 -1.926 . . . . 0.0 112.103 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.9 m -61.26 -10.01 6.09 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.345 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.68 132.32 54.29 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.33 -40.56 10.85 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -174.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -139.16 162.12 35.73 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.59 135.47 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 35.0 ttt-85 -124.66 116.31 22.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.519 0.728 . . . . 0.0 109.828 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.31 132.15 36.35 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 103.39 -2.818 . . . . 0.0 103.39 175.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -136.53 136.03 39.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.826 0.285 . . . . 0.0 110.901 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.53 113.55 27.19 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.787 -0.571 . . . . 0.0 110.543 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -151.62 149.88 29.65 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -108.34 131.42 54.75 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.5 mt -124.1 120.62 32.9 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -171.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -88.49 -37.81 15.48 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.887 0.851 . . . . 0.0 111.585 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -129.67 144.71 51.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.727 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -64.33 -17.54 63.78 Favored 'General case' 0 C--O 1.215 -0.736 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -60.75 -33.33 72.77 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.518 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -77.65 -34.91 52.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.065 0.459 . . . . 0.0 110.209 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.0 ttt -60.81 -48.83 80.0 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.559 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.2 m -66.31 -31.84 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.433 0.635 . . . . 0.0 110.086 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -38.21 87.15 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.198 -177.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -62.36 -38.99 91.68 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.3 mm -68.66 -31.81 52.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.949 -0.47 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -61.66 -39.48 91.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -44.32 58.17 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.689 0.757 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -59.53 -39.74 84.92 Favored 'General case' 0 C--O 1.21 -0.989 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.097 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.86 90.65 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.576 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -70.92 -35.95 72.46 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 119.887 -0.725 . . . . 0.0 109.759 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.83 -44.77 96.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.2 t -66.9 -39.76 84.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -62.21 -33.53 74.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 119.654 1.116 . . . . 0.0 111.187 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.8 ttt-85 -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -69.03 -37.41 77.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.935 0.398 . . . . 0.0 110.014 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -41.35 88.13 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.855 -0.528 . . . . 0.0 111.052 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -66.79 -40.11 88.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -63.48 -40.19 96.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.022 0.439 . . . . 0.0 110.861 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -78.02 -13.96 59.68 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.65 1.47 38.06 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -68.36 156.28 38.1 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.008 -0.701 . . . . 0.0 110.082 -177.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -39.35 93.85 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -149.41 167.99 24.65 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 103.453 -2.795 . . . . 0.0 103.453 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 ttp -129.18 147.97 51.08 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 118.746 0.703 . . . . 0.0 109.979 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -116.33 123.7 48.27 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 123.521 0.513 . . . . 0.0 110.559 177.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.4 tp -116.87 128.12 54.94 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.253 0.346 . . . . 0.0 111.405 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -91.32 110.83 22.13 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -102.54 129.12 48.99 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 32.6 t -121.05 109.38 25.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -76.84 142.95 40.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -119.35 107.62 13.59 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 172.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 97.7 p -126.74 155.65 42.41 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.33 -171.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 18.2 m -67.09 -47.91 69.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -147.0 158.19 43.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.813 -2.662 . . . . 0.0 103.813 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.92 157.14 39.83 Favored Pre-proline 0 C--N 1.312 -1.025 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.087 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -55.08 143.73 72.53 Favored 'Trans proline' 0 C--N 1.347 0.46 0 N-CA-C 116.374 1.644 . . . . 0.0 116.374 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.47 -21.72 15.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.638 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -90.81 91.98 8.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.872 178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.9 t0 14.88 70.98 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 117.773 2.509 . . . . 0.0 117.773 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -74.01 -16.85 61.04 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.608 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.75 -35.22 79.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.224 -0.298 . . . . 0.0 110.553 -175.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -60.81 -23.54 65.14 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.825 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.1 mm -79.04 -44.46 24.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 -176.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.04 -1.58 23.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.256 0.55 . . . . 0.0 111.917 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -108.59 5.35 24.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.503 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -124.72 132.27 53.39 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.153 0.502 . . . . 0.0 110.872 178.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -77.68 125.2 28.98 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 173.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -82.71 120.6 25.79 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -126.23 127.64 45.97 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.793 0.806 . . . . 0.0 110.008 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -139.3 114.71 9.79 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 60.21 -126.45 41.49 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 119.968 -1.11 . . . . 0.0 111.439 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.0 p -96.3 29.05 2.98 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.11 -0.641 . . . . 0.0 111.065 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 48.5 t -124.61 145.52 31.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.852 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.9 m -132.6 134.95 45.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.66 138.95 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.786 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 109.06 60.48 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -87.94 63.95 3.55 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.151 2.567 . . . . 0.0 117.171 -175.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 156.68 38.98 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.819 -0.551 . . . . 0.0 110.589 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -147.91 142.36 19.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 O-C-N 121.887 -0.508 . . . . 0.0 110.116 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.4 t -117.69 120.84 65.93 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.29 136.22 40.52 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.303 0.573 . . . . 0.0 109.857 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.45 -34.93 91.23 Favored Glycine 0 CA--C 1.51 -0.232 0 N-CA-C 114.868 0.707 . . . . 0.0 114.868 -176.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.2 t -53.16 -26.8 18.31 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.9 ptm -140.56 32.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.634 0.73 . . . . 0.0 109.808 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -46.64 -36.55 7.13 Favored 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 mtm180 -58.36 -46.99 85.23 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 121.496 -0.752 . . . . 0.0 111.175 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -78.65 -38.66 38.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.103 0.954 . . . . 0.0 111.922 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.63 -35.43 72.93 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.37 -41.05 73.61 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.887 -0.508 . . . . 0.0 110.684 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -69.3 -16.14 63.5 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.629 -177.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.82 65.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.067 0.461 . . . . 0.0 109.836 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.8 t -97.57 -43.84 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.457 0.646 . . . . 0.0 110.643 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -129.47 78.14 76.15 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.113 -178.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.05 -12.67 34.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 CA-C-O 121.381 0.492 . . . . 0.0 112.998 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -11.59 59.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -94.92 124.93 39.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.215 0.531 . . . . 0.0 111.164 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 . . . . . 0 C--N 1.324 -0.532 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.687 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 m120 . . . . . 0 C--O 1.22 -0.497 0 CA-C-O 120.044 -0.027 . . . . 0.0 110.935 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.21 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.625 0.25 . . . . 0.0 110.567 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -66.38 -35.53 80.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.499 0.666 . . . . 0.0 109.348 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 77.0 mtp -71.04 -30.8 67.08 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.787 -0.571 . . . . 0.0 109.998 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -70.95 -30.41 66.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -61.19 -52.22 65.73 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.4 -37.2 86.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.536 0.684 . . . . 0.0 110.449 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -60.01 -46.87 88.06 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.036 176.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -65.88 -41.86 91.07 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.97 -36.88 82.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 29.3 m -76.12 -32.94 59.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.56 0.695 . . . . 0.0 112.21 176.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -62.31 -42.78 99.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -176.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.5 p -57.73 -39.18 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.829 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 110.027 176.837 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp . . . . . 0 C--O 1.222 -0.384 0 CA-C-O 121.1 0.476 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.29 -35.35 78.75 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.81 -27.44 68.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.073 0.464 . . . . 0.0 110.222 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -65.13 -50.67 65.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -64.47 -39.79 94.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.256 0.551 . . . . 0.0 110.309 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -55.42 -52.44 63.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.318 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -71.54 -27.1 62.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.346 -0.846 . . . . 0.0 111.964 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -64.97 -39.52 93.6 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 22.2 mm -71.85 -38.2 64.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 178.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.49 -44.89 81.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 176.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.73 93.23 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.674 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -59.32 -47.03 86.94 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 122.747 0.419 . . . . 0.0 111.585 -179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.7 mt -68.39 -47.31 67.66 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.698 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -57.84 -39.77 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.886 -0.509 . . . . 0.0 110.519 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.32 -25.56 67.95 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 121.871 -0.518 . . . . 0.0 111.276 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -84.77 4.89 30.75 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.796 0.438 . . . . 0.0 111.366 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.14 -1.68 47.38 Favored Glycine 0 CA--C 1.518 0.249 0 N-CA-C 115.939 1.135 . . . . 0.0 115.939 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.452 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.3 m-85 -65.78 129.17 38.84 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 117.736 0.768 . . . . 0.0 110.864 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.3 134.88 13.69 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.6 t -79.38 122.4 34.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 76.7 mt -90.73 -44.96 14.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 176.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -155.0 146.24 22.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 177.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.357 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 178.739 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 . . . . . 0 N--CA 1.465 0.311 0 CA-C-O 120.838 0.351 . . . . 0.0 110.393 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -129.09 151.75 49.43 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.2 mt -134.54 134.78 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -115.1 131.58 56.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -127.62 132.93 49.7 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.655 0.782 . . . . 0.0 109.908 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -86.22 134.84 33.75 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.13 109.75 13.67 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.5 Cg_endo -74.38 -24.41 14.25 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 117.889 -0.941 . . . . 0.0 114.054 -174.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -74.88 -4.45 37.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.859 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt 44.02 40.4 3.35 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 122.948 1.356 . . . . 0.0 111.875 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.3 m -67.21 -172.96 0.24 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 112.621 -2.081 . . . . 0.0 110.613 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.9 t -50.35 -35.72 29.12 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -83.3 138.95 33.34 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 173.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -98.04 -37.84 9.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -142.39 161.59 37.65 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.853 -175.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.5 t -132.55 136.25 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -122.11 130.18 53.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 176.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.06 128.72 54.62 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -136.43 143.56 43.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.87 99.81 6.32 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -151.69 149.47 29.13 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.49 151.56 20.72 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -133.18 124.54 27.63 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.275 0.23 . . . . 0.0 111.468 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -75.96 -42.7 47.7 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -136.04 151.03 49.43 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.203 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -63.98 -18.72 64.57 Favored 'General case' 0 C--O 1.212 -0.881 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -60.61 -33.17 72.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -77.22 -40.92 43.26 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.65 -40.88 89.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.0 -31.85 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 O-C-N 121.79 -0.569 . . . . 0.0 111.256 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -70.65 -34.62 72.24 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.628 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -59.32 -38.66 80.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mm -71.63 -31.31 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 121.99 -0.444 . . . . 0.0 111.457 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -63.07 -39.61 95.22 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -68.19 -45.41 73.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.705 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -58.05 -45.11 87.55 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.189 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.79 -31.18 69.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.56 -45.43 68.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.339 0.59 . . . . 0.0 109.454 177.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -61.51 -44.06 97.74 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.83 0.824 . . . . 0.0 109.299 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 73.6 t -65.73 -32.81 59.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.427 -178.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 121.764 -0.585 . . . . 0.0 109.434 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -62.16 -46.03 90.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.96 0.41 . . . . 0.0 110.273 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 79.7 t -61.74 -40.43 86.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.888 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.412 HH21 ' HB2' ' A' ' 75' ' ' LEU . 2.7 tpm_? -66.48 -40.26 89.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.16 -0.963 . . . . 0.0 111.877 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -55.47 -46.07 76.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -73.41 -18.79 61.11 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.412 ' HB2' HH21 ' A' ' 72' ' ' ARG . 97.3 mt -99.27 -10.04 22.88 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -177.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.81 -1.53 5.71 Favored Glycine 0 CA--C 1.531 1.052 0 N-CA-C 120.935 3.134 . . . . 0.0 120.935 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -67.9 154.19 42.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.161 1.481 . . . . 0.0 108.107 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -65.44 -29.51 70.2 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 ttt85 -151.41 147.92 27.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.48 150.32 23.5 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -134.43 122.22 22.21 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 168.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -124.0 129.74 51.42 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.8 tp -92.29 121.84 34.19 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -115.81 108.57 16.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 5.4 t -108.45 117.34 53.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -84.68 150.58 25.03 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -129.05 116.77 19.81 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -139.59 158.24 44.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.97 0.414 . . . . 0.0 111.887 -174.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 55.0 m -69.23 -49.23 58.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -128.28 170.43 13.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.67 154.17 43.3 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.75 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.15 146.17 89.43 Favored 'Trans proline' 0 C--N 1.348 0.551 0 N-CA-C 114.579 0.953 . . . . 0.0 114.579 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.9 m -82.17 -6.01 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -113.14 100.43 8.59 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.438 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.4 t0 14.43 60.41 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 117.981 2.585 . . . . 0.0 117.981 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 p-90 -73.1 -17.45 61.4 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.99 -32.45 73.99 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.03 -28.38 67.7 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.178 0.514 . . . . 0.0 110.137 175.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.1 mm -75.37 -40.66 42.7 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 O-C-N 122.013 -0.429 . . . . 0.0 110.588 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.11 62.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 122.138 0.97 . . . . 0.0 109.306 177.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -88.6 -3.02 58.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.849 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -126.38 130.39 50.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.754 0.788 . . . . 0.0 112.296 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.3 m -76.41 125.62 29.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -83.3 123.08 29.27 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 176.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -127.65 139.19 52.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.774 0.797 . . . . 0.0 111.649 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -139.97 82.06 1.85 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.627 -1.17 . . . . 0.0 108.928 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.06 -112.66 5.02 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 119.698 -1.239 . . . . 0.0 111.726 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 p -86.2 8.69 20.13 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.76 0.424 . . . . 0.0 111.281 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -110.0 141.37 25.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 122.574 0.35 . . . . 0.0 110.637 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.0 t -135.46 137.4 42.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.104 -2.924 . . . . 0.0 103.104 171.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 99.8 t -133.77 136.5 53.99 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -105.03 104.18 45.51 Favored Pre-proline 0 N--CA 1.433 -1.321 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.467 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.99 147.71 24.2 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 117.387 -1.275 . . . . 0.0 112.191 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 155.91 39.9 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.9 tt -149.81 142.16 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.093 -1.817 . . . . 0.0 106.093 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.35 103.84 15.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.64 138.47 31.44 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.43 -22.92 66.14 Favored Glycine 0 C--N 1.321 -0.29 0 CA-C-N 116.072 -0.513 . . . . 0.0 113.977 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 119' ' ' THR . 22.0 p -59.21 -29.27 67.37 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -177.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.4 ptm -144.65 36.52 1.18 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 109.261 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -44.61 -40.35 5.72 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -173.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -58.24 -51.45 69.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 118.387 0.54 . . . . 0.0 111.411 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -76.99 -34.88 57.49 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.327 0.584 . . . . 0.0 112.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -67.43 -36.27 80.91 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.596 0.712 . . . . 0.0 111.707 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.85 -44.1 77.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.169 -179.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -71.88 -14.29 61.9 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.321 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.23 -26.42 62.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.442 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.1 p -108.73 -37.83 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 120.635 0.255 . . . . 0.0 111.465 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -125.19 75.29 67.92 Favored Pre-proline 0 CA--C 1.536 0.421 0 O-C-N 121.863 -0.523 . . . . 0.0 111.289 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.22 -7.42 21.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 N-CA-C 114.724 1.009 . . . . 0.0 114.724 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 20.3 t -85.85 -5.82 59.18 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.971 -0.456 . . . . 0.0 111.039 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -89.37 130.86 35.67 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 71.8 mtm-85 . . . . . 0 C--N 1.325 -0.487 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 -178.662 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 . . . . . 0 C--O 1.214 -0.768 0 CA-C-O 121.048 0.451 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.78 -35.86 64.28 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 111.905 176.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.61 -43.09 73.45 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 121.954 -0.466 . . . . 0.0 109.816 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 33.3 mmt -64.56 -33.24 75.44 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.87 79.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.222 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -68.06 -43.83 77.75 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -65.89 -39.43 90.63 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.5 0.667 . . . . 0.0 110.372 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -62.92 -38.8 92.43 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -64.71 -40.33 95.17 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 0.0 111.86 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 30.3 mt -64.54 -36.58 84.68 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 122.12 -0.363 . . . . 0.0 111.059 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 7.6 p -76.06 -32.17 59.17 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.585 -0.697 . . . . 0.0 111.281 174.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -42.62 98.09 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 p -58.99 -39.2 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.413 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.329 -0.314 0 O-C-N 121.473 -0.767 . . . . 0.0 110.192 177.851 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.5 tp . . . . . 0 N--CA 1.47 0.571 0 CA-C-O 121.677 0.751 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.9 mt -73.67 -37.06 65.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.39 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.69 -34.03 77.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.631 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -59.33 -50.58 73.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 m -66.0 -41.9 90.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.89 0.376 . . . . 0.0 111.283 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -57.21 -52.13 66.57 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.113 0.565 . . . . 0.0 111.95 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.402 ' CZ3' HD11 ' A' ' 31' ' ' ILE . 92.6 m95 -70.8 -30.98 67.58 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.807 -0.558 . . . . 0.0 110.656 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -69.59 -38.15 77.21 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.874 -0.516 . . . . 0.0 111.693 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.4 HD11 HD11 ' A' ' 125' ' ' LEU . 12.0 mm -70.39 -36.51 67.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.33 -43.03 83.02 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.83 -44.82 84.4 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -59.08 -45.05 91.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.228 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.6 mt -69.23 -47.61 64.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.0 p -62.4 -29.03 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.362 177.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.4 -24.94 61.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 177.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 t -87.84 8.83 24.15 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.501 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.74 2.41 61.37 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 116.79 1.476 . . . . 0.0 116.79 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.411 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 6.9 m-85 -72.48 113.05 9.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 118.182 0.991 . . . . 0.0 109.458 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.54 126.0 24.15 Favored Glycine 0 C--O 1.226 -0.39 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.538 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 70.9 t -76.42 121.95 29.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.6 mt -91.39 -42.09 13.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -153.11 145.0 23.61 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 118.273 0.488 . . . . 0.0 112.31 -179.51 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 . . . . . 0 N--CA 1.462 0.171 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -113.43 147.07 38.5 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.402 HD11 ' CZ3' ' A' ' 9' ' ' TRP . 96.6 mt -132.76 129.57 58.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 103.069 -2.938 . . . . 0.0 103.069 169.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -108.16 129.3 55.18 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.411 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -130.1 134.72 47.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -179.358 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -84.23 136.87 33.77 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -90.97 105.76 13.41 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 118.005 0.366 . . . . 0.0 111.194 -178.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -72.06 -17.31 28.4 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 118.402 -0.599 . . . . 0.0 112.892 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.33 -15.85 62.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.0 mtmt 58.12 38.95 26.51 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -175.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -62.57 -177.43 0.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 112.945 -1.934 . . . . 0.0 112.377 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.9 m -57.21 -10.66 1.33 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.034 0.534 . . . . 0.0 111.828 175.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -127.93 151.26 49.32 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -96.9 -31.2 12.69 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.083 0.468 . . . . 0.0 109.952 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -135.33 161.91 34.07 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.5 t -123.17 133.58 68.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 ttt-85 -117.31 108.78 16.02 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 174.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.7 mt -85.89 130.53 34.52 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 103.777 -2.675 . . . . 0.0 103.777 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -134.65 123.09 23.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 117.993 0.361 . . . . 0.0 111.267 -176.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -102.69 94.55 5.68 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.04 0.447 . . . . 0.0 111.582 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -151.24 139.73 20.53 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -92.65 151.6 20.01 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -134.64 119.85 18.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.68 -173.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -86.48 -37.58 18.13 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.71 0.767 . . . . 0.0 110.52 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.5 145.79 51.41 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.135 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.66 ' HD2' HD11 ' A' ' 99' ' ' ILE . 28.0 ptt180 -66.1 -20.74 66.26 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.097 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -64.09 -33.24 75.32 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.141 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -77.64 -35.25 52.73 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.475 -0.766 . . . . 0.0 109.21 175.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 18.5 ttt -58.26 -50.41 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.954 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 29.8 m -60.61 -31.87 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -69.11 -37.94 78.65 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -59.87 -41.71 92.11 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -71.78 -36.39 58.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 121.447 -0.783 . . . . 0.0 111.72 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -65.11 -30.72 71.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -76.53 -41.72 45.73 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.618 0.723 . . . . 0.0 109.564 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -58.06 -35.0 70.72 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.272 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.44 78.57 Favored 'General case' 0 C--N 1.319 -0.759 0 O-C-N 122.056 -0.403 . . . . 0.0 111.41 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -72.89 -36.02 67.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.609 0.719 . . . . 0.0 109.168 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -43.18 99.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.92 -38.42 81.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.49 -41.15 80.16 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.419 1.009 . . . . 0.0 110.243 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.55 -41.66 99.03 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.165 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 87.5 t -69.99 -46.43 73.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.454 0.645 . . . . 0.0 109.704 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.54 -40.1 78.1 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 111.131 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -63.33 -51.72 64.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.403 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -71.12 -22.26 62.1 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.08 -4.96 57.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.886 0.374 . . . . 0.0 110.51 175.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.82 13.71 64.24 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 114.289 0.475 . . . . 0.0 114.289 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -79.64 145.4 33.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.776 -0.838 . . . . 0.0 112.605 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.1 mtp85 -72.41 -32.89 66.74 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.882 177.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -153.13 150.8 29.45 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 177.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.3 ttp -131.59 150.58 52.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -117.74 139.25 51.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -135.16 131.62 37.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.378 0.535 . . . . 0.0 110.287 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.7 tp -93.55 122.28 35.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -110.57 108.45 18.41 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.6 t -105.23 105.6 18.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 120.897 0.38 . . . . 0.0 110.801 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -75.73 144.59 41.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 174.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -121.74 104.14 9.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 103.125 -2.916 . . . . 0.0 103.125 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -123.1 156.56 34.7 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.543 0.527 . . . . 0.0 110.149 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -67.06 -52.69 39.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 110.583 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.29 -179.41 4.73 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.99 141.8 23.23 Favored Pre-proline 0 C--N 1.317 -0.832 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -57.12 142.92 94.35 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 117.696 -1.069 . . . . 0.0 113.851 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.1 m -77.65 -10.25 12.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -173.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -110.04 56.21 0.63 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.3 t0 61.76 52.53 3.48 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 123.238 1.494 . . . . 0.0 114.882 174.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -65.45 -17.88 64.89 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.349 -0.844 . . . . 0.0 112.69 175.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -58.81 -37.4 76.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -173.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.9 -18.61 65.46 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.66 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.3 mm -73.02 -37.87 54.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.11 -25.08 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.427 0.632 . . . . 0.0 110.438 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -89.15 3.14 52.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.184 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -116.95 98.49 6.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.31 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 47.1 m -68.53 126.11 28.61 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 172.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -86.25 108.44 18.38 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -110.31 101.39 10.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.76 0.79 . . . . 0.0 113.013 -176.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.2 tttm -99.48 75.58 1.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.76 -108.35 2.08 Favored Glycine 0 C--O 1.228 -0.238 0 C-N-CA 119.529 -1.319 . . . . 0.0 112.568 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 52.0 p -72.4 9.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.535 1.134 . . . . 0.0 112.965 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 99.3 t -129.49 144.82 36.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 C-N-CA 122.796 0.438 . . . . 0.0 110.471 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.0 t -136.34 118.32 15.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -118.79 126.39 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.471 -2.075 0 CA-C-O 122.74 1.257 . . . . 0.0 110.379 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -99.42 104.53 27.63 Favored Pre-proline 0 N--CA 1.419 -2.001 0 CA-C-N 111.4 -2.636 . . . . 0.0 109.474 -176.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -80.27 149.47 19.45 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 117.843 -0.971 . . . . 0.0 113.973 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.32 149.84 31.55 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.0 tt -142.72 123.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.1 t -102.57 107.84 22.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 136.16 33.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -60.7 -33.58 83.08 Favored Glycine 0 CA--C 1.511 -0.182 0 N-CA-C 114.908 0.723 . . . . 0.0 114.908 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.5 t -56.05 -23.88 36.19 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.5 ptm -140.97 35.83 1.75 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.586 1.184 . . . . 0.0 109.44 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.81 -41.94 34.39 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 -171.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -61.52 -51.36 68.93 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.16 1.8 . . . . 0.0 111.387 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -73.69 -32.94 64.2 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.828 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -72.73 -39.92 66.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.889 0.852 . . . . 0.0 111.309 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 11' ' ' ILE . 3.5 tm? -68.22 -43.47 77.93 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.751 -0.593 . . . . 0.0 110.491 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.424 -177.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.41 -32.03 62.54 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.4 t -91.21 -43.64 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.367 0.603 . . . . 0.0 110.157 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -127.39 79.61 73.0 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.036 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.6 -13.85 38.19 Favored 'Trans proline' 0 C--N 1.347 0.456 0 N-CA-C 114.535 0.937 . . . . 0.0 114.535 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.6 m -84.47 -2.46 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -76.83 137.29 39.11 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.447 0.641 . . . . 0.0 111.183 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 . . . . . 0 C--N 1.325 -0.465 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.76 178.616 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 57.8 t30 . . . . . 0 CA--C 1.533 0.311 0 CA-C-O 120.988 0.423 . . . . 0.0 110.866 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.92 -38.06 72.93 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.286 -0.259 . . . . 0.0 110.705 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -64.03 -45.73 87.6 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtt -62.69 -28.95 70.3 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.675 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.08 -34.49 73.53 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 121.63 -0.669 . . . . 0.0 111.115 -178.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -66.37 -45.64 79.42 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -67.1 -38.03 84.96 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.259 0.552 . . . . 0.0 110.375 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 60.3 mtt85 -61.86 -43.49 98.73 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -63.88 -42.17 97.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 118.515 0.598 . . . . 0.0 111.887 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.5 -36.36 83.95 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 122.092 -0.38 . . . . 0.0 111.648 -178.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 10.6 p -76.14 -35.66 59.14 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.321 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -41.24 95.38 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.69 0.796 . . . . 0.0 112.837 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -63.13 -38.25 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 118.753 0.706 . . . . 0.0 111.349 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 N--CA 1.467 0.402 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.406 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 C--O 1.224 -0.28 0 CA-C-O 120.914 0.387 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 22.4 tp -60.65 -48.11 83.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.821 0.343 . . . . 0.0 110.491 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -73.75 -30.63 62.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.443 0.64 . . . . 0.0 110.804 -178.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -61.62 -43.0 99.67 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.9 m -66.34 -44.31 83.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.778 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -53.05 -55.43 23.82 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -68.59 -35.66 77.66 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.527 -0.733 . . . . 0.0 112.858 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -74.88 -25.24 58.81 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.113 -0.992 . . . . 0.0 112.515 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.567 HD11 HD11 ' A' ' 125' ' ' LEU . 7.4 mm -67.76 -40.78 84.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.96 -40.29 80.21 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -41.95 96.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.392 177.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -63.54 -42.33 98.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.585 0.231 . . . . 0.0 110.539 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -65.2 -45.74 83.56 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.4 t -60.48 -40.11 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.101 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -62.16 -30.63 71.19 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.664 -0.647 . . . . 0.0 110.623 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.8 m -80.39 11.41 3.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.926 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.14 3.19 63.71 Favored Glycine 0 C--O 1.229 -0.194 0 N-CA-C 115.296 0.879 . . . . 0.0 115.296 175.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.454 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 16.5 m-85 -68.8 126.4 29.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.024 0.912 . . . . 0.0 110.361 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 134.89 13.75 Favored Glycine 0 C--O 1.225 -0.445 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.57 119.18 24.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 O-C-N 122.013 -0.698 . . . . 0.0 110.142 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 77.2 mt -89.41 -46.03 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -149.76 120.37 7.49 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.285 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.599 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 173.665 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 . . . . . 0 C--O 1.22 -0.473 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -144.73 142.97 30.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.36 0.982 . . . . 0.0 113.445 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.8 mt -136.5 125.98 38.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -107.77 123.87 49.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.454 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.3 mm? -124.15 128.58 49.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -83.0 132.22 35.15 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.56 123.52 89.64 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.67 -19.51 24.21 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 116.955 -1.563 . . . . 0.0 112.943 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -66.07 -33.87 76.78 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 56.75 27.38 12.66 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.65 1.214 . . . . 0.0 110.638 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 t -79.46 -172.85 3.43 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 112.217 -2.265 . . . . 0.0 106.347 176.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.7 m -41.75 -25.45 0.06 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -110.38 127.27 55.0 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 169.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -91.01 -32.42 15.93 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.62 166.42 32.15 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.36 136.67 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.2 ttt180 -112.64 111.28 21.98 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -81.47 128.53 33.98 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 101.917 -3.364 . . . . 0.0 101.917 173.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -136.13 114.89 12.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.732 -176.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tttm -87.38 94.66 9.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -151.7 136.41 17.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.264 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -97.26 147.24 24.33 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 175.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.97 134.61 47.56 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -92.25 -39.93 11.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -120.39 147.84 44.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.634 0.73 . . . . 0.0 112.418 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -61.3 -21.26 63.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.48 -33.25 74.73 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.961 -0.462 . . . . 0.0 109.8 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -68.24 -37.59 80.95 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 54.1 ttm -61.94 -46.5 89.03 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.67 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.1 m -68.02 -36.62 76.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.745 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -26.43 62.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.862 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -65.15 -34.5 78.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -72.08 -30.87 37.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.495 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.63 -40.17 93.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -67.91 -44.85 75.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.864 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -61.02 -38.76 87.21 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.465 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.71 76.03 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -68.87 -37.04 78.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.244 0.545 . . . . 0.0 109.917 177.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -64.21 -42.3 96.67 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.511 HG11 HG13 ' A' ' 109' ' ' VAL . 44.9 t -62.29 -40.41 87.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.066 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.521 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -57.53 -36.1 71.15 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 119.108 0.867 . . . . 0.0 111.333 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -64.33 -45.95 85.59 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.531 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.72 -40.8 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.663 0.744 . . . . 0.0 110.248 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -39.83 78.56 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.348 0.659 . . . . 0.0 110.201 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -63.35 -47.57 81.59 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.487 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -73.36 -23.01 60.15 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.989 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.3 -11.88 57.25 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.668 0.271 . . . . 0.0 111.353 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.21 17.6 68.32 Favored Glycine 0 CA--C 1.52 0.401 0 CA-C-O 121.55 0.528 . . . . 0.0 112.482 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 mmt-85 -69.62 136.95 51.85 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.113 -0.64 . . . . 0.0 111.503 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -72.09 -32.04 66.63 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -152.32 145.34 24.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 N-CA-C 102.536 -3.135 . . . . 0.0 102.536 173.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.1 ttp -125.36 143.04 51.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -178.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -120.58 129.79 53.92 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -117.64 134.06 55.29 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.021 -176.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.87 124.9 38.18 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -112.06 128.27 56.14 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 121.905 -0.497 . . . . 0.0 109.793 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.65 105.85 17.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -75.14 136.58 41.07 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -111.99 108.36 17.66 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 173.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -126.39 158.52 35.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.71 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.9 t -80.01 -28.9 39.36 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.632 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -155.41 167.11 31.44 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.85 158.83 41.54 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 122.669 0.388 . . . . 0.0 111.174 -175.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.41 153.17 42.47 Favored 'Trans proline' 0 C--N 1.355 0.898 0 O-C-N 122.178 0.567 . . . . 0.0 112.871 175.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -62.72 -29.69 47.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -157.41 151.61 24.76 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.8 t0 49.8 15.89 0.18 Allowed 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 27.7 p-90 -76.81 -25.21 53.01 Favored 'General case' 0 C--O 1.216 -0.669 0 O-C-N 121.118 -0.989 . . . . 0.0 110.741 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.05 -31.93 72.39 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 121.989 -0.444 . . . . 0.0 111.783 -175.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.59 -17.71 62.9 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.128 0.49 . . . . 0.0 110.823 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.8 mm -75.87 -36.12 31.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -70.22 -17.51 63.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.074 0.464 . . . . 0.0 111.341 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -96.34 2.71 52.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -121.48 138.42 54.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.434 0.635 . . . . 0.0 111.013 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 62.4 m -80.59 125.88 30.55 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -82.66 130.49 35.13 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 105.084 -2.191 . . . . 0.0 105.084 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -129.6 137.11 50.52 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.557 0.694 . . . . 0.0 112.448 -178.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -132.6 75.59 1.64 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.15 -112.66 5.18 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.989 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.8 t -77.5 16.49 0.63 Allowed 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.68 0.752 . . . . 0.0 111.935 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.511 HG13 HG11 ' A' ' 68' ' ' VAL . 76.6 t -130.07 141.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 121.47 -0.769 . . . . 0.0 111.677 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 70.9 m -132.49 140.21 48.27 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -138.24 138.17 43.45 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.291 0 CA-C-O 121.566 0.698 . . . . 0.0 110.564 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.98 108.77 62.52 Favored Pre-proline 0 N--CA 1.435 -1.2 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.101 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.41 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 51.8 Cg_endo -78.83 155.33 26.83 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 115.363 -2.625 . . . . 0.0 112.132 176.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -153.13 153.42 32.75 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 102.269 -3.234 . . . . 0.0 102.269 175.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.4 tt -146.88 130.08 8.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.0 m -105.92 133.53 50.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 N-CA-C 104.473 -2.417 . . . . 0.0 104.473 172.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.82 136.18 53.14 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -55.21 -34.13 58.57 Favored Glycine 0 C--O 1.227 -0.332 0 N-CA-C 115.65 1.02 . . . . 0.0 115.65 -174.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.4 t -61.7 -17.08 54.2 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -141.49 25.44 2.02 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.665 0.745 . . . . 0.0 109.815 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -48.0 -39.78 20.61 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -170.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -58.72 -51.33 70.41 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.456 1.026 . . . . 0.0 111.729 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -73.76 -34.71 64.82 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.333 0.587 . . . . 0.0 111.585 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.91 -40.59 91.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.065 0.936 . . . . 0.0 111.789 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.567 HD11 HD11 ' A' ' 11' ' ' ILE . 2.7 tm? -67.54 -44.76 77.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.433 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -70.97 -13.75 62.12 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.164 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.82 -35.5 62.44 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 176.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.62 -36.8 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 120.632 0.253 . . . . 0.0 111.327 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -126.39 75.85 73.46 Favored Pre-proline 0 C--N 1.326 -0.422 0 O-C-N 122.079 -0.388 . . . . 0.0 110.755 177.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.95 -14.99 39.69 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 118.53 -0.513 . . . . 0.0 112.766 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 m -76.03 0.78 17.42 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.821 0.449 . . . . 0.0 112.008 178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -117.27 139.07 51.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 -179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 . . . . . 0 CA--C 1.514 -0.441 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.699 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.223 -0.314 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.03 -45.48 92.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.96 0.409 . . . . 0.0 110.727 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -63.7 -46.08 87.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.218 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 84.1 mtp -64.33 -29.46 70.54 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.089 -0.382 . . . . 0.0 110.947 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -34.9 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.716 -0.615 . . . . 0.0 110.672 178.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -66.45 -47.18 73.96 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -67.09 -38.88 86.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.541 0.686 . . . . 0.0 110.401 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.4 ttt-85 -60.64 -44.19 96.69 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.35 99.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 111.995 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -33.77 76.55 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.856 0.36 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -75.97 -35.26 59.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.751 0.786 . . . . 0.0 111.523 175.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -62.13 -43.57 98.55 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 124.041 0.936 . . . . 0.0 113.341 -176.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 4.3 p -57.4 -43.43 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.86 -176.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? . . . . . 0 C--N 1.326 -0.421 0 O-C-N 121.657 -0.652 . . . . 0.0 110.117 178.603 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.1 tt . . . . . 0 N--CA 1.471 0.599 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 53.6 tp -54.32 -35.25 62.47 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.609 0.718 . . . . 0.0 112.299 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 61.9 mt-10 -57.12 -25.03 58.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -178.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -51.81 -50.46 60.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.602 0.637 . . . . 0.0 110.714 177.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.0 m -68.56 -39.61 80.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.2 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -58.76 -57.29 13.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.113 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.401 ' CZ3' HD11 ' A' ' 31' ' ' ILE . 98.3 m95 -70.34 -31.55 68.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -70.09 -35.12 73.94 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.644 -1.222 . . . . 0.0 109.183 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 125' ' ' LEU . 1.2 mm -65.0 -44.78 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.16 -42.04 80.31 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.33 -41.28 98.89 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -62.73 -45.75 91.29 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -66.84 -51.89 50.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.194 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.7 t -56.28 -43.09 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.927 0.394 . . . . 0.0 110.306 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -71.28 -18.24 62.43 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.109 -0.994 . . . . 0.0 112.362 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.9 t -88.08 9.51 22.32 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.967 0.507 . . . . 0.0 110.734 177.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.28 0.24 57.03 Favored Glycine 0 CA--C 1.517 0.205 0 N-CA-C 116.135 1.214 . . . . 0.0 116.135 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.408 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 22.8 m-85 -69.93 107.43 3.57 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.73 133.26 34.88 Favored Glycine 0 CA--C 1.511 -0.211 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.212 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.5 t -75.95 125.02 35.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.518 HD11 HD22 ' A' ' 43' ' ' LEU . 52.4 mt -93.91 -46.05 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -147.79 133.37 18.78 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.409 -178.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.317 -0.805 0 N-CA-C 101.203 -3.629 . . . . 0.0 101.203 173.876 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 . . . . . 0 C--O 1.235 0.322 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.19 164.71 14.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.401 HD11 ' CZ3' ' A' ' 9' ' ' TRP . 52.1 mt -135.58 126.29 43.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 76.8 m95 -105.9 132.87 51.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 4.2 mp -133.72 145.16 49.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -98.66 150.14 22.08 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 125.64 88.02 Favored Pre-proline 0 CA--C 1.544 0.75 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.63 -29.06 13.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 116.939 -1.574 . . . . 0.0 113.242 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -73.52 -19.42 60.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.847 0.356 . . . . 0.0 110.744 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.1 mttm 53.89 43.34 31.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.103 1.43 . . . . 0.0 110.045 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.2 p -69.73 -177.71 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 112.237 -2.256 . . . . 0.0 108.737 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -46.82 -33.07 4.14 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.09 113.47 21.06 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 172.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -78.48 -44.86 23.48 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.359 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.518 HD22 HD11 ' A' ' 23' ' ' ILE . 24.4 mt -137.35 166.17 24.46 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -173.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.2 t -134.55 139.74 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.791 0.837 . . . . 0.0 109.497 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 -120.34 124.27 45.14 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -91.77 130.17 37.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 104.264 -2.495 . . . . 0.0 104.264 174.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -136.49 139.79 42.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -125.72 103.12 7.65 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.775 0.716 . . . . 0.0 111.906 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -149.05 138.81 21.91 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.31 145.78 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.498 HD13 ' HG2' ' A' ' 57' ' ' MET . 7.2 mt -129.02 126.24 39.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.46 0.171 . . . . 0.0 111.085 -173.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -90.17 -38.15 13.69 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.674 0.749 . . . . 0.0 110.637 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -133.42 151.27 51.79 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.787 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HD2' HD11 ' A' ' 99' ' ' ILE . 21.4 ptt-85 -65.34 -18.14 65.08 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -64.53 -33.33 75.65 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.787 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -69.29 -40.37 77.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.498 ' HG2' HD13 ' A' ' 51' ' ' LEU . 91.8 mtp -55.92 -47.95 76.57 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.149 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -64.15 -31.21 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.682 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -71.13 -41.37 70.6 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -57.46 -43.65 84.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.164 0.507 . . . . 0.0 110.629 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -68.03 -30.65 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.423 -176.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.94 73.82 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.92 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -73.71 -43.75 58.36 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -54.38 -39.1 66.89 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 175.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.29 93.79 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.042 0.837 . . . . 0.0 110.791 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -67.97 -42.39 80.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.516 0.674 . . . . 0.0 109.379 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -59.18 -42.38 90.68 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.6 -36.9 77.65 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.975 0 CA-C-O 118.833 -0.603 . . . . 0.0 110.558 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.0 -42.59 85.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.951 1.25 . . . . 0.0 109.391 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -65.91 -48.41 71.51 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.328 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.0 t -66.17 -35.8 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.264 0.554 . . . . 0.0 110.346 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -43.91 96.9 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 121.558 -0.714 . . . . 0.0 110.037 178.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -67.61 -39.3 84.75 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.396 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.91 -40.36 88.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.825 0.345 . . . . 0.0 111.477 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -91.83 0.54 57.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.85 19.71 65.72 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 115.746 1.058 . . . . 0.0 115.746 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -77.93 142.58 38.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.684 -0.892 . . . . 0.0 110.698 -176.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -63.65 -40.48 96.96 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.13 -0.356 . . . . 0.0 111.182 -178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.3 ptt-85 -144.91 160.37 41.41 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 102.09 -3.3 . . . . 0.0 102.09 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -135.09 145.9 48.37 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 119.568 1.076 . . . . 0.0 110.895 175.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 110' ' ' SER . 40.2 tttp -123.62 127.82 48.8 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.666 0.604 . . . . 0.0 109.671 174.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -122.5 132.64 54.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.814 -175.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.9 tp -92.79 123.66 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 174.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -115.6 108.5 16.49 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.3 t -105.08 112.92 40.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.107 0.254 . . . . 0.0 111.46 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.41 135.16 35.64 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 175.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -110.92 117.84 34.47 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.9 p -132.87 168.39 18.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -176.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.4 t -92.55 -28.95 16.44 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.64 161.73 39.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.36 149.88 39.13 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -177.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -64.35 151.14 86.67 Favored 'Trans proline' 0 C--N 1.346 0.418 0 O-C-N 122.34 0.652 . . . . 0.0 112.562 177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.0 m -77.76 -12.7 13.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 119.096 2.998 . . . . 0.0 119.096 -169.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.82 101.66 8.04 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 117.404 2.372 . . . . 0.0 117.404 -173.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 44.52 28.66 0.33 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 117.703 2.483 . . . . 0.0 117.703 172.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -63.11 -21.75 66.39 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -176.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -61.72 -31.27 71.42 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.746 -0.596 . . . . 0.0 110.774 -177.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.5 -28.09 69.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.082 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.474 HD11 ' HD2' ' A' ' 54' ' ' ARG . 7.4 mm -73.59 -35.81 45.7 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.75 71.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.444 0.64 . . . . 0.0 111.114 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.65 -24.42 59.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.293 0.568 . . . . 0.0 111.358 178.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -85.16 99.36 11.02 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -171.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 59.6 m -68.26 122.58 18.64 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 171.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.88 120.66 25.96 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -118.76 128.18 54.24 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.079 0.943 . . . . 0.0 110.474 -179.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -130.75 75.57 1.67 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.246 -1.343 . . . . 0.0 107.773 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.02 -112.63 5.0 Favored Glycine 0 C--O 1.219 -0.831 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.703 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.1 p -84.49 16.99 2.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -121.64 140.73 44.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.447 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 7.9 p -134.88 137.71 43.47 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -134.01 130.05 54.82 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.724 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -99.09 110.76 59.05 Favored Pre-proline 0 N--CA 1.432 -1.361 0 CA-C-N 114.424 -1.262 . . . . 0.0 107.979 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -79.64 149.95 21.32 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 117.417 -1.255 . . . . 0.0 111.597 179.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.84 150.69 29.59 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.9 tt -145.89 137.36 19.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 -178.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.0 m -119.83 133.79 65.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 103.559 -2.756 . . . . 0.0 103.559 175.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.38 136.21 53.9 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 -176.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -45.58 -43.35 10.95 Favored Glycine 0 N--CA 1.461 0.318 0 N-CA-C 116.915 1.526 . . . . 0.0 116.915 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.405 HG22 ' H ' ' A' ' 119' ' ' THR . 0.2 OUTLIER -53.25 -29.93 35.48 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -178.565 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.9 ptm -140.6 30.84 1.88 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 122.664 1.221 . . . . 0.0 109.624 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.06 -37.81 47.81 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -58.39 -40.83 83.43 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.621 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -78.44 -43.37 27.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.808 0.813 . . . . 0.0 111.105 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.66 -43.37 93.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.991 0.901 . . . . 0.0 112.196 -177.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.479 HD12 ' CD2' ' A' ' 132' ' ' PHE . 1.2 tm? -65.01 -42.06 94.79 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.27 -175.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -74.78 -18.39 60.48 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.72 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.72 -36.26 65.18 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 59.5 t -85.59 -40.19 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.427 0.632 . . . . 0.0 110.117 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -124.91 82.26 61.17 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.122 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -68.92 -4.54 13.65 Favored 'Trans proline' 0 C--N 1.347 0.462 0 N-CA-C 114.919 1.084 . . . . 0.0 114.919 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 35.4 p -80.53 -8.18 59.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.367 0.603 . . . . 0.0 109.628 175.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . 0.479 ' CD2' HD12 ' A' ' 125' ' ' LEU . 71.2 t80 -86.15 124.93 33.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.697 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 . . . . . 0 C--N 1.324 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.546 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 32.0 m120 . . . . . 0 C--O 1.219 -0.55 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.68 95.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.19 0.519 . . . . 0.0 111.117 177.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -44.23 92.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 48.7 mtp -69.03 -28.89 66.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.02 92.49 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.901 -0.499 . . . . 0.0 110.222 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.99 -46.73 80.21 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -60.33 -45.6 92.86 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.241 1.019 . . . . 0.0 110.373 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 22.2 ttm180 -65.48 -33.86 76.92 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.3 -42.75 92.74 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 121.224 -0.19 . . . . 0.0 110.905 177.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.18 -41.0 91.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 28.0 m -67.09 -35.36 79.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.562 0.696 . . . . 0.0 111.019 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tt -70.18 -33.76 72.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 39.9 t -58.36 -44.44 88.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--N 1.324 -0.519 0 C-N-CA 120.475 -0.49 . . . . 0.0 109.928 178.804 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.5 tt . . . . . 0 N--CA 1.471 0.62 0 CA-C-O 121.63 0.729 . . . . 0.0 110.276 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.35 -39.74 89.38 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.24 -38.15 90.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.712 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -62.24 -46.18 90.01 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 23.5 m -65.16 -43.23 92.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.047 0.451 . . . . 0.0 110.519 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.63 -53.94 51.76 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.384 0.673 . . . . 0.0 111.156 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -69.8 -27.41 64.87 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.956 -0.465 . . . . 0.0 111.679 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -71.13 -36.85 72.26 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.745 -0.597 . . . . 0.0 111.881 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.4 mm -67.84 -45.9 83.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.86 -45.86 74.61 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.9 91.96 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -34.74 76.58 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.684 -176.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -71.07 -52.18 20.92 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.531 178.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.0 m -60.1 -32.84 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.828 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -67.99 -23.96 65.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.417 . . . . 0.0 110.723 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 t -89.17 9.82 24.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.809 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.73 2.68 59.73 Favored Glycine 0 C--O 1.227 -0.293 0 N-CA-C 115.612 1.005 . . . . 0.0 115.612 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 15.5 m-85 -72.31 99.76 2.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.064 0.932 . . . . 0.0 109.402 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.76 134.36 40.99 Favored Glycine 0 CA--C 1.512 -0.125 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.819 -177.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.2 t -77.23 124.26 35.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 79.3 mt -90.09 -43.58 14.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -150.13 127.33 11.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.402 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.321 -0.674 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 170.551 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -140.45 144.51 36.13 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -176.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 87.7 mt -139.31 132.24 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -105.22 134.33 48.51 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -129.72 139.75 51.26 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.927 0.491 . . . . 0.0 110.294 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -86.93 140.47 29.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -92.44 105.61 14.96 Favored Pre-proline 0 CA--C 1.553 1.068 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 91.9 Cg_endo -72.76 -17.29 25.99 Favored 'Trans proline' 0 C--N 1.352 0.729 0 CA-C-N 118.431 0.475 . . . . 0.0 112.991 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -67.47 -16.41 64.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.751 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.9 mttt 54.49 42.37 31.38 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 122.67 1.224 . . . . 0.0 108.823 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.4 p -72.78 -175.04 1.59 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 112.884 -1.962 . . . . 0.0 109.637 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.5 m -52.35 -31.71 34.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.769 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -98.66 136.25 38.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.043 0.537 . . . . 0.0 109.62 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -83.34 -33.75 25.8 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.9 mt -135.01 158.03 45.39 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.619 -176.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.21 141.7 43.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -138.5 150.71 46.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.247 0.546 . . . . 0.0 111.079 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.1 mt -113.98 135.96 53.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -136.47 129.92 31.81 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.261 0.35 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -106.11 114.84 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -151.76 150.4 30.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -118.85 139.56 51.41 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 103.601 -2.74 . . . . 0.0 103.601 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -152.22 144.45 23.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -82.03 -35.15 29.1 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -133.3 154.52 50.63 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.461 ' HD2' HD11 ' A' ' 99' ' ' ILE . 28.5 ptt-85 -62.9 -17.87 62.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -61.77 -33.34 73.92 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.622 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.53 -39.1 67.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 ttp -61.84 -45.81 92.17 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.586 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.41 -33.35 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.22 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -65.05 -39.87 93.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.758 -178.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -57.87 -43.49 86.01 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.172 0.295 . . . . 0.0 110.421 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mt -74.07 -35.59 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.761 -0.587 . . . . 0.0 111.341 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.3 -39.0 78.19 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -76.61 -40.76 48.44 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.571 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.56 93.34 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.21 -33.93 76.56 Favored 'General case' 0 C--O 1.209 -1.036 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.66 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.19 -41.73 96.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.584 0.707 . . . . 0.0 109.75 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -63.61 -46.21 86.78 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.304 0.574 . . . . 0.0 109.697 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.4 t -65.24 -38.23 82.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.908 -177.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -58.6 -43.03 89.41 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -64.47 -42.05 96.15 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.177 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.9 t -65.7 -39.47 84.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.619 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.3 OUTLIER -61.93 -44.95 95.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.561 -0.712 . . . . 0.0 111.95 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.3 m80 -64.44 -31.54 72.79 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.484 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -66.73 -24.21 66.2 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.914 0.387 . . . . 0.0 111.325 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.7 mp -100.68 -17.64 16.9 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.52 6.94 59.89 Favored Glycine 0 CA--C 1.523 0.594 0 CA-C-O 121.574 0.541 . . . . 0.0 113.93 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 -71.37 140.8 50.31 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -59.14 -47.01 86.84 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -170.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -153.97 153.72 32.49 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.675 0.671 . . . . 0.0 110.609 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.469 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -102.19 164.13 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.654 0.782 . . . . 0.0 112.716 -178.349 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.6 mptt -148.2 129.01 14.28 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 101.389 -3.56 . . . . 0.0 101.389 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -139.57 128.11 22.99 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -174.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.6 tp -91.43 121.16 32.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -115.16 108.62 16.86 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 12.4 t -101.69 113.06 36.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -82.14 143.51 31.4 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 175.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -123.25 117.35 25.09 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 173.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.1 m -135.59 158.31 44.7 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 123.447 0.467 . . . . 0.0 111.522 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 52.3 m -68.16 -49.16 62.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-O 121.885 0.85 . . . . 0.0 108.844 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -144.31 158.77 43.56 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 103.142 -2.91 . . . . 0.0 103.142 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.76 155.94 53.0 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.959 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -63.61 154.11 70.96 Favored 'Trans proline' 0 C--N 1.346 0.404 0 O-C-N 122.208 0.583 . . . . 0.0 112.789 177.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.6 m -88.26 10.52 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -121.83 83.49 2.1 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 114.449 1.278 . . . . 0.0 114.449 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 31.09 45.0 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 118.005 2.594 . . . . 0.0 118.005 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -70.01 -15.37 63.01 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.43 -0.794 . . . . 0.0 111.48 179.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -64.38 -29.67 70.74 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.664 -0.648 . . . . 0.0 109.687 -178.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.444 ' HA ' ' HE2' ' A' ' 101' ' ' LYS . 78.0 mm-40 -67.29 -18.32 65.14 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.635 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.461 HD11 ' HD2' ' A' ' 54' ' ' ARG . 10.1 mm -87.16 -38.4 12.11 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.667 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.04 -39.57 82.39 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.419 0.628 . . . . 0.0 112.477 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 98' ' ' GLU . 48.0 pttt -89.63 3.79 51.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.763 -178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -102.22 107.19 18.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.805 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.5 m -68.31 123.19 20.07 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 175.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -85.65 125.35 33.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 178.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -125.89 127.32 45.82 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 121.688 0.756 . . . . 0.0 109.496 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -143.72 113.12 6.92 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.249 -178.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 55.39 -126.28 38.8 Favored Glycine 0 C--O 1.24 0.502 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.294 178.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.2 p -84.55 15.2 3.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.527 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.4 t -119.29 148.77 22.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.309 0.576 . . . . 0.0 112.216 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 t -139.31 140.07 37.48 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 100.598 -3.853 . . . . 0.0 100.598 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.8 t -136.29 133.94 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -101.07 111.68 63.82 Favored Pre-proline 0 C--O 1.244 0.781 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 174.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -78.2 153.37 28.09 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 117.058 -1.495 . . . . 0.0 111.376 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.61 151.63 34.1 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.61 137.56 16.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.1 t -116.87 107.9 23.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 177.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.21 141.17 28.86 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.65 -19.9 61.04 Favored Glycine 0 C--O 1.228 -0.28 0 N-CA-C 114.435 0.534 . . . . 0.0 114.435 -177.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 38.8 p -62.69 -29.47 70.67 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.631 0.975 . . . . 0.0 113.631 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.8 ptm -144.42 40.55 1.33 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.05 -43.63 30.57 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -173.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -43.8 97.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 119.069 0.849 . . . . 0.0 111.844 -176.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -73.68 -39.13 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.911 0.386 . . . . 0.0 111.232 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.47 -39.76 92.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.492 0.663 . . . . 0.0 110.445 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -63.71 -49.41 73.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.019 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -70.49 -15.45 62.8 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.881 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.61 64.61 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 31.7 t -91.86 -44.64 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 121.458 0.647 . . . . 0.0 110.689 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -124.97 77.98 66.21 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.123 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.2 -6.64 19.3 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 118.611 -0.459 . . . . 0.0 112.476 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 49.2 p -88.11 -5.72 58.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.677 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -79.2 124.15 28.08 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 . . . . . 0 C--N 1.323 -0.565 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.649 -179.455 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 . . . . . 0 C--O 1.22 -0.5 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.84 95.29 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.731 0.241 . . . . 0.0 110.629 178.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -64.25 -44.82 90.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.7 mtm -62.76 -29.97 71.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.862 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.3 83.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 177.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -64.8 -45.72 85.08 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.623 0.249 . . . . 0.0 110.426 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -60.03 -44.32 94.7 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.317 0.579 . . . . 0.0 110.556 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -69.78 -28.53 65.82 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.083 -0.385 . . . . 0.0 111.071 178.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -66.45 -37.48 85.24 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.13 -34.68 78.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.83 0.347 . . . . 0.0 110.127 178.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 m -74.23 -38.02 63.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.678 0.751 . . . . 0.0 110.551 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.65 -39.92 88.46 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.6 p -60.61 -34.84 60.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 CA-C-N 118.934 0.788 . . . . 0.0 110.278 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? . . . . . 0 C--N 1.328 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 108.914 176.329 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.148 0 CA-C-O 120.859 0.361 . . . . 25.0 110.979 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.4 mt -61.38 -35.91 78.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 25.0 110.884 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -51.96 -39.9 60.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.799 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -52.08 -39.54 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.87 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.928 HG21 HD21 ' A' ' 121' ' ' LEU . 0.2 OUTLIER -70.44 -54.31 12.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.092 -0.503 . . . . 25.0 111.118 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -51.9 -43.98 63.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 25.0 110.914 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -71.98 -34.65 69.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -55.34 28.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.908 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.452 HG22 HD23 ' A' ' 15' ' ' LEU . 42.1 mm -59.72 -37.4 70.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.251 -0.431 . . . . 25.0 111.093 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.26 -53.74 32.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 25.0 111.107 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.444 ' HB1' HD22 ' A' ' 157' ' ' LEU . . . -60.01 -35.63 75.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 25.0 111.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -61.27 -54.97 37.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.865 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.62 ' HB3' HD22 ' A' ' 33' ' ' LEU . 4.3 mm? -56.07 -55.31 34.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.932 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 95.1 t -53.27 -51.88 36.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.117 179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.522 HD22 HD11 ' A' ' 157' ' ' LEU . 28.0 t-20 -58.47 -33.72 70.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.923 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.69 -16.57 64.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.821 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 117.95 -24.91 8.65 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 25.0 112.445 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -51.2 103.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 25.0 110.833 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.34 149.79 34.94 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.705 -0.76 . . . . 25.0 112.516 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.577 HG11 ' HB2' ' A' ' 25' ' ' ALA . 21.8 t -90.29 106.71 17.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.814 0.34 . . . . 25.0 111.099 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.9 mt -69.53 -35.69 67.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 25.0 111.137 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -161.03 118.98 2.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.577 ' HB2' HG11 ' A' ' 22' ' ' VAL . . . . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 25.0 111.086 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.718 0.294 . . . . 25.0 110.801 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.13 128.83 18.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.871 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 78.1 mt -141.49 131.93 26.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.101 -0.5 . . . . 25.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.7 m95 -101.33 149.66 23.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 25.0 110.864 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.62 HD22 ' HB3' ' A' ' 15' ' ' LEU . 1.8 mt -140.74 116.74 10.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 25.0 110.913 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.553 ' HA ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -74.48 146.35 42.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 25.0 110.894 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.434 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . . . -103.42 104.11 39.49 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.677 0.751 . . . . 25.0 111.085 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 35' ' ' ALA . 54.0 Cg_endo -69.84 -32.22 18.65 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.636 2.224 . . . . 25.0 112.279 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -57.57 -27.02 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.306 -0.407 . . . . 25.0 110.858 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.9 mttt 66.07 44.65 2.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.907 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 p -83.91 -176.71 6.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.43 . . . . 25.0 110.806 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.42 -35.0 17.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 25.0 110.851 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.55 132.13 35.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.934 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . 0.682 ' O ' HD23 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.36 -65.26 0.95 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 25.0 110.937 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.682 HD23 ' O ' ' A' ' 42' ' ' ASP . 18.8 mt -138.37 166.66 23.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.949 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.37 129.23 73.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 25.0 111.093 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.431 ' HB2' HD11 ' A' ' 82' ' ' LEU . 42.4 ttt180 -115.95 146.67 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 25.0 110.859 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.3 tp -123.83 110.33 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 25.0 110.974 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -116.72 140.61 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.287 -0.415 . . . . 25.0 110.966 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -125.65 101.52 6.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.52 . . . . 25.0 110.889 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -144.08 148.76 35.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 25.0 110.898 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -78.82 146.05 33.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 25.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.0 129.62 36.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.927 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.63 -52.2 2.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.108 -0.496 . . . . 25.0 110.804 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -99.83 168.41 9.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 25.0 110.956 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -34.48 36.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.828 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -54.68 -34.92 62.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 25.0 110.957 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -65.78 -33.38 75.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 25.0 110.84 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.498 ' HG2' HG21 ' A' ' 99' ' ' ILE . 1.5 tpp -58.15 -52.91 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.839 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.593 HG13 HG12 ' A' ' 99' ' ' ILE . 24.8 m -68.86 -33.04 57.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.234 -0.439 . . . . 25.0 111.12 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -26.22 68.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 25.0 110.805 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -77.26 -29.98 54.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 25.0 110.884 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.457 HG21 ' HB2' ' A' ' 104' ' ' PHE . 8.1 mm -73.62 -43.26 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 25.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -29.12 16.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.271 -0.422 . . . . 25.0 110.887 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.76 -35.95 57.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 25.0 110.895 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.744 ' O ' HG23 ' A' ' 68' ' ' VAL . 1.1 mp0 -58.4 -51.43 69.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.468 . . . . 25.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.06 -35.9 48.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.154 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -61.74 -43.43 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.446 . . . . 25.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -35.52 58.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.277 -0.42 . . . . 25.0 110.866 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.948 HG11 HG13 ' A' ' 109' ' ' VAL . 81.1 t -52.79 -36.6 23.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 25.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -61.19 -36.1 78.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 25.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -48.41 81.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.898 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . 0.573 HG11 HD11 ' A' ' 43' ' ' LEU . 21.7 t -74.82 -41.49 46.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 25.0 111.188 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.83 -36.31 47.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.846 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -72.32 -35.94 68.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.825 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -47.28 53.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.43 . . . . 25.0 110.887 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.6 HD23 ' HD2' ' A' ' 77' ' ' ARG . 4.4 mp -70.88 -19.61 62.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 25.0 110.956 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.74 33.37 87.07 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.845 -0.693 . . . . 25.0 112.497 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.6 ' HD2' HD23 ' A' ' 75' ' ' LEU . 71.9 mtt-85 -103.63 176.17 5.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 25.0 110.847 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.444 ' O ' HG22 ' A' ' 108' ' ' THR . 0.1 OUTLIER -85.29 -52.96 5.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.935 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -127.03 144.77 50.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.116 -0.493 . . . . 25.0 110.805 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.561 ' HB3' HG13 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -116.83 111.57 19.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.854 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -82.08 119.18 23.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.914 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.431 HD11 ' HB2' ' A' ' 45' ' ' ARG . 5.7 tt -130.7 135.18 47.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.904 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.4 tp -99.43 107.44 19.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 25.0 110.896 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.408 ' O ' ' HB3' ' A' ' 114' ' ' ALA . 1.7 t30 -105.36 108.89 20.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 25.0 110.87 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.569 ' CG1' HG23 ' A' ' 116' ' ' VAL . 21.8 t -106.41 146.43 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 25.0 111.174 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -108.16 137.59 45.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -114.12 103.66 11.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 25.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 p -131.06 169.25 16.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.862 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.8 t -67.09 -35.29 79.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 25.0 111.126 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -162.78 176.03 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.434 . . . . 25.0 110.853 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.603 ' HB1' ' HD2' ' A' ' 92' ' ' PRO . . . -73.68 161.34 79.24 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.533 0.683 . . . . 25.0 111.099 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.603 ' HD2' ' HB1' ' A' ' 91' ' ' ALA . 53.1 Cg_endo -69.92 176.86 6.32 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.651 2.234 . . . . 25.0 112.324 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.441 HG23 ' N ' ' A' ' 94' ' ' ASP . 10.6 m -51.46 -47.36 35.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.109 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.441 ' N ' HG23 ' A' ' 93' ' ' VAL . 0.2 OUTLIER 171.92 -172.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 25.0 110.868 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 57.48 38.79 28.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.43 ' HZ3' ' HB2' ' A' ' 100' ' ' ALA . 18.2 p-90 -120.57 -32.2 4.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 25.0 110.907 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -51.83 -35.28 43.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.861 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.87 -40.24 96.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 25.0 110.858 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.593 HG12 HG13 ' A' ' 58' ' ' VAL . 2.4 mp -65.02 -47.77 86.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 25.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.43 ' HB2' ' HZ3' ' A' ' 96' ' ' TRP . . . -50.9 -30.35 14.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 25.0 111.087 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.55 -38.19 12.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.944 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.28 139.88 58.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 25.0 110.921 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.9 m -101.89 143.66 31.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.44 . . . . 25.0 111.183 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.457 ' HB2' HG21 ' A' ' 61' ' ' ILE . 7.9 t80 -97.14 104.28 16.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.858 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -112.92 100.97 9.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 25.0 110.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -101.74 86.81 3.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.43 -112.43 4.97 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.726 -0.749 . . . . 25.0 112.458 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . 0.444 HG22 ' O ' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -95.0 30.01 2.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.355 . . . . 25.0 111.252 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.948 HG13 HG11 ' A' ' 68' ' ' VAL . 18.3 t -119.39 151.82 21.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 25.0 111.043 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 36.2 p -137.05 112.55 9.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.044 -0.526 . . . . 25.0 110.794 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -142.81 139.1 28.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.041 -0.527 . . . . 25.0 111.101 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -116.32 136.0 22.97 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.691 0.758 . . . . 25.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 149.16 66.24 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.669 2.246 . . . . 25.0 112.317 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' A' ' 85' ' ' VAL . . . -152.72 136.56 16.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.279 -0.418 . . . . 25.0 111.119 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.1 tt -138.83 144.21 30.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.159 -0.473 . . . . 25.0 111.093 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.744 HG13 ' CB ' ' A' ' 124' ' ' ASP . 90.8 t -124.57 124.91 69.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 25.0 111.196 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.567 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -70.65 140.06 51.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 25.0 110.834 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -75.04 -33.12 55.52 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.706 -0.759 . . . . 25.0 112.489 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.766 HG23 ' HG2' ' A' ' 120' ' ' MET . 5.1 t -84.63 -34.05 23.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 25.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . 0.766 ' HG2' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER -111.08 33.04 4.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 25.0 110.835 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.928 HD21 HG21 ' A' ' 7' ' ' THR . 3.2 tt -52.68 -36.2 56.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.416 . . . . 25.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -58.55 -37.46 75.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.855 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.03 -35.82 64.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 25.0 110.927 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.744 ' CB ' HG13 ' A' ' 116' ' ' VAL . 3.4 m-20 -72.61 -38.13 67.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 25.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -52.22 -42.79 63.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.925 -179.939 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -79.83 -34.97 38.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 25.0 110.886 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.12 -33.81 76.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 25.0 111.112 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.55 -60.13 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 25.0 111.108 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -113.09 76.18 2.3 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.762 0.792 . . . . 25.0 110.944 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -30.71 22.04 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.727 2.285 . . . . 25.0 112.311 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 t -69.6 -16.32 63.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.265 -0.425 . . . . 25.0 110.863 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -70.45 139.69 51.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.828 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 25.0 110.934 -179.954 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.058 0 CA-C-O 120.786 0.327 . . . . 25.0 110.861 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.57 -49.72 75.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 25.0 111.064 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -36.63 66.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 25.0 110.878 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.0 mtt -68.93 -41.44 78.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.932 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.64 -38.62 72.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 25.0 111.088 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -63.72 -53.68 47.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 25.0 110.871 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.08 -43.74 64.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.275 -0.42 . . . . 25.0 110.839 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -66.54 -38.96 88.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 25.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.32 -46.47 88.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.51 -36.32 55.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.93 -36.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 25.0 110.878 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.522 HD11 HD22 ' A' ' 17' ' ' ASN . 0.7 OUTLIER -62.73 -54.6 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 25.0 110.925 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.0 -35.95 23.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 25.0 111.13 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 25.0 110.999 179.961 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.9 tt . . . . . 0 N--CA 1.467 0.42 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.12 -35.06 79.03 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.335 0.588 . . . . 0.0 110.887 177.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -59.62 -27.17 66.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.107 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.49 -48.98 78.63 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.6 m -67.44 -38.76 85.02 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.968 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -55.17 -53.43 56.01 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -65.95 -30.87 71.51 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.953 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.68 -33.38 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.088 -0.382 . . . . 0.0 111.85 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.423 HD11 HD11 ' A' ' 125' ' ' LEU . 7.4 mm -68.04 -43.66 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.36 -43.61 88.48 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.32 96.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.36 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -59.03 -46.02 89.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.143 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.28 -53.2 39.59 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.29 -0.164 . . . . 0.0 111.025 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 73.1 t -53.99 -44.47 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.944 -0.473 . . . . 0.0 111.883 178.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.83 -16.28 64.02 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.462 -0.774 . . . . 0.0 112.722 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.2 m -89.79 1.24 56.38 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.423 0.289 . . . . 0.0 110.924 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.06 -1.0 28.45 Favored Glycine 0 C--O 1.228 -0.278 0 N-CA-C 115.887 1.115 . . . . 0.0 115.887 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.464 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 37.7 m-85 -68.63 118.51 11.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 117.974 0.887 . . . . 0.0 109.39 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.86 130.82 11.93 Favored Glycine 0 CA--C 1.508 -0.386 0 N-CA-C 111.051 -0.819 . . . . 0.0 111.051 -177.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.6 t -75.47 130.31 36.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.14 0.495 . . . . 0.0 110.164 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.9 mt -102.46 -44.54 10.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 175.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -150.62 138.63 20.08 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.371 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 -177.278 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 . . . . . 0 C--O 1.225 -0.219 0 N-CA-C 113.218 0.822 . . . . 0.0 113.218 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -131.48 138.61 49.06 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -171.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.9 mt -138.96 137.26 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -120.79 133.55 55.32 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.151 0.58 . . . . 0.0 109.967 177.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.4 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 2.6 mp -131.07 137.28 49.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.908 0.883 . . . . 0.0 110.272 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -86.17 137.04 32.95 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.78 118.25 70.9 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 84.8 Cg_endo -76.26 -25.45 9.95 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 117.192 -1.405 . . . . 0.0 112.035 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -72.94 -30.52 63.93 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.393 1.077 . . . . 0.0 112.012 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.2 mttp 55.99 39.24 30.54 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.722 1.249 . . . . 0.0 111.554 177.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.2 t -77.66 -172.99 2.81 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 104.48 -2.415 . . . . 0.0 104.48 170.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -41.4 -1.78 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.071 1 N-CA-C 121.945 4.054 . . . . 0.0 121.945 -178.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -132.95 125.37 29.66 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -74.58 -33.63 62.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.589 0.709 . . . . 0.0 109.54 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.06 161.03 37.81 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.711 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.7 t -130.79 139.06 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -123.87 136.38 54.32 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tp -113.21 124.97 53.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -136.45 135.56 38.76 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -118.5 100.09 7.23 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.063 0.459 . . . . 0.0 112.177 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.41 150.23 30.21 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -87.82 151.41 22.88 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.6 mt -138.22 120.28 15.59 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -88.14 -33.41 18.22 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.098 0.475 . . . . 0.0 110.755 -178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -129.87 149.9 51.4 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.494 ' HD2' HD11 ' A' ' 99' ' ' ILE . 15.0 ptt180 -66.93 -22.42 65.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.673 -0.642 . . . . 0.0 111.147 -179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -32.69 73.77 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -74.37 -39.5 62.7 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 46.3 ttm -58.54 -48.59 80.38 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.279 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 20.8 m -63.2 -31.9 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 122.037 -0.414 . . . . 0.0 111.59 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -70.07 -34.13 72.8 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.834 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.22 -42.56 91.3 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 175.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -66.17 -31.28 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -63.82 -39.54 94.47 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -76.64 -41.98 43.85 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -57.48 -36.58 71.67 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 113.034 0.754 . . . . 0.0 113.034 178.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.488 ' HA ' HG11 ' A' ' 109' ' ' VAL . . . -61.89 -37.28 84.0 Favored 'General case' 0 C--O 1.208 -1.124 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -37.28 77.39 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.815 0.341 . . . . 0.0 110.471 177.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -61.16 -47.69 85.04 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.481 HG11 HG13 ' A' ' 109' ' ' VAL . 75.4 t -65.12 -40.72 89.78 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.408 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.31 -40.83 83.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -65.23 -44.74 87.25 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.733 -0.605 . . . . 0.0 110.884 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.7 t -67.01 -36.97 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-O 121.231 0.538 . . . . 0.0 110.176 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.07 -44.52 94.68 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.812 -0.555 . . . . 0.0 110.749 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -65.59 -41.08 93.22 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.2 -40.0 92.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.2 mp -94.57 -0.07 54.83 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.07 15.38 65.07 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 116.241 1.256 . . . . 0.0 116.241 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.8 mtt-85 -72.47 142.86 48.59 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.25 -32.99 67.17 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.35 -0.843 . . . . 0.0 112.979 -177.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.45 160.82 43.12 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 102.31 -3.218 . . . . 0.0 102.31 178.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.6 mtp -141.86 148.23 38.44 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.858 1.208 . . . . 0.0 113.004 178.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -117.6 141.27 48.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 174.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.2 tp -128.26 135.44 49.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 68.0 tp -94.14 119.5 33.06 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 170.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -115.04 108.73 17.06 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -177.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.4 t -107.68 118.44 55.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -176.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -88.01 146.21 25.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.226 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -121.47 116.86 25.5 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 172.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 78.2 p -136.45 160.32 39.11 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.226 0.329 . . . . 0.0 110.722 -174.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.2 t -76.87 -29.24 55.73 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.583 -0.698 . . . . 0.0 111.381 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -150.7 164.08 37.01 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 106.26 -1.755 . . . . 0.0 106.26 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.88 152.78 41.87 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -177.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -59.4 149.21 82.83 Favored 'Trans proline' 0 C--N 1.349 0.579 0 O-C-N 122.367 0.667 . . . . 0.0 113.42 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.8 m -77.79 -16.14 14.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 117.317 2.34 . . . . 0.0 117.317 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -120.73 100.26 7.01 Favored 'General case' 0 C--O 1.21 -0.991 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -175.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 44.6 31.46 0.63 Allowed 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 117.29 2.33 . . . . 0.0 117.29 172.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.7 p-90 -61.94 -22.23 65.44 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.461 -0.775 . . . . 0.0 112.642 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.88 -31.28 69.65 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.04 -0.413 . . . . 0.0 111.664 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -58.75 -39.85 82.14 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.768 -0.826 . . . . 0.0 108.768 177.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.494 HD11 ' HD2' ' A' ' 54' ' ' ARG . 8.8 mm -63.89 -39.35 85.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.04 -177.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.28 -10.33 57.33 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -112.0 3.81 17.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -109.88 105.85 15.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.852 -175.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.0 m -68.36 122.42 18.35 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 174.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -84.05 122.55 28.94 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -123.01 132.87 54.32 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.783 0.802 . . . . 0.0 109.643 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -147.61 125.48 11.97 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.23 -119.42 13.0 Favored Glycine 0 C--O 1.227 -0.343 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -176.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -119.23 19.34 12.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.167 0.984 . . . . 0.0 108.576 175.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 65' ' ' ALA . 84.6 t -97.14 138.45 22.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.618 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -126.12 139.98 52.94 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 172.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.2 t -132.72 136.76 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.262 0 CA-C-O 121.813 0.816 . . . . 0.0 110.347 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.2 103.37 47.9 Favored Pre-proline 0 N--CA 1.433 -1.279 0 CA-C-N 113.422 -1.717 . . . . 0.0 109.347 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.18 152.61 27.62 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 115.636 -2.443 . . . . 0.0 112.483 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.69 154.69 38.96 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.63 -2.73 . . . . 0.0 103.63 175.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -150.76 135.89 10.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.5 m -111.99 138.03 42.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 172.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.44 142.57 47.43 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.76 -27.68 59.36 Favored Glycine 0 C--O 1.227 -0.283 0 CA-C-N 115.956 -0.565 . . . . 0.0 114.169 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.8 p -55.45 -30.03 59.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.84 26.27 2.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.352 0.596 . . . . 0.0 110.527 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 27.6 tp -43.51 -44.04 5.79 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -170.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -60.91 -43.27 98.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 119.118 0.872 . . . . 0.0 112.068 -177.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -74.95 -38.7 61.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 122.282 1.039 . . . . 0.0 110.564 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.82 -38.97 92.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.035 0.921 . . . . 0.0 111.686 -177.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.423 HD11 HD11 ' A' ' 11' ' ' ILE . 2.5 tm? -61.78 -50.04 73.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.102 -178.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -72.06 -15.7 62.02 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.404 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.21 -34.67 63.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 56.2 t -91.18 -41.51 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.113 0.482 . . . . 0.0 109.979 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -124.24 76.33 60.65 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 122.882 0.473 . . . . 0.0 111.532 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.13 -11.64 32.15 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 117.726 -1.049 . . . . 0.0 112.181 177.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 24.7 p -76.27 -8.74 57.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.556 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -93.21 131.41 38.33 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.195 0.521 . . . . 0.0 109.598 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 . . . . . 0 C--N 1.323 -0.557 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.673 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 . . . . . 0 C--O 1.217 -0.625 0 N-CA-C 111.847 0.314 . . . . 0.0 111.847 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.89 -36.79 70.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 177.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.83 -41.27 95.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.467 0.651 . . . . 0.0 109.382 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 45.9 mtt -68.36 -35.44 77.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.517 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.2 -30.73 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.315 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.97 -48.27 74.62 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.01 -40.58 91.23 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.568 0.699 . . . . 0.0 110.007 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -60.26 -38.92 84.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.394 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -68.18 -45.42 73.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.706 -0.224 . . . . 0.0 110.905 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.19 -39.02 91.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.307 0.575 . . . . 0.0 110.028 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 42.0 m -66.32 -34.59 78.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.04 0.448 . . . . 0.0 110.577 177.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.3 tt -67.33 -39.9 85.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.762 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 66.9 t -58.49 -50.02 80.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.0 tm? . . . . . 0 C--N 1.325 -0.469 0 C-N-CA 120.142 -0.623 . . . . 0.0 110.968 -178.708 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.3 tt . . . . . 0 N--CA 1.467 0.385 0 CA-C-O 121.114 0.483 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 69.7 mt -64.1 -42.71 96.8 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.402 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -67.17 -38.48 85.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.667 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -60.9 -50.7 72.37 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.6 m -59.77 -40.1 87.11 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 121.075 0.464 . . . . 0.0 111.008 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -59.7 -45.13 93.07 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -75.6 -34.23 60.6 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.791 1.281 . . . . 0.0 108.776 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tptt -64.63 -39.65 94.09 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.834 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.5 mm -72.1 -40.47 66.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 -42.31 84.24 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.26 98.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -62.07 -46.91 87.04 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.352 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -63.48 -48.04 79.29 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.051 -0.406 . . . . 0.0 110.718 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.6 -37.19 79.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.014 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -74.2 -10.5 59.67 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.077 -1.014 . . . . 0.0 111.765 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.0 m -94.77 12.69 27.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.0 2.63 66.33 Favored Glycine 0 CA--C 1.517 0.204 0 N-CA-C 116.496 1.359 . . . . 0.0 116.496 175.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -70.36 115.09 9.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 118.444 1.122 . . . . 0.0 109.237 178.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.34 133.86 20.44 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.0 t -78.6 118.69 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.519 HD11 HD22 ' A' ' 43' ' ' LEU . 40.6 mt -90.27 -44.92 14.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 177.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -149.65 124.65 9.99 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.451 -177.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.32 -0.685 0 N-CA-C 104.689 -2.337 . . . . 0.0 104.689 173.097 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 . . . . . 0 N--CA 1.456 -0.173 0 N-CA-C 115.667 1.728 . . . . 0.0 115.667 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -136.93 147.09 46.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 116.511 2.041 . . . . 0.0 116.511 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.1 mt -136.36 130.05 47.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 174.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.9 m95 -103.23 127.25 50.6 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 177.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -123.02 142.37 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.039 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -92.26 133.84 35.45 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 175.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.22 114.0 29.07 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.22 -29.13 14.65 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 116.667 -1.756 . . . . 0.0 113.245 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -74.15 -11.76 60.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.006 0.523 . . . . 0.0 111.279 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 mttm 59.4 41.6 19.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 123.355 1.55 . . . . 0.0 107.896 -178.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -177.57 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 110.898 -2.864 . . . . 0.0 117.952 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 p -50.4 -26.78 5.35 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.537 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -117.12 139.09 51.16 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -81.98 -35.04 29.4 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.519 HD22 HD11 ' A' ' 23' ' ' ILE . 73.4 mt -133.62 158.84 42.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.831 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.58 134.38 66.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -116.39 102.86 9.9 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.18 129.17 34.3 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.167 -2.16 . . . . 0.0 105.167 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -136.37 138.32 41.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -105.22 95.22 5.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.73 122.78 7.63 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.203 0.525 . . . . 0.0 111.065 -178.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -91.54 134.56 34.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -124.36 126.61 46.27 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -171.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -72.9 -41.18 64.9 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -129.18 152.07 49.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -63.41 -19.72 64.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -73.22 -33.01 65.1 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 121.982 -0.449 . . . . 0.0 109.938 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -67.25 -28.41 68.02 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.755 -0.591 . . . . 0.0 109.484 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 77.4 mtp -63.86 -51.73 63.26 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 9.1 m -65.8 -31.79 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.541 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -61.46 -43.91 98.03 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.543 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -64.52 -46.61 82.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.278 0.561 . . . . 0.0 110.187 -178.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mp -68.22 -33.25 59.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 121.272 -0.892 . . . . 0.0 110.618 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.188 -0.945 . . . . 0.0 110.08 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -76.56 -43.64 38.16 Favored 'General case' 0 C--O 1.243 0.729 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.404 ' O ' HG23 ' A' ' 68' ' ' VAL . 55.4 mt-30 -56.93 -40.08 75.68 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.628 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -35.88 75.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.045 0.384 . . . . 0.0 111.276 -178.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -72.46 -40.05 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.502 0.667 . . . . 0.0 109.308 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.4 -38.57 84.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 64' ' ' GLN . 89.3 t -70.43 -38.4 73.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 CA-C-O 118.628 -0.701 . . . . 0.0 110.802 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.84 -34.32 77.1 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.414 1.461 . . . . 0.0 110.123 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttt-85 -62.56 -44.8 95.43 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.611 -0.436 . . . . 0.0 109.926 175.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 84.4 t -66.62 -41.39 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.19 -42.87 77.82 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 123.271 0.628 . . . . 0.0 109.411 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -67.7 -40.9 84.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.623 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -58.53 -41.51 85.68 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -100.44 6.65 44.43 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.11 12.38 60.3 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 117.213 1.645 . . . . 0.0 117.213 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.8 ttt85 -62.07 145.1 54.18 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.854 0.827 . . . . 0.0 109.825 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -68.2 -34.91 77.14 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 122.039 -0.413 . . . . 0.0 110.755 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -149.05 160.66 43.13 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.0 mmm -127.92 136.08 50.86 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.48 138.06 50.66 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 tt -138.55 140.98 39.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 118.356 0.525 . . . . 0.0 112.251 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -104.44 118.43 36.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 173.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -107.99 127.38 53.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.3 t -121.79 111.91 32.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 121.363 -0.135 . . . . 0.0 111.171 -178.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -81.59 147.57 29.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -120.76 115.95 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 171.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 t -131.25 160.5 34.72 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.568 0.543 . . . . 0.0 111.128 -173.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.1 m -67.1 -46.75 73.25 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -149.29 170.87 17.51 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.45 152.95 70.87 Favored Pre-proline 0 C--N 1.314 -0.971 0 CA-C-N 115.385 -0.825 . . . . 0.0 108.92 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.75 151.42 47.92 Favored 'Trans proline' 0 C--N 1.35 0.618 0 O-C-N 122.358 0.662 . . . . 0.0 112.008 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -61.18 -20.03 21.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 117.761 2.504 . . . . 0.0 117.761 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -155.51 145.63 21.66 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.6 t0 39.9 30.15 0.06 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 174.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -73.47 -22.4 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.339 -0.85 . . . . 0.0 110.705 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -64.85 -32.02 73.53 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.922 -0.486 . . . . 0.0 111.525 -176.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -64.18 -25.11 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.713 -0.395 . . . . 0.0 109.996 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.6 mm -73.96 -43.43 52.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -178.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.83 -16.95 63.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.665 0.745 . . . . 0.0 110.105 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -95.1 4.03 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.61 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -126.64 118.76 25.46 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.7 m -68.28 126.83 30.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 173.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -85.72 111.77 20.43 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -110.67 125.23 53.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.933 0.397 . . . . 0.0 110.951 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.4 ttpp -138.58 101.9 4.46 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.01 -112.72 5.08 Favored Glycine 0 C--N 1.322 -0.231 0 C-N-CA 120.164 -1.017 . . . . 0.0 111.806 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.9 p -89.66 9.15 28.06 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 44.7 t -115.46 143.48 25.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.6 m -127.76 118.18 23.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 171.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.5 t -120.49 130.88 73.97 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.304 0 CA-C-O 121.624 0.726 . . . . 0.0 111.21 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.49 110.9 61.66 Favored Pre-proline 0 N--CA 1.433 -1.322 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.587 177.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -80.14 150.56 20.37 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.169 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.92 154.14 37.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 176.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.0 tt -147.4 125.8 3.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -177.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.7 t -102.37 120.96 52.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.05 136.24 47.24 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -179.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.67 -22.53 53.32 Favored Glycine 0 C--O 1.228 -0.257 0 N-CA-C 114.694 0.637 . . . . 0.0 114.694 -177.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 54.3 p -59.47 -32.08 69.91 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.1 ptm -139.89 29.5 2.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 122.051 0.929 . . . . 0.0 108.845 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 tt -46.1 -41.25 12.06 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -172.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -62.35 -45.0 95.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.006 0.821 . . . . 0.0 111.126 -176.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -74.44 -39.75 62.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.783 0.801 . . . . 0.0 111.287 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -66.58 -37.84 85.78 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.007 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 14.4 tp -62.1 -36.37 81.51 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.928 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.33 -15.93 61.88 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.71 -31.37 59.63 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.01 -40.28 10.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.258 -179.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -125.83 77.05 70.63 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.441 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -67.49 -19.82 48.42 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.427 0.895 . . . . 0.0 114.427 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.2 m -80.06 -9.46 59.7 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -64.82 140.01 58.82 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.286 0.565 . . . . 0.0 111.346 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? . . . . . 0 CA--C 1.511 -0.543 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.576 179.842 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 . . . . . 0 C--O 1.215 -0.729 0 N-CA-C 111.46 0.17 . . . . 0.0 111.46 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.66 96.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.435 0.636 . . . . 0.0 110.054 177.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -68.92 -39.56 79.58 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 90.5 mtp -65.82 -36.7 84.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.98 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.95 78.78 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.263 . . . . 0.0 110.524 178.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -65.44 -44.85 85.99 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 177.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.02 -44.23 96.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.521 0.677 . . . . 0.0 109.73 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 -61.11 -41.12 96.11 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.645 179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.32 -41.38 98.51 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.66 -38.28 90.5 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.349 -0.844 . . . . 0.0 110.142 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 59.9 p -69.94 -30.02 67.31 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.854 175.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.49 -43.97 92.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.357 0.663 . . . . 0.0 109.898 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 76.7 t -57.95 -46.54 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.659 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 C--N 1.323 -0.552 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.107 179.747 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.7 tt . . . . . 0 N--CA 1.469 0.524 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -61.75 -30.56 70.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.418 ' HB2' ' HB1' ' A' ' 147' ' ' ALA . 95.7 mt-10 -62.84 -35.46 80.02 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.1 m -61.93 -42.78 99.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.53 0.681 . . . . 0.0 111.845 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -59.92 -51.03 71.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.511 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -69.75 -27.34 64.87 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 121.867 -0.521 . . . . 0.0 111.357 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -66.21 -43.56 86.36 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.811 -0.555 . . . . 0.0 110.886 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.7 mm -70.62 -37.5 69.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.0 -45.35 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.49 -44.52 90.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.377 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -57.58 -46.74 83.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.37 -178.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.12 -50.91 59.79 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -66.0 -31.04 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.54 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -68.16 -14.34 62.9 Favored 'General case' 0 C--O 1.221 -0.425 0 O-C-N 121.855 -0.528 . . . . 0.0 110.719 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.7 m -95.91 8.9 42.35 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 122.767 0.427 . . . . 0.0 109.998 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.64 -2.88 58.94 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 115.435 0.934 . . . . 0.0 115.435 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -65.44 115.23 5.47 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 109.905 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.3 138.57 27.96 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.374 -176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.2 t -83.11 107.35 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.428 HD11 HD22 ' A' ' 43' ' ' LEU . 84.0 mt -71.91 -47.23 56.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.92 130.56 10.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.232 178.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.587 0 N-CA-C 101.146 -3.65 . . . . 0.0 101.146 170.305 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 . . . . . 0 C--O 1.23 0.051 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -142.32 149.72 39.84 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.1 mt -141.25 133.1 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -103.5 130.02 50.8 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -124.39 141.18 52.28 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -99.29 145.79 26.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.47 105.65 17.02 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.02 -16.47 32.28 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 118.012 -0.858 . . . . 0.0 111.49 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -61.62 -28.7 69.56 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.017 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 58.79 37.79 24.87 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.2 p -76.75 -176.28 3.78 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 112.495 -2.139 . . . . 0.0 109.593 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 p -54.87 -8.91 0.29 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -132.9 136.12 45.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -80.27 -35.94 35.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.305 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 HD11 ' A' ' 23' ' ' ILE . 40.4 mt -138.6 163.34 32.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.116 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.2 p -138.63 139.41 41.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -119.34 132.87 55.94 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mp -106.24 122.46 46.27 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 177.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.53 121.28 18.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 118.118 0.417 . . . . 0.0 110.659 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -100.8 114.93 29.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.677 0.751 . . . . 0.0 109.188 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -151.64 150.37 30.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.456 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.0 147.72 44.87 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 174.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 73.6 mt -139.83 107.64 5.66 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -83.0 -40.55 19.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.64 0.734 . . . . 0.0 110.892 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -132.44 156.72 46.22 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.927 -0.578 . . . . 0.0 112.145 -178.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 95' ' ' ASP . 15.9 ptt180 -64.97 -15.33 62.1 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.098 0.475 . . . . 0.0 111.093 175.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -63.35 -37.44 87.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -75.46 -30.86 60.08 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.952 0.406 . . . . 0.0 110.057 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 97.1 mtp -63.58 -47.35 81.87 Favored 'General case' 0 C--O 1.211 -0.972 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.92 -30.74 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.682 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 mtm-85 -61.49 -43.41 98.91 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -59.13 -42.18 89.99 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.17 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -64.51 -30.79 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -61.03 -40.18 92.62 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 177.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -72.96 -37.22 67.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.207 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 68.2 mm-40 -56.2 -50.54 70.95 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.25 -36.57 82.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 122.161 -0.337 . . . . 0.0 111.841 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.47 -43.49 97.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.991 0.424 . . . . 0.0 109.871 178.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -67.33 -42.42 83.61 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.419 HG11 HG13 ' A' ' 109' ' ' VAL . 57.0 t -62.94 -37.55 79.59 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.168 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -58.42 -41.0 84.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.008 0.822 . . . . 0.0 110.137 178.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 87.4 mtt-85 -63.87 -41.66 97.7 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.3 t -69.81 -43.42 79.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.118 0.485 . . . . 0.0 110.167 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -57.53 -41.14 80.29 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -65.85 -37.67 86.81 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.357 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -68.94 -40.26 79.09 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.076 0.465 . . . . 0.0 110.463 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 mp -75.42 -13.21 60.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.136 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.69 6.41 55.19 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 114.084 0.394 . . . . 0.0 114.084 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -73.57 140.78 46.51 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.801 . . . . 0.0 110.352 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -66.45 -38.03 86.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.634 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -131.16 161.3 32.46 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mtp -144.87 148.63 34.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 118.708 0.685 . . . . 0.0 109.824 174.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -121.47 143.49 49.22 Favored 'General case' 0 CA--C 1.514 -0.41 0 O-C-N 123.594 0.559 . . . . 0.0 110.97 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -139.76 125.66 19.64 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.0 tp -93.53 121.75 35.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -111.98 112.61 24.38 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.126 -0.359 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.3 t -105.98 110.94 33.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-O 121.201 0.524 . . . . 0.0 111.834 -176.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -80.1 136.64 36.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -114.18 112.31 22.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 173.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.6 m -132.13 158.23 42.2 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.846 0.355 . . . . 0.0 111.108 -175.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.5 t -74.86 -28.93 60.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.826 -0.546 . . . . 0.0 110.393 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -154.99 166.12 34.6 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 -178.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.4 155.09 54.33 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.15 154.34 73.98 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 117.328 -1.315 . . . . 0.0 111.994 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.57 -12.54 13.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 120.402 3.482 . . . . 0.0 120.402 -168.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -151.54 140.45 21.0 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -175.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 54' ' ' ARG . 7.3 m-20 42.69 15.3 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 120.153 3.39 . . . . 0.0 120.153 173.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 25.3 p-90 -63.68 -21.41 66.37 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 120.837 -1.164 . . . . 0.0 113.598 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.66 -29.46 70.65 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -62.39 -33.5 74.88 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.616 0.722 . . . . 0.0 109.615 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 mm -69.19 -40.49 80.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.825 -174.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.73 -15.19 63.1 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.866 0.365 . . . . 0.0 111.793 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -102.2 3.27 38.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -177.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -117.42 130.32 56.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.483 0.659 . . . . 0.0 112.155 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -80.71 125.27 29.83 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 173.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -84.02 126.08 32.7 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -123.85 135.61 53.86 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.84 0.829 . . . . 0.0 110.502 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -135.49 91.73 2.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.75 -109.54 2.85 Favored Glycine 0 C--O 1.22 -0.76 0 N-CA-C 107.336 -2.305 . . . . 0.0 107.336 -177.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.0 p -110.85 7.26 21.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.777 0.323 . . . . 0.0 111.558 178.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.419 HG13 HG11 ' A' ' 68' ' ' VAL . 78.7 t -87.68 139.36 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.7 m -126.86 136.99 53.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.9 t -132.09 135.35 58.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -111.14 115.83 52.14 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -79.69 151.08 21.87 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 117.373 -1.284 . . . . 0.0 112.331 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.15 152.72 42.1 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 175.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.7 tt -146.81 131.31 10.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.2 m -113.68 128.45 70.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 103.598 -2.742 . . . . 0.0 103.598 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.33 136.32 54.88 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -47.16 -39.9 13.27 Favored Glycine 0 C--O 1.226 -0.382 0 N-CA-C 117.173 1.629 . . . . 0.0 117.173 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 119' ' ' THR . 0.2 OUTLIER -55.58 -29.31 58.81 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.764 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -142.46 32.7 1.48 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.099 1.428 . . . . 0.0 108.934 -178.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 tp -52.04 -36.4 50.18 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -60.17 -49.86 75.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.562 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.68 -32.98 64.23 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.735 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -63.45 -45.33 91.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.829 0.347 . . . . 0.0 110.719 177.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.68 -44.08 96.94 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -75.37 -14.08 60.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.819 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.52 -41.82 37.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.945 0.402 . . . . 0.0 110.03 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.451 HG13 ' CD2' ' A' ' 129' ' ' PHE . 5.2 p -88.91 -33.98 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.244 0.545 . . . . 0.0 110.577 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . 0.451 ' CD2' HG13 ' A' ' 128' ' ' VAL . 61.1 m-85 -126.78 75.62 75.38 Favored Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 122.0 -0.438 . . . . 0.0 110.233 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -67.29 -10.75 29.71 Favored 'Trans proline' 0 C--N 1.349 0.593 0 CA-C-O 121.415 0.506 . . . . 0.0 113.006 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.4 p -80.26 -9.97 59.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.459 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.84 135.64 33.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.424 0.63 . . . . 0.0 110.5 -178.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 85.9 mtt-85 . . . . . 0 CA--C 1.507 -0.696 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -179.882 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 . . . . . 0 C--O 1.221 -0.411 0 CA-C-O 121.52 0.676 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.418 ' HB1' ' HB2' ' A' ' 5' ' ' GLU . . . -57.1 -39.98 76.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.839 177.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -78.7 -31.12 46.38 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.969 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 94.0 mmm -63.26 -34.48 77.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.319 176.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -67.86 -44.61 76.73 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.5 -40.88 96.47 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.669 0.747 . . . . 0.0 109.34 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -61.57 -42.26 98.59 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.647 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.42 -42.31 98.73 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 177.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 47.7 mt -64.27 -31.8 73.15 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.235 -0.291 . . . . 0.0 110.334 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.4 m -76.18 -36.36 58.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.771 0.796 . . . . 0.0 110.543 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.36 -34.72 77.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.813 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 2.1 p -52.97 -28.09 13.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.479 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.218 -0.59 0 O-C-N 121.066 -1.021 . . . . 0.0 109.26 178.663 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.0 mt . . . . . 0 N--CA 1.469 0.481 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.66 -35.32 80.46 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -63.02 -31.76 72.97 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.021 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -63.02 -51.64 65.98 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -64.64 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.294 0.568 . . . . 0.0 111.271 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -56.58 -50.77 70.97 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.264 0.626 . . . . 0.0 111.04 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.385 -0.822 . . . . 0.0 111.71 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -66.3 -42.88 87.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.073 -0.392 . . . . 0.0 110.064 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.426 HD11 HD11 ' A' ' 125' ' ' LEU . 14.8 mm -69.2 -39.54 79.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.35 -44.21 79.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.53 99.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.093 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -46.47 90.41 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.913 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.2 mt -65.01 -46.24 82.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.156 0.503 . . . . 0.0 110.889 -179.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.8 -38.34 82.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.702 -178.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -78.93 -3.5 45.18 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.242 -0.911 . . . . 0.0 112.374 178.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.9 t -96.46 17.44 16.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.058 0.456 . . . . 0.0 110.008 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.89 -0.77 64.87 Favored Glycine 0 CA--C 1.518 0.246 0 N-CA-C 116.257 1.263 . . . . 0.0 116.257 175.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -75.96 135.47 40.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.109 0.955 . . . . 0.0 110.043 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.77 146.48 20.64 Favored Glycine 0 CA--C 1.505 -0.589 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.1 t -90.19 121.25 40.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 117.794 0.797 . . . . 0.0 109.22 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.6 mt -87.98 -45.66 15.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -161.07 147.49 14.79 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 175.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.37 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -177.37 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.477 0.917 0 CA-C-O 121.513 0.673 . . . . 0.0 112.581 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.66 158.99 38.54 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.6 mt -131.2 131.43 63.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -110.3 129.65 55.7 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -117.1 133.8 55.55 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.859 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -85.26 124.32 31.76 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.35 120.93 83.53 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.55 -22.87 37.75 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 117.164 -1.424 . . . . 0.0 113.599 -175.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.98 -18.49 55.9 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -176.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm 59.76 29.0 18.56 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-O 121.961 0.886 . . . . 0.0 109.509 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 t -65.91 -177.56 0.49 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 113.872 -1.513 . . . . 0.0 110.243 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.1 m -45.53 -44.64 12.82 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -81.68 106.14 13.38 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 170.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -84.86 -24.74 28.42 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -138.38 156.13 47.88 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.345 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 69.9 t -136.74 144.56 32.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 104.81 -2.293 . . . . 0.0 104.81 176.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.02 149.95 46.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 119.047 0.84 . . . . 0.0 111.755 174.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -115.4 132.54 56.59 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.663 -1.977 . . . . 0.0 105.663 179.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -136.5 126.81 26.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.206 0.457 . . . . 0.0 112.135 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.15 115.13 27.03 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -150.58 125.26 9.68 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -87.35 111.4 21.04 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.507 HD13 ' HG2' ' A' ' 57' ' ' MET . 4.6 mt -106.5 121.05 43.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -171.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -91.03 -36.03 14.29 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.578 0.704 . . . . 0.0 111.773 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -128.14 147.38 50.55 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.869 -0.52 . . . . 0.0 111.391 -177.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -65.29 -20.37 66.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -63.54 -33.33 75.35 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.05 -30.57 63.82 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 121.659 -0.651 . . . . 0.0 109.263 179.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.507 ' HG2' HD13 ' A' ' 51' ' ' LEU . 84.5 mtp -66.32 -51.85 53.19 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.8 m -60.94 -36.42 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.186 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -66.12 -36.82 84.16 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -62.04 -40.21 94.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.977 0.418 . . . . 0.0 110.022 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.406 HD12 ' O ' ' A' ' 57' ' ' MET . 2.5 mp -73.25 -34.2 43.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 121.42 -0.8 . . . . 0.0 111.058 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -58.74 -37.94 77.32 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -74.87 -43.43 54.5 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.603 0.716 . . . . 0.0 109.881 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.41 HE22 ' ND2' ' A' ' 84' ' ' ASN . 44.9 mt-30 -58.79 -39.38 80.91 Favored 'General case' 0 C--O 1.212 -0.872 0 O-C-N 121.765 -0.584 . . . . 0.0 111.409 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.83 -34.41 74.51 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 118.114 0.416 . . . . 0.0 110.505 -178.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -71.62 -42.58 67.48 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -60.15 -42.86 95.8 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.276 0.56 . . . . 0.0 109.508 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -67.46 -39.17 82.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 123.111 0.564 . . . . 0.0 110.336 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.55 -41.87 81.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.107 0.479 . . . . 0.0 110.736 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -65.12 -41.18 95.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.827 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.7 t -68.88 -39.69 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.4 ttp85 -60.09 -40.74 90.66 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.819 -0.55 . . . . 0.0 109.846 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -63.39 -41.11 98.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.906 -0.134 . . . . 0.0 110.845 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.55 -41.38 98.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.061 0.458 . . . . 0.0 110.899 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.82 -15.87 55.24 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.82 15.58 71.51 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-O 121.546 0.526 . . . . 0.0 112.227 -177.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -70.2 140.08 52.43 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 122.153 -0.616 . . . . 0.0 110.617 -175.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -64.45 -39.41 93.78 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.446 HH22 ' CD ' ' A' ' 105' ' ' GLU . 11.2 mtp180 -148.35 156.37 42.42 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 177.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.0 mmm -131.97 124.34 29.18 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.145 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -105.35 135.73 46.19 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 175.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -130.61 132.84 45.72 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.9 tp -94.74 123.51 38.24 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.41 ' ND2' HE22 ' A' ' 64' ' ' GLN . 36.6 t30 -120.06 114.47 22.03 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 122.159 0.184 . . . . 0.0 111.389 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.06 116.86 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.989 0.424 . . . . 0.0 111.671 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -80.92 152.81 27.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.514 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -128.09 115.87 19.11 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.508 -2.404 . . . . 0.0 104.508 171.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -136.88 151.87 49.58 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.474 0.484 . . . . 0.0 110.621 -173.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 87.7 m -67.22 -49.85 63.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 168.53 11.12 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -176.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.32 140.61 22.13 Favored Pre-proline 0 C--N 1.313 -0.991 0 N-CA-C 104.818 -2.29 . . . . 0.0 104.818 176.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.1 145.88 83.92 Favored 'Trans proline' 0 C--N 1.345 0.386 0 N-CA-C 114.706 1.002 . . . . 0.0 114.706 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.2 m -76.63 -4.24 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -175.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -120.86 100.46 7.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 119.461 -0.304 . . . . 0.0 111.513 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 22.53 50.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 32.7 p-90 -66.84 -22.84 65.98 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.488 -0.758 . . . . 0.0 112.276 -178.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -63.06 -31.25 72.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 121.914 -0.491 . . . . 0.0 110.742 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -63.78 -34.82 78.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.2 mm -63.99 -38.53 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 122.486 0.314 . . . . 0.0 110.283 -177.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.13 -25.78 68.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 111.181 -179.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -90.81 -2.33 57.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -96.0 102.34 14.12 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.957 -0.465 . . . . 0.0 111.749 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -68.4 118.76 11.88 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 103.039 -2.948 . . . . 0.0 103.039 169.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -82.93 110.77 18.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . 0.446 ' CD ' HH22 ' A' ' 79' ' ' ARG . 5.1 mt-10 -107.81 121.12 44.08 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 122.094 0.949 . . . . 0.0 110.257 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -119.62 78.52 1.33 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.62 5.04 Favored Glycine 0 C--O 1.221 -0.694 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.448 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.7 p -76.81 -19.93 56.98 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 122.248 -0.56 . . . . 0.0 112.342 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.5 t -89.12 146.66 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.091 -0.38 . . . . 0.0 110.997 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 57.8 p -137.88 139.91 40.11 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 171.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.8 t -132.48 136.85 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.638 0 CA-C-O 122.021 0.915 . . . . 0.0 109.799 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -106.13 103.09 43.42 Favored Pre-proline 0 N--CA 1.428 -1.56 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.434 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -82.25 152.73 16.11 Favored 'Trans proline' 0 C--N 1.347 0.47 0 N-CA-C 114.129 0.78 . . . . 0.0 114.129 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.57 158.05 39.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 175.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.4 tt -149.66 128.48 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 118.369 0.531 . . . . 0.0 109.873 -178.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.3 t -100.08 116.97 44.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.82 139.96 38.82 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.54 -27.8 68.62 Favored Glycine 0 C--N 1.322 -0.2 0 CA-C-N 116.056 -0.52 . . . . 0.0 114.153 -177.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 27.0 p -54.01 -33.82 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -177.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.59 30.89 1.88 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.529 0.68 . . . . 0.0 110.107 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.9 tt -44.85 -36.96 3.54 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -175.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 18.3 ptp180 -55.61 -51.38 67.37 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.78 -38.56 38.2 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.976 0.893 . . . . 0.0 111.114 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.58 -38.09 86.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.975 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.426 HD11 HD11 ' A' ' 11' ' ' ILE . 2.7 tm? -63.24 -49.43 74.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -72.72 -16.12 61.67 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.391 -177.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.05 -34.97 64.25 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 46.6 t -91.35 -42.19 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.245 0.545 . . . . 0.0 110.285 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.9 76.53 66.2 Favored Pre-proline 0 C--N 1.324 -0.512 0 C-N-CA 122.93 0.492 . . . . 0.0 111.734 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.67 -11.92 33.23 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 118.325 -0.65 . . . . 0.0 113.123 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -75.84 -12.82 60.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.905 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -90.85 131.19 36.64 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 . . . . . 0 C--N 1.324 -0.532 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.903 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 44.8 m-20 . . . . . 0 N--CA 1.463 0.212 0 CA-C-O 120.509 0.195 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -37.26 69.3 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -64.97 -43.49 92.46 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 37.3 mtt -64.09 -36.59 84.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.369 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.27 -38.28 89.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.271 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -65.47 -43.04 91.52 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.007 0.432 . . . . 0.0 109.921 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -64.43 -41.98 96.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.472 0.653 . . . . 0.0 109.772 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -42.39 99.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.714 177.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -62.74 -43.02 99.88 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 122.82 0.448 . . . . 0.0 112.15 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.35 -37.31 86.79 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.585 -0.697 . . . . 0.0 109.948 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 21.5 m -67.64 -33.39 74.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.688 0.756 . . . . 0.0 110.673 176.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.81 -38.56 73.31 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.669 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.2 t -56.14 -42.48 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? . . . . . 0 C--N 1.322 -0.614 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.317 -179.22 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.501 0 CA-C-O 121.988 0.899 . . . . 0.0 109.516 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -73.68 -36.51 65.31 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.946 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.96 -39.18 84.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.059 0.39 . . . . 0.0 109.961 177.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -60.03 -53.14 61.27 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.9 m -63.05 -42.92 99.82 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.241 0.544 . . . . 0.0 111.114 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -56.91 -51.28 69.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.496 0.718 . . . . 0.0 112.14 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -71.31 -28.75 64.32 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.605 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -68.74 -36.48 78.45 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.664 -0.647 . . . . 0.0 109.511 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.537 HD11 HD11 ' A' ' 125' ' ' LEU . 22.2 mm -72.88 -36.01 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.62 85.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.02 -41.89 97.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.887 177.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -57.51 -49.87 74.91 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.549 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.24 -49.87 57.8 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.299 -178.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -39.45 82.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.722 -175.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -11.67 61.09 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.263 -0.898 . . . . 0.0 111.855 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.0 m -95.92 11.53 33.51 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 122.559 0.344 . . . . 0.0 110.32 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.25 -3.57 56.78 Favored Glycine 0 C--O 1.228 -0.26 0 N-CA-C 116.176 1.23 . . . . 0.0 116.176 175.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -66.79 126.14 28.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.065 0.932 . . . . 0.0 108.886 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.89 135.71 14.06 Favored Glycine 0 C--O 1.227 -0.318 0 N-CA-C 110.524 -1.031 . . . . 0.0 110.524 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.1 t -79.45 124.08 37.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 117.496 0.648 . . . . 0.0 109.258 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.6 mt -96.08 -45.5 13.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -148.56 141.96 25.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.456 0 CA-C-N 117.941 0.337 . . . . 0.0 111.088 178.064 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 . . . . . 0 N--CA 1.478 0.956 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.2 159.46 37.68 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 72.2 mt -132.59 125.89 53.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 105.46 -2.052 . . . . 0.0 105.46 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -99.14 129.63 45.41 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.86 138.27 54.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.914 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -81.59 129.78 34.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.23 118.07 68.68 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -74.37 -21.13 17.74 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 116.862 -1.625 . . . . 0.0 113.894 -175.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -77.44 -22.14 51.89 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 56.54 34.36 24.25 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 123.075 1.417 . . . . 0.0 111.092 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.5 p -74.48 -172.91 1.6 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.438 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.8 m -42.23 -28.24 0.18 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 112.675 0.621 . . . . 0.0 112.675 172.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -91.22 129.25 37.23 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 173.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -105.71 -41.46 5.44 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 31.4 mt -132.15 154.67 49.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.13 0.491 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -129.93 139.23 52.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -125.19 120.09 30.35 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.2 mt -96.02 120.54 36.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 104.035 -2.58 . . . . 0.0 104.035 175.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -135.09 127.93 31.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.937 0.789 . . . . 0.0 111.403 -175.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -103.18 105.78 16.16 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.018 0.913 . . . . 0.0 112.208 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -151.56 131.53 13.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.313 178.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -82.24 151.29 26.89 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 176.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -134.54 141.97 46.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.827 0.285 . . . . 0.0 110.432 -174.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -94.9 -45.64 7.2 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -128.4 154.62 45.82 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -178.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -64.3 -15.32 60.0 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.989 176.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -64.45 -34.93 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.26 178.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -75.81 -41.63 52.21 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -47.75 83.54 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.358 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.08 -34.73 72.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.993 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 83.5 mtt85 -71.14 -32.43 68.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -177.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.85 -42.62 89.75 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.8 mp -71.49 -37.16 63.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.975 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.07 -33.39 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 119.067 0.849 . . . . 0.0 109.688 -179.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -74.29 -44.94 50.65 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -36.21 73.86 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 121.833 -0.542 . . . . 0.0 111.308 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.28 -43.93 72.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.79 -42.68 93.9 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -63.78 -56.93 11.81 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.707 0.765 . . . . 0.0 113.044 178.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.9 p -64.14 -30.41 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.86 -173.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.17 -37.48 64.52 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -64.43 -42.82 95.81 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.837 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 17.7 t -68.28 -37.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.419 0.628 . . . . 0.0 109.734 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -42.73 98.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.703 -178.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.6 m80 -67.53 -35.96 80.1 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.648 178.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -30.49 71.42 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.78 -9.6 58.68 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 177.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.22 18.29 71.06 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -76.55 121.96 23.91 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 122.011 -0.7 . . . . 0.0 110.407 -175.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.3 mtp180 -66.53 -35.39 80.12 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -157.58 149.72 22.45 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 172.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -147.34 126.15 12.68 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.958 -173.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -88.24 117.39 27.12 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.502 1.047 . . . . 0.0 111.309 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.05 121.91 34.06 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.2 tp -87.39 100.27 12.61 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -100.28 113.27 25.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.2 t -114.4 111.19 34.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -79.73 144.66 33.44 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.39 116.76 25.39 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 172.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.7 p -136.12 152.16 50.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -172.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.9 m -67.18 -48.62 67.4 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -138.55 157.92 45.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 -176.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.59 152.64 63.96 Favored Pre-proline 0 C--N 1.312 -1.048 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.14 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -64.53 149.74 89.41 Favored 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 117.632 -1.112 . . . . 0.0 112.059 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.02 -6.9 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 119.021 2.971 . . . . 0.0 119.021 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -126.91 112.89 15.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.479 1.288 . . . . 0.0 114.479 -173.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 21.07 45.71 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 118.977 2.954 . . . . 0.0 118.977 175.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.437 ' HA ' HG12 ' A' ' 99' ' ' ILE . 52.1 p-90 -72.11 -15.52 61.99 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.133 -0.979 . . . . 0.0 110.796 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.38 -31.3 72.45 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.539 -0.726 . . . . 0.0 111.202 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.89 -37.23 76.11 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 174.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.437 HG12 ' HA ' ' A' ' 96' ' ' TRP . 7.4 mm -67.45 -40.97 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -178.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.42 -32.82 73.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.264 0.554 . . . . 0.0 111.881 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -88.48 2.49 52.75 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.251 0.548 . . . . 0.0 110.289 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.8 ttpp -114.51 103.06 10.66 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 123.169 0.587 . . . . 0.0 111.849 -176.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 81.9 m -68.35 126.92 31.12 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 174.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -83.78 117.73 23.45 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -116.74 135.62 53.62 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.703 0.763 . . . . 0.0 111.072 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -144.41 85.82 1.8 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.66 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.69 5.21 Favored Glycine 0 C--O 1.225 -0.456 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.436 178.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.7 p -82.75 10.21 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.7 t -122.29 144.53 31.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -176.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.56 144.01 43.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 100.826 -3.768 . . . . 0.0 100.826 169.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.8 t -138.54 134.44 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.953 0 CA-C-N 119.449 1.022 . . . . 0.0 109.01 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -99.45 114.56 65.67 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -82.16 62.85 8.16 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 121.839 1.692 . . . . 0.0 113.76 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.01 147.2 48.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.7 tt -148.15 138.11 16.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 59.4 t -110.62 114.09 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.8 137.24 35.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -21.14 65.03 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.343 -0.456 . . . . 0.0 114.141 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 119' ' ' THR . 30.6 p -59.65 -31.56 69.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -177.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptm -140.43 34.2 1.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 tt -42.13 -42.86 3.1 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 117.187 2.292 . . . . 0.0 117.187 -172.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -61.04 -51.31 69.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 118.631 0.65 . . . . 0.0 112.255 -176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -74.08 -35.54 64.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.528 0.68 . . . . 0.0 111.798 -179.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -67.84 -36.41 80.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.842 0.83 . . . . 0.0 111.512 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.537 HD11 HD11 ' A' ' 11' ' ' ILE . 3.4 tm? -68.51 -43.38 76.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -70.75 -14.73 62.55 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.133 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.68 -34.04 66.92 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 176.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -94.38 -36.77 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -126.07 77.65 71.12 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 122.232 -0.292 . . . . 0.0 110.924 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -69.45 -9.33 25.93 Favored 'Trans proline' 0 C--N 1.347 0.483 0 N-CA-C 113.704 0.617 . . . . 0.0 113.704 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.0 p -83.5 -9.72 58.79 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 122.73 0.412 . . . . 0.0 111.852 178.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -80.98 141.64 34.24 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.191 0.52 . . . . 0.0 111.434 -177.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 . . . . . 0 CA--C 1.512 -0.502 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 179.951 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 120.222 0.058 . . . . 0.0 110.955 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.4 -37.02 84.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.298 0.57 . . . . 0.0 109.483 175.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -73.88 -40.82 62.93 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.1 mtt -65.14 -30.79 71.74 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 120.693 0.282 . . . . 0.0 110.742 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.48 91.29 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -67.63 -44.75 77.23 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.34 -42.85 99.36 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.648 0.737 . . . . 0.0 109.869 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -58.86 -44.83 91.12 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.15 176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.81 -32.27 73.88 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.819 -0.55 . . . . 0.0 109.832 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.94 -35.16 59.82 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.155 0.979 . . . . 0.0 110.538 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.67 -37.55 87.98 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -176.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -60.03 -37.17 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 118.838 0.744 . . . . 0.0 110.946 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 C--N 1.327 -0.395 0 O-C-N 121.196 -0.94 . . . . 0.0 108.64 177.013 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.475 0.807 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 71.4 mt -54.94 -35.23 64.01 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 47.7 mt-10 -56.81 -26.01 57.02 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -58.37 -49.4 77.37 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 m -71.82 -41.77 67.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.0 0.428 . . . . 0.0 110.934 178.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.478 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 64.1 t80 -56.05 -56.22 23.43 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -67.61 -29.73 69.13 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.853 -0.529 . . . . 0.0 110.766 -178.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -69.12 -39.42 78.92 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.352 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.613 HD11 HD11 ' A' ' 125' ' ' LEU . 8.2 mm -62.24 -46.22 96.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -42.18 79.48 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.37 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -60.83 -46.33 90.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 mt -66.53 -51.44 56.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.936 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.9 t -56.04 -46.74 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.81 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -22.03 66.64 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.756 -0.59 . . . . 0.0 112.431 -178.313 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.3 m -87.19 1.08 54.21 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.02 -0.94 27.06 Favored Glycine 0 C--O 1.228 -0.277 0 N-CA-C 115.898 1.119 . . . . 0.0 115.898 176.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -68.0 122.66 18.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.377 1.088 . . . . 0.0 108.438 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.79 116.3 4.25 Favored Glycine 0 CA--C 1.507 -0.424 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -178.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -71.81 111.98 6.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.1 mt -75.6 -42.9 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -143.01 116.45 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.904 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.493 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.722 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 N--CA 1.442 -0.833 0 CA-C-O 120.01 -0.043 . . . . 0.0 111.004 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 45' ' ' ARG . 11.2 pt-20 -139.56 148.52 42.69 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 86.0 mt -140.1 132.26 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -108.3 136.02 48.64 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.059 0.39 . . . . 0.0 109.968 176.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mp -131.16 129.98 42.45 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.346 0.658 . . . . 0.0 109.749 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -79.58 136.41 36.85 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.34 115.29 41.85 Favored Pre-proline 0 CA--C 1.546 0.795 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.48 -25.56 9.51 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 117.334 -1.311 . . . . 0.0 112.668 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.85 59.31 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.883 0.873 . . . . 0.0 111.482 -179.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt 57.34 45.49 20.0 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 t -60.13 -177.69 0.07 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 112.433 -2.167 . . . . 0.0 112.955 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 p -55.88 -29.02 59.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.239 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -109.36 136.96 47.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -80.18 -30.54 38.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.725 -175.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.0 mt -137.57 162.45 33.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.186 -176.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.3 t -129.59 135.39 61.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 30' ' ' GLU . 59.1 ttt180 -125.01 134.59 52.52 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 175.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.2 129.56 54.23 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 104.427 -2.434 . . . . 0.0 104.427 177.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -136.43 132.56 35.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 117.891 0.314 . . . . 0.0 110.736 -177.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 tmtm? -106.76 110.8 23.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.832 -0.542 . . . . 0.0 109.673 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -151.52 144.91 24.8 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -106.77 101.22 10.67 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.65 135.57 35.53 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -92.29 -37.27 12.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 175.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -126.27 150.86 48.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.009 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -65.02 -15.54 62.44 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.854 -0.529 . . . . 0.0 110.998 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -63.38 -36.33 83.37 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -73.47 -40.52 64.07 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.8 ttm -57.39 -48.75 78.26 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.934 -0.306 . . . . 0.0 111.0 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.33 -31.84 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.832 0.742 . . . . 0.0 112.108 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.0 mtt180 -66.82 -41.21 87.86 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -179.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.28 -36.29 77.49 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.85 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.5 mm -64.38 -30.81 51.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 121.626 -0.671 . . . . 0.0 112.243 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -63.39 -36.87 85.15 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -72.38 -38.69 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -56.58 -49.89 73.54 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.66 -27.94 68.73 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.97 -46.06 83.09 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -66.48 -42.59 87.25 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.93 -40.83 88.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 119.034 -0.507 . . . . 0.0 112.116 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.31 -33.34 74.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.014 1.279 . . . . 0.0 109.999 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.3 ttm-85 -64.05 -42.12 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.6 t -68.66 -41.68 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -57.03 -41.37 78.48 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.795 0.438 . . . . 0.0 111.35 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.5 t-80 -62.23 -40.54 96.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.758 0.314 . . . . 0.0 110.883 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -73.27 -41.86 63.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.739 0.304 . . . . 0.0 111.791 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.69 -17.94 59.78 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.47 7.18 63.71 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.444 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -65.42 140.45 58.63 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 122.068 -0.666 . . . . 0.0 109.356 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.02 -32.45 73.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.613 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.7 ttt85 -150.73 154.04 36.64 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 29.7 mmm -124.38 150.36 45.66 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -127.33 142.43 51.45 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.554 0.534 . . . . 0.0 109.651 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -142.35 124.81 15.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.922 0.391 . . . . 0.0 111.198 -176.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.6 tp -90.87 108.08 19.61 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -102.09 111.52 23.82 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 10.8 t -100.98 106.87 20.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.061 0.458 . . . . 0.0 112.002 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -75.69 139.68 42.08 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -118.22 113.23 21.2 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 172.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.2 m -128.28 155.0 45.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.6 m -67.16 -48.39 68.15 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.818 0.818 . . . . 0.0 108.908 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.27 170.87 15.17 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 -177.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.93 151.16 43.11 Favored Pre-proline 0 C--N 1.314 -0.966 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -62.16 151.51 81.56 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 122.194 0.576 . . . . 0.0 112.307 176.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -63.62 -18.39 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 N-CA-C 121.176 3.769 . . . . 0.0 121.176 -167.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -150.21 137.93 19.96 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 116.241 1.941 . . . . 0.0 116.241 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 t0 37.87 24.1 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 119.179 3.029 . . . . 0.0 119.179 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 30.6 p-90 -67.59 -22.32 65.37 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 120.742 -1.224 . . . . 0.0 110.376 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.25 -31.26 71.06 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.4 . . . . 0.0 111.944 -178.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -59.77 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.8 mm -66.04 -39.58 84.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.911 -175.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.26 -14.7 60.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.35 0.595 . . . . 0.0 111.658 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -100.16 3.28 43.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.789 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -124.2 144.6 49.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.598 0.714 . . . . 0.0 110.979 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.7 m -79.89 147.16 31.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 104.468 -2.419 . . . . 0.0 104.468 172.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -107.61 123.67 48.81 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -125.95 130.94 52.25 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.455 0.645 . . . . 0.0 109.645 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.05 75.52 1.3 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 178.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.36 -112.65 3.7 Favored Glycine 0 C--O 1.224 -0.528 0 C-N-CA 119.722 -1.228 . . . . 0.0 111.15 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.2 p -93.19 22.15 5.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.532 0.682 . . . . 0.0 110.975 -178.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 54.2 t -123.86 141.03 45.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.7 t -127.68 140.92 51.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 104.286 -2.487 . . . . 0.0 104.286 170.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.2 t -135.86 138.5 47.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -114.33 114.44 45.45 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.08 157.73 30.4 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 115.955 -2.23 . . . . 0.0 111.122 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.09 149.78 31.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 103.023 -2.954 . . . . 0.0 103.023 175.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -147.88 137.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 118.776 0.716 . . . . 0.0 109.602 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 83.1 t -114.18 117.27 55.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.2 140.42 36.5 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.52 -22.68 61.78 Favored Glycine 0 C--N 1.322 -0.222 0 C-N-CA 121.06 -0.591 . . . . 0.0 113.823 -176.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 37.2 p -61.05 -32.06 71.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 18.0 ptp -142.66 40.69 1.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.5 tt -43.29 -45.98 6.12 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.79 -1.55 . . . . 0.0 114.906 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -61.16 -37.29 82.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -43.73 61.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.354 0.597 . . . . 0.0 110.68 -176.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -64.49 -41.16 96.63 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.919 0.866 . . . . 0.0 109.45 179.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.613 HD11 HD11 ' A' ' 11' ' ' ILE . 0.6 OUTLIER -63.49 -43.29 97.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.035 -176.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -73.7 -18.68 60.98 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.298 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.26 -34.85 61.42 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.2 t -90.03 -41.65 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 121.319 0.581 . . . . 0.0 110.283 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.29 79.48 70.17 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.154 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -66.78 -14.19 42.86 Favored 'Trans proline' 0 N--CA 1.474 0.376 0 N-CA-C 114.233 0.82 . . . . 0.0 114.233 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 7.2 m -83.16 2.62 34.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -68.54 132.02 46.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.51 0.672 . . . . 0.0 111.101 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 . . . . . 0 C--N 1.325 -0.482 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 176.831 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 34.2 m120 . . . . . 0 N--CA 1.464 0.227 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.8 71.85 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.941 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -69.06 -45.05 71.34 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 36.3 mmt -62.75 -28.92 70.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.131 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -61.98 -35.53 78.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.172 -0.33 . . . . 0.0 111.742 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -67.32 -44.48 79.05 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.14 0.495 . . . . 0.0 109.713 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -65.21 -38.58 90.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.732 0.777 . . . . 0.0 109.458 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -58.85 -46.68 87.17 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.377 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -66.98 -45.31 78.05 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.0 -40.5 93.79 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.595 -176.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 33.9 p -71.81 -34.74 69.61 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.203 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.28 -34.64 76.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.726 0.41 . . . . 0.0 111.712 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 71.2 t -56.94 -46.94 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 118.47 0.577 . . . . 0.0 110.675 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 C--N 1.324 -0.509 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.432 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.3 tt . . . . . 0 C--O 1.222 -0.389 0 CA-C-O 121.558 0.694 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.03 -35.25 78.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -60.82 -29.73 69.66 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.5 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -61.2 -51.07 70.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -179.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 m -63.76 -42.0 97.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.489 0.661 . . . . 0.0 110.837 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -59.09 -51.75 68.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.97 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -72.37 -28.66 63.17 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.746 -0.596 . . . . 0.0 111.547 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -64.68 -44.42 90.39 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.1 mm -70.84 -37.67 69.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.23 81.64 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.52 -46.12 89.86 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 116.894 -0.139 . . . . 0.0 111.305 178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -54.73 -47.18 74.1 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.228 0.611 . . . . 0.0 112.037 -177.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.07 -45.82 55.14 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.409 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.6 t -56.97 -41.92 77.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 O-C-N 122.032 -0.417 . . . . 0.0 111.4 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.477 HD22 ' C ' ' A' ' 17' ' ' ASN . 0.2 OUTLIER -72.08 -4.78 30.89 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.141 -0.974 . . . . 0.0 112.734 -179.862 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.4 m -98.31 13.56 31.03 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.68 -3.92 53.4 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.394 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.469 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.0 m-85 -69.67 121.69 17.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.627 0.727 . . . . 0.0 109.694 -178.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.62 129.94 9.59 Favored Glycine 0 N--CA 1.449 -0.495 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.5 t -74.01 126.9 35.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.0 mt -96.2 -44.04 12.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -150.17 133.23 16.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 118.936 0.789 . . . . 0.0 112.404 179.434 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.382 0.611 . . . . 0.0 111.541 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -129.89 159.08 37.7 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 115.1 1.519 . . . . 0.0 115.1 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.6 mt -139.25 131.19 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.86 0.864 . . . . 0.0 109.036 176.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -100.92 135.9 41.62 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 mp -129.46 138.1 51.22 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 122.975 0.51 . . . . 0.0 110.095 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.05 137.78 32.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -88.45 107.47 16.96 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 117.905 0.32 . . . . 0.0 111.513 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 81.9 Cg_endo -70.06 -17.01 36.48 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 120.58 0.854 . . . . 0.0 112.474 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -66.62 -25.26 66.52 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.884 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 60.7 42.96 12.94 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 -174.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.2 t -66.47 -177.52 0.57 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 112.577 -2.102 . . . . 0.0 112.943 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.9 p -55.07 -33.98 63.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 178.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 7.8 p80 -107.29 143.24 35.83 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -89.73 -29.72 18.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.721 -173.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.69 164.43 28.85 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.479 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.1 t -130.54 138.07 54.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -123.85 113.65 18.81 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tp -94.57 128.56 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -136.46 118.4 15.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.426 0.557 . . . . 0.0 111.607 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -86.47 94.68 9.47 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.383 -0.823 . . . . 0.0 109.084 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -147.25 135.81 21.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.164 0.506 . . . . 0.0 111.314 -176.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -89.99 151.54 21.63 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 124.951 1.3 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.7 mt -138.32 140.06 39.36 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -176.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -92.86 -44.71 8.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -129.64 160.57 32.92 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.712 -0.618 . . . . 0.0 109.634 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -64.65 -22.42 66.97 Favored 'General case' 0 C--O 1.219 -0.513 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -66.28 -33.36 75.57 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.252 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -69.16 -35.06 75.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 177.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.27 -50.53 67.55 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.327 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.3 m -63.72 -32.79 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 O-C-N 121.452 -0.78 . . . . 0.0 110.297 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.55 -36.92 83.85 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.663 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.78 -46.71 86.72 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.2 mp -69.22 -33.94 60.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.418 -0.801 . . . . 0.0 110.744 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -57.91 -40.81 81.27 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -69.29 -44.74 71.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.477 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.53 -42.92 97.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.1 -31.28 66.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -41.49 98.15 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.214 1.007 . . . . 0.0 109.474 177.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -73.6 -33.93 64.82 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -65.32 -43.34 95.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.92 -33.68 75.16 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.395 0.998 . . . . 0.0 110.556 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.18 -45.36 93.75 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.095 -0.378 . . . . 0.0 110.184 175.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.51 -40.43 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -37.56 69.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.126 -0.359 . . . . 0.0 110.739 178.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -63.08 -40.52 97.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.519 0.2 . . . . 0.0 110.787 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -65.91 -39.62 90.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.192 0.52 . . . . 0.0 110.307 179.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -77.28 -9.66 58.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.868 -0.606 . . . . 0.0 112.6 -179.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.69 14.67 60.86 Favored Glycine 0 CA--C 1.52 0.396 0 CA-C-O 121.43 0.461 . . . . 0.0 113.837 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.5 mtp85 -73.51 148.65 42.9 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.955 -0.733 . . . . 0.0 112.665 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.48 -33.75 71.61 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.539 176.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -154.4 151.67 29.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.5 mmm -118.43 141.84 48.15 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 43.4 tttp -120.82 130.75 54.1 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -132.68 125.92 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.901 0.382 . . . . 0.0 111.857 -171.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.3 tp -88.23 123.32 32.73 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 175.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -116.41 127.97 55.09 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.18 116.36 47.57 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 120.991 0.424 . . . . 0.0 110.734 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -83.56 145.4 28.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -121.45 112.0 17.99 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 173.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.5 m -130.28 154.03 48.03 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -170.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.2 m -67.21 -48.28 68.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -141.41 159.59 41.9 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 -177.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.86 157.84 45.59 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.616 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -61.45 146.86 96.7 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 117.715 -1.056 . . . . 0.0 111.168 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.0 m -70.66 -11.71 15.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 118.983 2.957 . . . . 0.0 118.983 -168.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.42 137.41 21.74 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t0 47.17 14.48 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 119.242 3.053 . . . . 0.0 119.242 171.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -69.02 -21.38 64.13 Favored 'General case' 0 C--N 1.318 -0.771 0 O-C-N 121.026 -1.046 . . . . 0.0 113.605 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -59.3 -31.15 68.88 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.019 -0.425 . . . . 0.0 111.473 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.34 -31.07 72.13 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.196 0.522 . . . . 0.0 109.821 177.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.7 mm -71.1 -40.73 75.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.028 0.442 . . . . 0.0 110.159 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.97 5.38 8.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.461 0.648 . . . . 0.0 110.569 178.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.34 -2.69 15.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.815 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -125.24 137.9 54.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.776 0.798 . . . . 0.0 112.512 -175.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 28.2 m -83.28 122.79 28.9 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.395 -2.446 . . . . 0.0 104.395 175.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -82.79 118.42 23.38 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -119.78 126.2 50.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.943 0.877 . . . . 0.0 111.287 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -127.46 75.45 1.59 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.228 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.76 -112.74 5.26 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 119.951 -1.119 . . . . 0.0 111.277 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 46.8 p -77.98 17.7 0.56 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 83.0 t -130.47 140.53 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 123.01 0.524 . . . . 0.0 110.663 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.8 m -131.51 132.54 44.28 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 169.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.3 t -132.01 133.43 60.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -114.13 109.04 49.73 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.18 159.57 20.37 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 117.247 -1.369 . . . . 0.0 113.644 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.93 159.17 44.73 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 102.973 -2.973 . . . . 0.0 102.973 176.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.0 tt -149.23 139.76 16.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.72 108.72 26.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.61 136.29 33.35 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.11 -23.43 67.88 Favored Glycine 0 C--O 1.225 -0.45 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.404 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 26.7 p -59.0 -28.62 66.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -143.43 35.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.244 1.021 . . . . 0.0 108.355 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.8 tt -46.03 -40.55 10.78 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 -173.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.6 -37.93 85.74 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 119.227 -0.989 . . . . 0.0 112.606 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -42.45 29.27 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.958 0.885 . . . . 0.0 110.573 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -39.42 92.09 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.404 -174.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -68.27 -44.01 76.51 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 122.082 -0.386 . . . . 0.0 110.35 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -73.62 -14.32 61.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.928 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.12 -31.58 62.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 177.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.61 -37.86 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 120.695 0.283 . . . . 0.0 110.964 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -130.16 77.07 77.02 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 122.101 -0.374 . . . . 0.0 111.5 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.64 -13.8 37.99 Favored 'Trans proline' 0 C--N 1.348 0.548 0 N-CA-C 113.819 0.661 . . . . 0.0 113.819 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.9 m -73.26 -10.51 59.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 178.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -102.53 125.64 49.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 . . . . . 0 CA--C 1.513 -0.445 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.33 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 . . . . . 0 C--O 1.223 -0.3 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.33 -36.5 78.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.07 0.462 . . . . 0.0 110.209 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -72.66 -40.92 65.94 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 54.2 mtt -62.09 -37.81 86.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.946 0.403 . . . . 0.0 109.988 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.85 97.47 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 122.178 -0.326 . . . . 0.0 110.247 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -64.58 -44.7 89.84 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.958 0.408 . . . . 0.0 110.121 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -63.38 -43.29 98.02 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.545 0.688 . . . . 0.0 109.953 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 37.6 ttt85 -64.02 -34.68 78.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.786 178.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -63.84 -39.56 94.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.215 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.96 -37.68 88.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.951 0.405 . . . . 0.0 109.995 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 14.5 m -69.74 -35.02 74.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.55 0.69 . . . . 0.0 110.904 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -42.93 74.3 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -62.57 -32.99 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 120.494 -0.483 . . . . 0.0 109.882 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.211 -0.968 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.538 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.468 0.43 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.1 -36.79 82.8 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.193 -0.317 . . . . 0.0 111.138 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -32.36 73.93 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -62.95 -52.54 62.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.2 m -59.96 -42.09 93.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.766 0.317 . . . . 0.0 110.73 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -56.29 -55.37 34.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 123.063 0.545 . . . . 0.0 112.15 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -71.07 -28.98 64.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 121.725 -0.61 . . . . 0.0 111.94 -178.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -70.51 -35.58 73.28 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.834 -0.541 . . . . 0.0 110.153 176.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' A' ' 11' ' ' ILE . 4.0 mm -69.38 -42.05 81.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.27 81.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.31 92.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.522 178.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -59.47 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.728 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.7 mt -63.87 -50.01 70.5 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.464 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.95 -42.34 89.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.757 0.313 . . . . 0.0 110.569 -177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -4.35 38.12 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.8 m -103.12 7.82 38.73 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.722 0.409 . . . . 0.0 110.655 176.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.98 0.33 35.95 Favored Glycine 0 C--O 1.228 -0.246 0 N-CA-C 116.527 1.371 . . . . 0.0 116.527 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.453 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.9 m-85 -72.89 117.96 15.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 118.312 1.056 . . . . 0.0 109.519 177.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.79 134.89 17.01 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.8 t -78.12 126.1 38.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 117.733 0.767 . . . . 0.0 109.481 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.401 HD11 HD22 ' A' ' 43' ' ' LEU . 51.9 mt -98.64 -47.98 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -149.64 138.68 21.18 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.435 0 CA-C-N 118.847 0.749 . . . . 0.0 112.65 179.897 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 . . . . . 0 C--O 1.237 0.407 0 CA-C-O 121.61 0.719 . . . . 0.0 110.837 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.63 154.94 47.36 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.126 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.2 mt -139.4 132.23 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 41.5 m95 -108.58 127.5 54.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.9 mm? -124.01 140.93 52.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.557 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -84.62 126.61 33.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 176.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.73 123.84 88.51 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.4 -29.22 14.0 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 115.56 -2.493 . . . . 0.0 113.12 -178.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -71.3 -31.97 68.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.186 0.517 . . . . 0.0 112.11 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 58.07 38.31 26.57 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.829 1.775 . . . . 0.0 108.68 -176.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.6 t -60.78 -172.63 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.725 171.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.0 m -41.52 -26.13 0.06 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -114.92 139.92 49.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 165.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -86.34 -31.58 21.47 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.843 -0.536 . . . . 0.0 109.786 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.401 HD22 HD11 ' A' ' 23' ' ' ILE . 68.9 mt -140.43 164.62 29.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 -177.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.2 p -135.29 137.36 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -111.83 125.17 53.73 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.13 124.66 39.29 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 104.009 -2.589 . . . . 0.0 104.009 174.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -136.44 125.55 24.51 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -175.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -107.34 99.16 8.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.878 0.847 . . . . 0.0 112.454 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.92 150.1 34.54 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.618 -179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.88 144.44 33.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.72 133.85 55.32 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -85.0 -39.88 17.53 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 122.37 1.081 . . . . 0.0 108.93 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -132.05 157.34 44.41 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -64.35 -19.55 65.54 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -178.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.412 ' HA ' HG22 ' A' ' 58' ' ' VAL . 6.9 pt20 -62.34 -33.24 74.33 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -69.5 -33.04 72.27 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.412 ' O ' HD12 ' A' ' 61' ' ' ILE . 4.8 ttm -72.65 -48.45 39.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.798 177.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 55' ' ' GLN . 23.6 m -58.05 -36.75 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.16 -29.8 65.66 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.668 -178.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -64.52 -39.18 93.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.412 HD12 ' O ' ' A' ' 57' ' ' MET . 2.9 mt -74.12 -38.32 48.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 122.004 -0.435 . . . . 0.0 111.857 179.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -66.59 -29.66 69.77 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.53 -37.76 56.17 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -56.71 -34.29 67.32 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.535 178.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.01 67.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.04 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -69.3 -46.17 67.8 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.908 0.776 . . . . 0.0 109.097 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 -56.74 -43.78 81.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.4 -34.2 57.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.076 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.84 -42.0 95.28 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.685 1.13 . . . . 0.0 109.636 176.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.43 -46.37 90.39 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.36 -38.95 82.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 178.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.57 -44.2 89.66 Favored 'General case' 0 CA--C 1.511 -0.54 0 O-C-N 121.842 -0.536 . . . . 0.0 110.22 179.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -66.06 -45.18 82.29 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -61.3 -41.43 96.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -90.0 -5.78 56.31 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.04 9.0 45.62 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 116.413 1.325 . . . . 0.0 116.413 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -67.22 146.62 54.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.912 -0.758 . . . . 0.0 110.477 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -62.41 -35.59 79.71 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.068 0.461 . . . . 0.0 110.338 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -149.49 148.37 29.33 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 175.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -113.75 139.04 49.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -116.06 132.06 56.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -134.56 125.57 27.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.514 0.597 . . . . 0.0 111.022 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.8 tp -89.13 124.44 34.33 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 174.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -113.89 108.64 17.33 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.53 111.55 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.807 0.337 . . . . 0.0 110.52 -176.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -82.78 133.06 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 176.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -111.27 109.47 19.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.0 m -127.31 155.59 43.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.057 0.456 . . . . 0.0 112.108 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.6 m -71.2 -46.92 60.2 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 175.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -138.85 158.76 43.63 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -175.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 146.13 39.61 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.862 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.68 150.3 88.41 Favored 'Trans proline' 0 C--N 1.345 0.363 0 O-C-N 121.895 0.418 . . . . 0.0 113.177 178.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -79.46 -7.49 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 116.728 2.121 . . . . 0.0 116.728 -173.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -108.49 97.0 6.73 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 14.96 55.62 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -73.12 -12.83 61.04 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.71 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.62 -31.16 70.36 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.828 -0.545 . . . . 0.0 111.735 -177.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.77 -33.2 74.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.219 0.533 . . . . 0.0 110.249 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.0 mm -67.25 -37.11 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -176.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.21 73.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.383 0.611 . . . . 0.0 110.824 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.76 -9.31 54.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.367 0.603 . . . . 0.0 111.078 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -88.14 95.74 10.27 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.157 -178.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 86.3 m -68.51 124.24 23.02 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 173.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -87.41 108.28 18.93 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -106.18 128.41 53.91 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.516 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -132.15 75.54 1.64 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.524 -1.288 . . . . 0.0 107.524 177.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.68 5.21 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.116 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.1 p -79.32 20.72 0.51 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.2 t -127.68 141.12 47.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.5 t -139.21 112.89 8.42 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.225 -1.769 . . . . 0.0 106.225 173.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.6 t -109.73 129.4 64.67 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 122.561 1.172 . . . . 0.0 110.311 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -102.07 99.73 13.2 Favored Pre-proline 0 N--CA 1.425 -1.699 0 CA-C-N 111.801 -2.454 . . . . 0.0 107.919 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.94 151.87 21.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 115.292 -2.672 . . . . 0.0 113.032 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.54 150.84 31.76 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 175.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -144.15 134.29 20.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.8 m -115.36 127.59 72.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 103.679 -2.711 . . . . 0.0 103.679 175.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.68 136.34 54.87 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -176.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -46.91 -39.03 10.82 Favored Glycine 0 N--CA 1.461 0.304 0 N-CA-C 117.268 1.667 . . . . 0.0 117.268 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -37.34 63.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.4 ptm -136.53 34.38 2.72 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.961 1.362 . . . . 0.0 108.673 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.3 tp -51.0 -38.52 51.76 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 116.966 2.21 . . . . 0.0 116.966 -172.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -64.97 -41.15 95.71 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.656 0.662 . . . . 0.0 111.255 -177.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.92 -37.57 70.02 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -65.91 -40.89 91.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.596 0.712 . . . . 0.0 110.811 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.36 -49.03 78.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.161 -177.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -71.76 -15.11 62.17 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.432 -177.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.99 -35.66 57.0 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.249 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.0 p -94.81 -37.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 120.853 0.359 . . . . 0.0 111.583 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -130.1 75.51 79.27 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 122.036 -0.415 . . . . 0.0 110.662 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.43 -13.83 40.51 Favored 'Trans proline' 0 C--N 1.349 0.598 0 CA-C-O 121.392 0.497 . . . . 0.0 112.813 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 11.9 p -75.62 -8.3 56.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.074 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -78.3 124.83 28.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.301 0.572 . . . . 0.0 110.704 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 . . . . . 0 C--N 1.322 -0.59 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.004 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 C--O 1.217 -0.618 0 CA-C-O 120.992 0.425 . . . . 0.0 110.198 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.7 64.72 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.47 -45.91 85.32 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 75.4 mtm -69.6 -28.93 66.36 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.017 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.97 -31.22 69.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 122.159 -0.338 . . . . 0.0 111.575 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -65.81 -43.72 87.78 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -69.62 -36.63 76.32 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.434 0.635 . . . . 0.0 109.363 -179.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.28 92.55 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.657 177.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -66.78 -40.61 88.24 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.787 0.435 . . . . 0.0 111.86 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.7 mt -64.99 -37.78 88.8 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 121.68 -0.638 . . . . 0.0 110.039 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 38.7 m -69.06 -31.72 70.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.612 0.72 . . . . 0.0 110.282 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.88 -45.49 64.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.943 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.09 -33.06 60.99 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 CA--C 1.536 0.406 0 O-C-N 121.428 -0.795 . . . . 0.0 109.37 176.15 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 pp . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 121.024 0.44 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.32 -36.54 82.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.897 0.379 . . . . 0.0 111.385 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -68.58 -29.58 68.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.332 -0.23 . . . . 0.0 110.679 -179.348 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.97 -50.0 73.84 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.157 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -64.79 -41.48 95.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.529 179.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -54.5 -52.34 62.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.986 0.422 . . . . 0.0 110.936 179.548 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -73.3 -29.27 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.005 -0.434 . . . . 0.0 111.977 -179.852 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -68.7 -36.09 78.01 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.546 -0.721 . . . . 0.0 111.304 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.6 mm -70.25 -39.08 76.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.843 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.27 -44.56 84.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.72 -42.32 95.33 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.968 178.347 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -62.2 -43.06 99.69 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.655 0.264 . . . . 0.0 111.371 -179.097 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 mt -69.84 -46.26 66.0 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.173 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 40.9 t -54.56 -42.55 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.956 -0.465 . . . . 0.0 110.857 173.171 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -61.35 -33.82 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 110.839 178.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -79.65 9.49 5.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 122.922 0.489 . . . . 0.0 112.271 177.886 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.19 -0.21 61.93 Favored Glycine 0 CA--C 1.517 0.212 0 N-CA-C 116.415 1.326 . . . . 0.0 116.415 175.507 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.8 m-85 -68.27 132.23 46.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.93 0.865 . . . . 0.0 110.075 179.891 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.33 133.4 11.77 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.217 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.9 t -75.38 121.45 27.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.3 mt -85.67 -46.07 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 177.102 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -160.52 132.3 5.94 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 174.731 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.515 -0.373 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -147.68 143.89 27.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -136.69 133.08 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 177.039 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 57.5 m95 -112.25 133.12 54.55 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.142 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.59 131.59 48.16 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 123.426 0.69 . . . . 0.0 109.69 -178.716 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -80.92 132.91 35.46 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.686 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.74 109.59 12.53 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.338 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.2 Cg_endo -74.72 -19.0 19.01 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 117.182 -1.412 . . . . 0.0 112.239 -178.044 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -68.83 -27.88 66.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.908 178.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 77.7 mttt 58.74 41.96 20.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 123.175 1.465 . . . . 0.0 107.106 -178.535 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -177.08 0.24 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 111.188 -2.733 . . . . 0.0 113.409 -179.47 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.7 p -51.9 -28.22 15.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.704 175.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.532 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 46.8 p-80 -107.36 143.82 35.11 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 173.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -85.94 -36.9 19.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.566 -172.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -141.66 163.26 33.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.13 -177.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.0 t -122.84 134.57 65.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 175.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.25 127.7 38.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.759 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.9 mt -97.51 129.81 44.64 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -136.56 150.37 48.58 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -115.08 131.5 56.91 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 173.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.69 140.43 20.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.588 0.233 . . . . 0.0 111.265 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -93.01 125.51 37.64 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 175.085 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -128.49 101.48 6.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.137 -0.352 . . . . 0.0 111.11 -174.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.0 -42.15 58.03 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.925 0.869 . . . . 0.0 111.251 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -129.19 156.89 43.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.316 -179.324 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HD2' HD11 ' A' ' 99' ' ' ILE . 25.7 ptt180 -65.82 -20.58 66.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 122.05 -0.406 . . . . 0.0 111.249 -178.355 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -62.34 -33.31 74.45 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -72.47 -34.65 67.88 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 121.537 -0.727 . . . . 0.0 109.186 178.264 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -65.25 -47.43 76.8 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.005 178.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.2 m -64.78 -31.76 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.538 -0.726 . . . . 0.0 111.207 179.442 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -68.13 -36.17 79.29 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.619 179.417 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.39 -44.81 92.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.4 -30.74 51.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -176.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.15 -40.5 96.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -70.59 -41.07 72.83 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.412 ' O ' HG23 ' A' ' 68' ' ' VAL . 83.2 mm-40 -57.08 -48.22 79.12 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.009 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.36 94.25 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.603 -177.891 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.55 -38.85 88.01 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 121.545 0.688 . . . . 0.0 110.281 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -61.19 -42.78 99.18 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.345 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.486 HG11 HG13 ' A' ' 109' ' ' VAL . 81.9 t -69.06 -38.71 78.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 119.131 -0.461 . . . . 0.0 112.111 -179.448 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -56.55 -41.16 76.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.038 0.835 . . . . 0.0 110.201 179.812 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.3 mtm-85 -63.55 -33.46 75.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.496 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.8 t -76.72 -44.38 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.4 mmt-85 -61.05 -34.82 75.48 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -58.04 -39.64 78.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.144 0.497 . . . . 0.0 109.884 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -73.41 -38.65 65.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.918 0.389 . . . . 0.0 111.087 179.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.28 -18.02 60.78 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -177.261 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.38 -3.08 1.95 Allowed Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.776 1.471 . . . . 0.0 116.776 179.311 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.27 143.39 43.05 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -62.18 -36.58 82.31 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -149.14 157.86 43.71 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.231 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.38 157.76 27.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.532 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 17.5 mmtt -143.41 132.01 22.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 174.509 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tt -142.47 127.41 18.35 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -175.198 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.4 tp -83.12 104.08 13.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 175.309 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -102.62 108.55 19.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.7 t -100.38 112.32 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.314 -176.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -91.41 106.78 18.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.417 0.627 . . . . 0.0 112.045 -179.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -79.19 126.89 31.35 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 92.2 p -141.42 164.04 31.3 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 122.696 0.398 . . . . 0.0 110.669 -174.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 74.3 m -69.7 -49.07 56.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 176.231 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -153.54 177.85 10.48 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 -175.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.439 ' HB2' ' HD2' ' A' ' 117' ' ' ARG . . . -96.01 151.19 38.12 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.638 -174.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.58 149.74 80.42 Favored 'Trans proline' 0 C--N 1.351 0.661 0 O-C-N 122.475 0.724 . . . . 0.0 113.079 174.831 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.0 m -80.26 -10.71 12.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -175.45 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -117.57 74.87 0.95 Allowed 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -172.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 53.38 49.16 20.3 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 174.083 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 49.5 p-90 -68.16 -19.71 64.82 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 121.522 -0.736 . . . . 0.0 109.875 175.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -63.06 -34.56 77.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.59 -35.2 70.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 176.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.557 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.3 mm -71.12 -44.57 74.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.132 0.491 . . . . 0.0 111.095 -176.341 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -67.96 -27.89 66.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.645 0.736 . . . . 0.0 111.79 -177.414 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -93.89 6.22 49.14 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.236 -177.049 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -119.89 144.41 47.42 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.407 0.622 . . . . 0.0 111.436 176.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.7 m -88.2 127.77 35.45 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.415 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -85.0 129.77 34.74 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 175.582 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -132.32 128.96 38.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.543 0.687 . . . . 0.0 110.091 178.475 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -149.54 114.78 5.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.251 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 58.01 -127.29 44.71 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.477 -0.868 . . . . 0.0 114.195 177.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.8 p -82.46 13.11 3.85 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 122.746 0.419 . . . . 0.0 111.155 -178.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.486 HG13 HG11 ' A' ' 68' ' ' VAL . 2.3 t -123.57 149.9 27.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -176.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.9 t -138.43 139.75 39.02 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 100.259 -3.978 . . . . 0.0 100.259 171.175 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.6 t -136.31 136.57 48.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 118.42 0.554 . . . . 0.0 109.806 -177.189 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -105.62 113.77 63.73 Favored Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 171.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.497 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 69.6 Cg_endo -76.36 158.28 36.88 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 116.158 -2.094 . . . . 0.0 111.638 176.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 152.78 37.66 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.2 tt -145.13 138.01 21.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -177.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 96.5 t -118.16 119.97 63.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.016 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.439 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -85.91 156.55 20.46 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 179.687 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.69 -27.67 53.44 Favored Glycine 0 C--N 1.318 -0.456 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 168.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 p -67.66 -42.82 81.56 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -177.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptp -128.28 37.98 4.06 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.559 1.171 . . . . 0.0 109.281 -179.272 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -45.55 -43.27 11.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.59 -1.641 . . . . 0.0 115.07 -177.233 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.3 mtm180 -69.5 -31.49 69.78 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.495 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -72.31 -41.54 66.44 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.443 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -64.5 -41.5 96.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.495 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.38 -42.14 98.24 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.568 -0.73 . . . . 0.0 112.371 -179.446 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -76.38 -14.34 60.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 119.813 1.188 . . . . 0.0 112.105 -179.07 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -85.09 -40.01 17.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.27 0.557 . . . . 0.0 110.246 178.705 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 42.6 t -91.57 -40.87 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.417 0.627 . . . . 0.0 110.816 -177.523 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -128.44 70.57 79.73 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.876 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.04 -15.69 49.54 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 CA-C-N 118.39 0.461 . . . . 0.0 113.147 179.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.7 m -83.37 0.34 46.4 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -73.34 137.02 44.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.327 0.584 . . . . 0.0 109.683 179.376 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 . . . . . 0 C--N 1.325 -0.496 0 CA-C-O 121.592 0.71 . . . . 0.0 109.805 -179.151 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 . . . . . 0 C--O 1.216 -0.689 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.15 90.2 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.854 -0.529 . . . . 0.0 111.496 177.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -65.86 -41.98 90.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 179.446 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 63.2 mtt -67.68 -29.01 68.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.397 178.299 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.06 -34.07 75.56 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.048 -0.407 . . . . 0.0 111.803 -179.298 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 76.7 ttt-85 -65.41 -46.68 79.06 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 178.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.65 -46.07 91.35 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.356 -0.537 . . . . 0.0 109.881 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -60.7 -35.52 76.49 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.328 -178.364 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -65.76 -41.36 92.18 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.538 0.208 . . . . 0.0 111.004 176.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.2 mt -66.07 -35.94 81.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.033 0.444 . . . . 0.0 110.109 -179.523 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.5 t -69.77 -42.94 73.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.483 0.659 . . . . 0.0 109.422 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.32 -46.0 90.7 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -177.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -58.68 -39.4 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 118.966 0.803 . . . . 0.0 111.986 -175.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.6 tm? . . . . . 0 C--N 1.326 -0.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.165 178.305 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 56.0 tp . . . . . 0 N--CA 1.47 0.559 0 CA-C-O 121.824 0.821 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 36.2 mt -59.9 -35.32 74.6 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.986 -178.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 43.4 mt-10 -67.38 -26.0 66.24 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.17 -177.165 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.24 -52.74 63.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.65 -41.89 68.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.899 178.691 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.434 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 77.0 t80 -56.85 -52.16 66.18 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.052 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -73.8 -33.53 64.23 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.653 -0.654 . . . . 0.0 112.269 -179.506 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -69.16 -34.82 75.57 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.417 -0.802 . . . . 0.0 111.034 178.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 125' ' ' LEU . 11.8 mm -72.72 -34.05 46.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 177.045 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.09 84.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 175.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.81 87.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.568 178.032 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -60.33 -46.06 91.24 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.23 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -64.99 -43.14 93.56 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.523 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.72 -43.01 94.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.28 179.775 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.5 p30 -75.38 -10.56 59.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.3 -0.875 . . . . 0.0 112.079 178.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.2 m -89.98 6.05 43.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 173.723 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.92 -0.51 67.1 Favored Glycine 0 CA--C 1.517 0.172 0 N-CA-C 116.353 1.301 . . . . 0.0 116.353 175.623 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -66.39 131.1 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 118.187 0.993 . . . . 0.0 110.0 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.94 131.65 10.56 Favored Glycine 0 N--CA 1.451 -0.357 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 -178.208 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.6 t -74.57 125.82 34.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 61.3 mt -93.65 -48.43 13.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.58 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -149.49 128.76 12.87 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 175.119 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 . . . . . 0 C--O 1.222 -0.366 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -133.28 152.07 51.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.262 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 25.8 mt -140.55 134.61 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 175.063 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 m95 -109.04 132.25 54.29 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -125.72 135.38 52.02 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.447 ' HA ' HD23 ' A' ' 43' ' ' LEU . 25.0 tt0 -94.75 133.59 38.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 175.748 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.75 128.17 93.75 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -77.78 -28.54 5.1 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 116.657 -1.762 . . . . 0.0 114.378 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -77.67 -28.62 51.21 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 123.62 0.768 . . . . 0.0 112.033 -178.39 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 55.09 40.6 31.95 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.4 m -66.09 -173.12 0.17 Allowed 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 164.612 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.7 t -41.25 -39.45 1.36 Allowed 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -75.84 123.8 26.26 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -104.82 -26.32 12.28 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 176.955 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 34' ' ' GLU . 96.4 mt -140.35 155.41 46.79 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -176.488 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.4 t -132.83 136.12 56.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 175.176 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -124.8 129.93 51.4 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.8 mt -102.55 131.43 49.28 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 174.448 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -136.4 103.03 5.14 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -174.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.9 96.38 7.02 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 178.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -151.69 122.73 7.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.125 -173.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.04 151.38 28.42 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.1 mt -138.59 110.46 7.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -173.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.26 -40.37 67.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -134.15 155.59 49.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.902 -175.206 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -63.87 -22.92 67.14 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 177.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.6 -39.51 88.42 Favored 'General case' 0 C--O 1.211 -0.945 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.424 -179.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.26 -37.02 80.32 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.495 ' O ' HD12 ' A' ' 61' ' ' ILE . 18.1 ttt -60.45 -51.6 68.77 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.379 178.925 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.42 -32.53 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 118.895 0.771 . . . . 0.0 111.116 -179.138 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.1 mtm105 -66.53 -38.1 86.43 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.834 0.349 . . . . 0.0 110.439 -178.823 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -60.34 -39.72 88.12 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.013 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.495 HD12 ' O ' ' A' ' 57' ' ' MET . 2.7 mp -74.18 -34.36 37.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.305 -0.872 . . . . 0.0 111.364 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -63.06 -35.33 79.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -68.7 -43.44 76.03 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 175.66 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -58.42 -40.99 83.97 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 121.663 -0.648 . . . . 0.0 110.539 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.65 -43.4 84.72 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 122.233 -0.292 . . . . 0.0 110.777 -178.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -64.64 -47.5 78.3 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.338 0.59 . . . . 0.0 110.017 179.146 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -59.14 -49.41 77.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.955 179.353 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.1 p -72.91 -32.34 39.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.685 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.0 -40.16 94.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 118.984 0.811 . . . . 0.0 111.036 -178.074 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -61.16 -35.3 76.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.232 -178.632 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.08 -50.46 19.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 178.371 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -71.08 -30.35 66.45 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -172.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -56.87 -29.65 63.13 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.613 0.642 . . . . 0.0 110.5 177.24 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.63 -21.19 66.55 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 mp -82.73 -12.35 57.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.912 0.387 . . . . 0.0 110.255 178.592 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.18 11.04 66.74 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.224 -0.513 . . . . 0.0 113.459 -178.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -67.26 136.94 55.71 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.258 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -63.18 -35.69 81.15 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -174.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.1 ptt85 -153.25 156.55 38.69 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 174.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -115.85 154.31 29.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.982 0.513 . . . . 0.0 111.451 -177.823 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -136.51 125.37 24.1 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 167.394 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.59 145.02 42.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.662 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.4 tp -108.64 121.28 44.69 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 172.486 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -115.86 108.69 16.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.035 0.38 . . . . 0.0 110.254 -178.641 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -104.94 107.71 23.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 111.997 -176.433 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -77.17 147.94 36.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.176 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -127.14 114.95 18.38 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 171.038 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -133.55 160.15 38.31 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.34 0.656 . . . . 0.0 109.978 -173.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -75.97 -50.14 15.73 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.572 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -124.26 158.39 32.63 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 106.553 -1.647 . . . . 0.0 106.553 -176.231 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.36 150.11 56.63 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 177.229 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -58.2 146.61 87.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 118.152 -0.766 . . . . 0.0 113.353 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.56 -12.43 15.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 115.808 1.781 . . . . 0.0 115.808 -174.035 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -133.34 137.84 46.1 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 121.947 -0.471 . . . . 0.0 112.21 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.9 t0 14.57 59.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 119.087 2.995 . . . . 0.0 119.087 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 22.7 p-90 -87.43 -24.1 24.29 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 121.133 -0.98 . . . . 0.0 109.73 178.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -64.17 -35.4 80.67 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 121.392 -0.818 . . . . 0.0 112.905 -174.446 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.8 -20.84 61.08 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.223 178.504 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.7 mm -70.41 -39.09 76.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.557 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.542 0.687 . . . . 0.0 111.153 -179.591 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -89.1 1.17 55.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.174 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -103.31 101.15 11.07 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.8 m -70.19 123.25 21.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 173.967 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -84.22 123.3 29.97 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 178.001 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.82 127.96 48.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.795 0.807 . . . . 0.0 109.302 179.237 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -145.5 122.12 11.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.229 -178.746 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.21 -112.95 5.42 Favored Glycine 0 C--O 1.226 -0.405 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 75.7 p -105.01 -2.9 23.89 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 178.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.0 t -96.84 139.47 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 76.3 p -119.69 140.15 51.11 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.631 -2.359 . . . . 0.0 104.631 168.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.32 130.96 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.795 0 CA-C-O 121.984 0.897 . . . . 0.0 110.044 179.106 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -100.59 109.46 57.45 Favored Pre-proline 0 N--CA 1.427 -1.624 0 CA-C-N 113.632 -1.622 . . . . 0.0 109.384 -179.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.5 154.61 21.16 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 117.894 -0.937 . . . . 0.0 112.085 178.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.89 151.95 30.96 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 175.553 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.7 tt -145.69 132.71 15.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.777 0.799 . . . . 0.0 110.489 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 99.2 t -104.72 126.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 175.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.89 142.91 43.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 104.511 -2.403 . . . . 0.0 104.511 176.329 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.5 -20.64 59.27 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.531 -0.366 . . . . 0.0 113.926 -175.555 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 55.6 p -62.49 -27.82 69.4 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.261 0.838 . . . . 0.0 113.261 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 19.5 ptp -146.9 44.46 1.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.71 1.243 . . . . 0.0 107.714 178.231 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tp -42.79 -50.41 5.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.606 -1.634 . . . . 0.0 114.777 -175.473 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -66.99 -36.23 81.7 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.63 -38.77 64.93 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.876 0.47 . . . . 0.0 110.347 -175.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -68.77 -38.97 80.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 176.128 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.447 HD11 HD11 ' A' ' 11' ' ' ILE . 1.8 tm? -59.39 -50.18 74.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.439 -177.615 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -71.92 -14.54 61.96 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.58 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.64 -37.26 50.39 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 122.061 -0.399 . . . . 0.0 109.957 177.123 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.7 p -90.28 -36.99 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -128.67 76.13 79.04 Favored Pre-proline 0 C--N 1.326 -0.44 0 C-N-CA 122.613 0.365 . . . . 0.0 110.657 178.205 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.02 -14.68 41.7 Favored 'Trans proline' 0 C--N 1.349 0.596 0 CA-C-O 121.1 0.375 . . . . 0.0 112.904 178.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -76.47 -8.98 58.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.798 177.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -72.39 138.54 47.28 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.548 0 CA-C-O 121.738 0.78 . . . . 0.0 112.254 -179.398 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 . . . . . 0 C--O 1.217 -0.648 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.06 88.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.03 0.443 . . . . 0.0 110.681 177.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.9 tm0? -68.53 -49.81 56.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.5 mtt -64.92 -29.74 70.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -178.308 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.92 -33.24 64.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.518 0.192 . . . . 0.0 111.518 -179.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -63.98 -47.43 80.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-O 120.959 0.409 . . . . 0.0 109.925 177.878 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -68.18 -38.95 82.57 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.213 0.53 . . . . 0.0 110.573 -177.496 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -66.11 -38.17 87.53 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.153 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -63.9 -44.04 94.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.872 0.368 . . . . 0.0 111.207 176.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.18 -33.29 75.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.991 0.425 . . . . 0.0 110.452 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -76.06 -35.77 59.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.576 0.703 . . . . 0.0 110.954 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.2 tt -65.63 -41.23 92.89 Favored 'General case' 0 C--O 1.218 -0.58 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.655 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.5 p -58.08 -39.5 72.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.149 -0.621 . . . . 0.0 111.248 -176.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.0 tm? . . . . . 0 C--N 1.328 -0.358 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.15 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 N--CA 1.464 0.264 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.8 tp -57.61 -43.7 84.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.064 0.459 . . . . 0.0 110.886 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.99 -29.82 70.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.336 -179.61 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -59.56 -55.65 31.86 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 179.785 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.9 m -60.41 -40.68 91.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.164 0.507 . . . . 0.0 111.561 -178.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -56.85 -43.55 81.27 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 178.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -78.84 -35.15 44.44 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 123.086 1.422 . . . . 0.0 109.151 -177.236 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -64.91 -39.11 93.02 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 113.131 -1.85 . . . . 0.0 111.798 -176.912 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 26.0 mm -70.23 -37.68 72.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.17 -42.54 91.03 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.318 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.19 -41.89 94.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 177.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -58.27 -46.71 85.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -67.85 -49.42 62.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.21 -43.01 88.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.052 -177.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -11.28 60.86 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.73 -0.606 . . . . 0.0 112.478 -179.028 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.9 m -95.49 6.79 48.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.7 -1.2 52.51 Favored Glycine 0 C--O 1.228 -0.247 0 N-CA-C 115.989 1.156 . . . . 0.0 115.989 176.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.03 118.85 11.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 118.519 1.159 . . . . 0.0 109.103 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.66 127.52 16.31 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 108.772 -1.731 . . . . 0.0 108.772 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.48 130.51 35.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.539 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.39 -41.41 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.244 -176.867 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -140.71 140.24 34.86 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 103.881 -2.637 . . . . 0.0 103.881 178.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HA ' HG23 ' A' ' 31' ' ' ILE . . . . . . . . 0 C--N 1.327 -0.41 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.206 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 . . . . . 0 N--CA 1.468 0.455 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.97 158.63 28.67 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.461 HG23 ' HA ' ' A' ' 25' ' ' ALA . 7.2 mt -138.33 127.42 32.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.51 132.47 55.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -127.62 131.85 49.84 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 123.542 0.526 . . . . 0.0 109.684 -178.421 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -84.15 134.48 34.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 114.97 34.88 Favored Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.389 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -73.61 -28.07 12.21 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 117.239 -1.374 . . . . 0.0 114.157 -174.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -9.88 59.25 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 122.171 -0.331 . . . . 0.0 111.461 -179.502 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.7 mtmm 62.2 39.68 12.44 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 -175.176 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -177.71 0.63 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 111.519 -2.582 . . . . 0.0 115.726 -176.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -44.99 -28.09 0.63 Allowed 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 177.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -114.51 141.43 47.72 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 174.053 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.06 -36.85 55.62 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -178.739 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.7 mt -140.65 163.02 33.99 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 87.0 t -128.19 136.56 59.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 105.213 -2.144 . . . . 0.0 105.213 174.569 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -123.48 129.19 50.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.881 0.372 . . . . 0.0 110.23 179.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.4 mt -109.87 120.86 43.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 176.407 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -136.45 132.85 35.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 117.95 0.341 . . . . 0.0 110.289 -176.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -106.96 118.79 37.62 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.212 0.529 . . . . 0.0 110.41 179.518 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -151.55 150.18 30.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -86.05 143.27 28.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.9 mt -143.69 103.58 4.09 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -79.62 -38.41 33.89 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 121.769 0.795 . . . . 0.0 111.99 -178.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.1 152.77 48.33 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.952 -0.468 . . . . 0.0 110.116 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -64.02 -20.9 66.24 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.7 -33.49 76.08 Favored 'General case' 0 C--O 1.213 -0.863 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.875 179.301 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.07 -32.28 64.92 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 28.6 ttm -66.23 -51.02 61.64 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.448 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.4 m -61.91 -34.55 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 118.82 0.736 . . . . 0.0 111.291 178.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -64.71 -38.25 90.34 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 120.752 0.311 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.75 -44.07 94.0 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.417 HG21 ' HB2' ' A' ' 104' ' ' PHE . 1.3 mm -66.14 -31.15 52.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.54 -0.464 . . . . 0.0 112.13 -177.474 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.14 -39.77 94.72 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 177.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -68.52 -44.9 73.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.145 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -57.97 -44.17 86.91 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.87 -43.85 90.94 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 111.477 0.177 . . . . 0.0 111.477 -176.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.08 -36.26 77.41 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.88 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -64.21 -45.74 86.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.548 177.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.69 -37.87 81.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.648 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -61.6 -41.65 97.74 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 122.211 -0.306 . . . . 0.0 110.643 178.76 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.8 mtt85 -62.98 -44.72 95.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.426 179.139 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.24 -40.81 90.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.485 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.2 OUTLIER -68.0 -40.54 83.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.249 -0.907 . . . . 0.0 111.619 179.659 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -60.16 -35.96 76.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.926 0.393 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -60.75 -31.11 70.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -179.241 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.81 9.06 10.62 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -177.348 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.09 5.67 21.43 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 121.472 3.349 . . . . 0.0 121.472 171.274 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.44 146.61 53.83 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.877 1.839 . . . . 0.0 107.44 178.763 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.8 tpt85 -62.31 -42.67 99.56 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -174.596 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -147.39 152.31 37.95 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 118.918 0.781 . . . . 0.0 110.307 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . 0.441 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -100.4 163.83 12.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.37 123.08 12.58 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.775 -3.787 . . . . 0.0 100.775 174.746 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.41 114.27 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.879 0.763 . . . . 0.0 111.803 -173.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 62.2 tp -81.46 117.26 21.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.011 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -111.47 109.52 19.51 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.28 112.18 35.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 120.866 0.365 . . . . 0.0 111.955 -176.483 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -85.76 117.78 24.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.11 177.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -94.23 111.44 23.18 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 174.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.2 p -122.16 155.19 36.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.83 0.348 . . . . 0.0 111.111 -176.038 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 16.4 m -67.24 -48.41 67.86 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 176.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -148.72 159.81 43.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 -177.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.09 159.12 40.45 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.717 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.34 147.84 65.0 Favored 'Trans proline' 0 C--N 1.351 0.699 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 179.151 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.2 m -84.44 -5.24 9.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.4 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -115.03 97.11 6.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.649 0.38 . . . . 0.0 111.316 -177.325 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 14.55 64.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 117.9 2.555 . . . . 0.0 117.9 176.506 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 54.8 p-90 -83.57 -16.74 44.21 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -37.06 71.54 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -173.957 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -66.06 -23.95 66.63 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.644 -0.66 . . . . 0.0 111.686 178.533 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.1 mm -67.07 -37.3 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -176.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.99 -22.9 64.95 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -92.04 3.27 55.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.217 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -102.72 98.45 8.47 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 122.033 -0.417 . . . . 0.0 111.63 -178.23 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.6 m -68.04 126.54 29.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 174.251 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . 0.417 ' HB2' HG21 ' A' ' 61' ' ' ILE . 9.5 t80 -82.72 109.03 16.53 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -111.07 114.43 27.7 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.327 -176.226 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -134.57 80.48 1.85 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.609 -177.774 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.13 -108.48 2.49 Favored Glycine 0 CA--C 1.517 0.185 0 C-N-CA 118.902 -1.618 . . . . 0.0 112.747 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.0 p -86.92 11.59 13.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.221 0.608 . . . . 0.0 111.062 179.489 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 92.6 t -120.68 141.06 42.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -176.317 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.8 t -141.23 127.4 19.63 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 104.45 -2.426 . . . . 0.0 104.45 169.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.1 t -133.64 123.49 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -102.89 115.8 63.59 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.046 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -79.86 157.58 24.21 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 116.033 -2.178 . . . . 0.0 112.975 179.257 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.78 151.83 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.615 -2.735 . . . . 0.0 103.615 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.1 tt -146.18 142.68 21.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.1 m -124.34 138.19 54.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 104.478 -2.415 . . . . 0.0 104.478 174.373 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.38 142.35 43.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 178.569 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.86 -19.48 61.02 Favored Glycine 0 C--N 1.323 -0.194 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.806 -176.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.1 p -63.9 -33.38 75.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -178.012 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.4 ptm -138.33 36.63 2.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.738 1.256 . . . . 0.0 108.54 -178.74 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 20.4 tp -49.87 -36.53 27.39 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 -173.238 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.64 -48.2 78.2 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.706 -0.621 . . . . 0.0 110.862 -178.111 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.87 -34.17 66.54 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.294 -177.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.79 -42.64 81.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.961 178.264 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.7 -48.6 81.05 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.703 -177.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -68.85 -13.78 62.62 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.529 -177.201 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.05 -32.48 50.91 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.171 -0.33 . . . . 0.0 110.66 176.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 6.9 p -95.63 -38.19 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 120.887 0.375 . . . . 0.0 111.078 178.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -126.87 76.12 75.55 Favored Pre-proline 0 C--N 1.325 -0.495 0 C-N-CA 122.475 0.31 . . . . 0.0 110.534 178.53 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -13.98 39.59 Favored 'Trans proline' 0 C--N 1.347 0.493 0 CA-C-O 121.195 0.415 . . . . 0.0 112.412 178.443 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.4 m -69.87 -13.71 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.3 177.07 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -105.65 127.88 53.32 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.07 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 . . . . . 0 C--N 1.324 -0.507 0 CA-C-O 121.167 0.508 . . . . 0.0 112.242 -179.478 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 . . . . . 0 C--O 1.216 -0.659 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.29 80.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.979 0.419 . . . . 0.0 110.293 178.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -74.26 -45.88 45.03 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 20.2 mmt -59.14 -31.4 68.93 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.339 179.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.2 81.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 122.244 -0.285 . . . . 0.0 111.147 179.453 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -67.85 -47.39 69.08 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.22 -42.86 99.68 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 -176.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.39 -34.44 74.53 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.635 178.649 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -66.35 -45.45 80.14 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.075 0.398 . . . . 0.0 110.13 176.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.18 -39.72 93.63 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 40.1 m -67.02 -37.47 84.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.675 177.223 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.14 -38.83 91.87 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.278 -179.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.3 t -57.75 -47.96 84.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.462 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? . . . . . 0 C--N 1.325 -0.46 0 O-C-N 121.808 -0.558 . . . . 0.0 110.342 179.928 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.539 0.529 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.02 -35.28 78.02 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.332 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.64 -33.03 74.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -176.275 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -60.38 -48.59 81.09 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.0 m -68.84 -40.11 79.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.046 0.45 . . . . 0.0 111.198 179.362 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -54.44 -52.23 62.45 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -70.14 -27.01 64.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.604 -0.685 . . . . 0.0 111.339 -179.885 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -68.51 -36.75 79.32 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.796 -0.565 . . . . 0.0 110.23 176.452 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.8 mm -67.0 -45.09 87.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 177.421 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.34 77.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.221 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.5 99.28 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -35.71 77.37 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.889 -178.308 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -69.72 -47.25 63.78 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.62 -41.59 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.168 177.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -75.05 -6.65 50.58 Favored 'General case' 0 C--O 1.217 -0.618 0 O-C-N 121.026 -1.046 . . . . 0.0 112.34 179.45 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.3 m -92.6 10.3 31.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 173.583 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.62 -3.55 56.25 Favored Glycine 0 C--N 1.329 0.167 0 N-CA-C 116.147 1.219 . . . . 0.0 116.147 175.716 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -67.53 125.23 25.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.649 0.724 . . . . 0.0 110.246 -179.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.71 131.24 10.29 Favored Glycine 0 C--O 1.225 -0.437 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.135 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.6 t -73.55 126.69 34.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 179.334 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.491 HD11 HD22 ' A' ' 43' ' ' LEU . 71.8 mt -92.72 -43.12 13.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 177.305 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -149.16 121.03 8.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.607 -176.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.617 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 171.501 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.69 129.72 20.75 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -177.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 89.1 mt -135.89 131.78 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.077 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.8 m95 -109.17 138.74 45.06 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.046 0.45 . . . . 0.0 110.882 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mp -132.57 137.97 47.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.131 0.972 . . . . 0.0 109.963 -178.31 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -86.57 133.92 33.68 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.375 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 119.76 77.93 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 103.393 -2.818 . . . . 0.0 103.393 174.964 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.55 -23.32 27.32 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 116.356 -1.962 . . . . 0.0 112.807 -173.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -71.35 -34.82 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 179.632 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 58.05 41.08 24.66 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.818 1.771 . . . . 0.0 108.652 -169.22 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -75.12 -172.78 1.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 110.939 -2.846 . . . . 0.0 105.681 172.816 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.2 m -41.22 -27.79 0.08 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -108.58 133.84 52.16 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.085 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -87.69 -44.73 10.96 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.185 0.516 . . . . 0.0 111.152 -178.224 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.491 HD22 HD11 ' A' ' 23' ' ' ILE . 76.2 mt -137.07 160.64 38.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.674 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.1 t -130.7 135.61 59.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 177.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 135.66 52.54 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 174.588 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -106.04 130.21 54.0 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 -179.591 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -130.27 124.74 33.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.846 0.355 . . . . 0.0 111.54 -176.823 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -103.3 94.52 5.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -149.36 133.85 17.58 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -175.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -78.28 144.64 35.95 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.739 -1.119 . . . . 0.0 108.439 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -135.93 110.05 8.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -81.42 -39.66 24.58 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.661 0.743 . . . . 0.0 111.4 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -127.0 149.78 49.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.567 -178.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -66.29 -18.86 65.6 Favored 'General case' 0 CA--C 1.504 -0.803 0 O-C-N 122.341 -0.225 . . . . 0.0 111.378 -178.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -62.99 -33.42 75.37 Favored 'General case' 0 C--O 1.211 -0.97 0 C-N-CA 119.616 -0.834 . . . . 0.0 108.874 178.054 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.36 -38.26 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.964 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.5 ttm -59.8 -51.18 70.83 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.802 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 15.1 m -64.55 -31.83 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-O 121.166 0.508 . . . . 0.0 111.496 -178.112 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -70.06 -41.47 74.12 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.55 -177.64 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -58.57 -41.99 86.94 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.9 mm -70.07 -33.69 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 119.776 -0.769 . . . . 0.0 111.788 -178.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -31.05 69.98 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.763 -178.772 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -45.33 58.77 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 175.15 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -57.49 -35.05 69.7 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.176 179.525 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.72 -34.48 74.45 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 122.354 -0.216 . . . . 0.0 111.261 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -69.91 -38.97 76.42 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -61.59 -43.43 98.88 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.679 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.421 HG11 HG13 ' A' ' 109' ' ' VAL . 70.8 t -64.98 -44.24 96.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 179.41 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.41 -46.06 87.2 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm105 -61.33 -42.3 98.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -177.719 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.3 -38.54 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.695 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -30.21 70.1 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.151 -0.968 . . . . 0.0 111.533 -177.959 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -40.24 78.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.759 0.314 . . . . 0.0 110.415 179.354 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -67.18 -39.38 86.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.917 -178.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.11 -8.13 59.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.892 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.38 19.44 68.6 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 114.029 0.372 . . . . 0.0 114.029 179.787 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.2 mtp85 -67.39 141.23 57.13 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 121.761 -0.846 . . . . 0.0 111.936 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.35 -35.14 78.77 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 178.002 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -155.72 147.56 23.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -122.45 139.91 53.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 178.104 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -113.46 121.39 44.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.92 0.39 . . . . 0.0 111.033 177.703 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -110.95 130.54 55.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.363 -178.121 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -93.05 121.13 34.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.607 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -115.89 128.33 55.71 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.742 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.4 t -125.45 113.87 37.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.969 0.414 . . . . 0.0 110.676 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -80.05 146.21 32.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.056 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -123.85 111.85 16.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 173.209 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 46.3 t -135.41 161.08 36.44 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -75.17 -29.06 60.32 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.799 -0.563 . . . . 0.0 110.042 -177.615 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -152.76 167.35 29.3 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.73 160.76 27.09 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.84 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -55.24 149.77 43.64 Favored 'Trans proline' 0 C--N 1.35 0.626 0 N-CA-C 115.609 1.35 . . . . 0.0 115.609 -179.339 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -76.27 -15.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -176.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -119.2 98.44 6.16 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 116.118 1.896 . . . . 0.0 116.118 -175.087 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 45.42 29.1 0.55 Allowed 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 118.549 2.796 . . . . 0.0 118.549 170.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -61.73 -22.25 65.22 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 121.089 -1.007 . . . . 0.0 111.283 178.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.69 -31.42 72.31 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 121.839 -0.538 . . . . 0.0 111.01 -178.026 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.47 -35.56 76.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.8 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.58 -40.06 83.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -176.627 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.68 -15.85 63.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.56 0.56 50.24 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 122.054 -0.404 . . . . 0.0 110.912 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -123.8 116.01 22.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.791 0.805 . . . . 0.0 111.466 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.1 m -68.19 128.3 36.06 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 176.19 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -82.74 107.81 15.65 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -178.32 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -117.11 137.63 52.17 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.894 0.854 . . . . 0.0 111.926 -176.312 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -137.21 75.29 1.52 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 177.467 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.42 -111.09 3.9 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 119.491 -1.338 . . . . 0.0 112.221 178.767 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.5 p -73.43 8.9 1.53 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.547 1.139 . . . . 0.0 113.39 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.421 HG13 HG11 ' A' ' 68' ' ' VAL . 67.6 t -127.82 143.79 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 C-N-CA 122.793 0.437 . . . . 0.0 111.307 -177.687 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.8 p -143.62 131.32 21.33 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 171.56 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.0 t -136.77 138.9 45.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 122.178 -0.326 . . . . 0.0 110.284 -179.033 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.25 122.62 53.45 Favored Pre-proline 0 CA--C 1.535 0.381 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.672 175.557 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -83.31 65.28 7.73 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 121.829 1.686 . . . . 0.0 113.708 178.151 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -79.26 153.69 29.72 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 tt -149.37 143.23 18.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.5 t -116.41 112.31 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 173.222 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.413 ' HE ' ' CG ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -94.52 136.18 35.12 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.353 0.597 . . . . 0.0 109.7 178.995 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.94 -37.82 93.22 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -176.699 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.5 t -57.04 -17.77 11.44 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.298 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -146.48 31.97 0.98 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tt -46.71 -40.09 12.73 Favored 'General case' 0 C--O 1.209 -1.073 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -173.496 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -59.24 -50.23 74.81 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.985 -176.756 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -73.76 -39.45 64.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.1 0.953 . . . . 0.0 111.817 179.168 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.413 ' CG ' ' HE ' ' A' ' 117' ' ' ARG . 1.8 t0 -67.11 -35.23 79.3 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.73 0.776 . . . . 0.0 112.136 -176.454 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.23 -43.34 74.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.105 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -69.92 -16.96 63.3 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.92 -175.954 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.25 -25.73 61.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.905 0.383 . . . . 0.0 110.294 177.356 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.06 -41.5 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.203 0.525 . . . . 0.0 110.545 179.735 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -127.05 75.91 76.37 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 123.113 0.565 . . . . 0.0 111.434 -178.635 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.91 -17.49 41.49 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.759 1.023 . . . . 0.0 114.759 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.1 m -85.61 0.99 51.02 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -179.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -72.48 134.72 45.46 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.646 0.736 . . . . 0.0 112.877 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 . . . . . 0 CA--C 1.513 -0.442 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.902 177.674 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.238 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.34 -38.22 90.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -42.8 95.07 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.656 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 80.9 mtp -64.2 -28.94 70.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 178.397 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.39 69.38 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.59 -0.694 . . . . 0.0 110.373 178.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -68.85 -46.43 68.55 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.06 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.81 -40.95 97.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.764 0.792 . . . . 0.0 109.579 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 58.9 ttt85 -59.14 -45.49 90.81 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.387 176.77 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.21 -41.44 85.79 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.583 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.65 -39.13 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.332 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.1 m -69.58 -38.44 77.37 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.445 176.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.69 -49.07 74.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.863 -178.355 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.1 p -62.43 -38.91 82.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 118.343 0.52 . . . . 0.0 110.809 -177.371 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? . . . . . 0 C--N 1.326 -0.419 0 C-N-CA 119.857 -0.737 . . . . 0.0 110.028 179.772 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 72.4 mt . . . . . 0 N--CA 1.47 0.549 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.72 -40.39 92.12 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 114.508 -1.224 . . . . 0.0 110.328 177.247 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -67.84 -38.42 83.17 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.071 0.548 . . . . 0.0 109.988 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -60.27 -46.63 89.14 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.83 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.7 m -68.01 -40.71 82.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.511 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -55.55 -52.14 64.72 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.497 0.719 . . . . 0.0 111.907 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.33 -28.35 67.07 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.661 -0.649 . . . . 0.0 111.571 -178.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp -69.71 -38.2 76.84 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.906 -0.496 . . . . 0.0 109.684 176.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.662 HD11 HD11 ' A' ' 125' ' ' LEU . 12.4 mm -62.48 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 177.357 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.85 -41.91 75.04 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.132 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.32 96.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 178.518 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -62.84 -45.69 91.41 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.259 -178.874 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.84 -46.92 76.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.277 -176.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.4 t -57.38 -43.43 82.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.511 0.672 . . . . 0.0 109.537 178.798 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -78.88 3.75 16.05 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -178.04 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 60.6 m -107.58 11.21 28.85 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.645 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.24 7.06 62.49 Favored Glycine 0 CA--C 1.516 0.148 0 N-CA-C 115.528 0.971 . . . . 0.0 115.528 177.499 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -69.91 129.65 40.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.382 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.77 133.31 15.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 109.139 -1.585 . . . . 0.0 109.139 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -84.44 115.66 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 117.83 0.815 . . . . 0.0 108.999 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 73.9 mt -90.19 -44.54 14.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 178.237 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -149.86 132.43 15.78 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.514 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.548 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 172.395 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 . . . . . 0 C--O 1.215 -0.724 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -151.05 124.91 9.15 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 175.181 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -124.65 120.61 59.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 169.131 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -107.28 121.79 45.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -178.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -120.47 128.94 53.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.1 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -84.67 126.13 33.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.24 178.443 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.56 135.32 95.71 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -178.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.82 -24.85 20.82 Favored 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 115.903 -2.265 . . . . 0.0 112.641 178.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -74.94 -29.6 60.99 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.073 0.549 . . . . 0.0 112.124 179.422 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.0 mttm 57.04 39.69 29.09 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.188 0.994 . . . . 0.0 112.641 178.701 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.24 -177.61 0.3 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 113.892 -1.504 . . . . 0.0 110.474 176.322 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -51.87 -34.02 39.11 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 175.306 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -90.63 112.12 23.72 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 103.495 -2.78 . . . . 0.0 103.495 170.069 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -105.49 -35.14 7.57 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.12 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -127.43 154.99 44.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 122.046 -0.409 . . . . 0.0 111.81 -175.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.7 p -131.79 137.57 54.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 175.406 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.48 114.19 22.48 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 175.404 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tp -79.37 132.71 36.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -136.46 150.52 48.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -174.745 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -125.76 110.5 13.8 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -151.74 150.32 30.06 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 178.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -114.09 134.79 54.64 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 177.601 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.25 134.35 55.18 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -175.312 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -84.21 -36.58 22.67 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.678 0.752 . . . . 0.0 110.912 176.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -135.61 164.63 27.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.476 -176.619 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.413 ' HD2' HD11 ' A' ' 99' ' ' ILE . 19.4 ptt-85 -64.38 -22.75 67.06 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.787 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -67.72 -33.15 74.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.007 -177.237 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -65.75 -41.32 92.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 175.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.9 ttm -62.22 -51.88 66.01 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.828 -179.407 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.9 m -60.87 -31.85 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.813 0.733 . . . . 0.0 111.099 -178.133 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -68.6 -38.71 80.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.283 -178.02 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -65.77 -35.71 81.48 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.276 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.4 mm -67.27 -34.67 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.864 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.25 -29.09 67.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.481 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -69.75 -42.82 73.37 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.164 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -57.73 -39.7 77.91 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.411 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -37.12 79.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.591 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.49 -44.96 89.33 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -60.96 -43.09 99.24 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.404 179.09 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.65 -31.25 51.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 122.038 -0.414 . . . . 0.0 110.399 -179.05 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.76 -33.55 75.39 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 121.513 -0.742 . . . . 0.0 109.476 175.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -72.4 -46.89 53.18 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 174.096 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.96 -47.29 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.912 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.91 -30.25 67.67 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.815 -0.553 . . . . 0.0 110.804 -179.237 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -73.58 -39.99 64.24 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.111 -0.368 . . . . 0.0 110.636 176.678 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.41 -48.6 72.26 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.13 5.7 49.78 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.351 0.596 . . . . 0.0 112.124 -178.764 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.55 -3.08 6.58 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 119.297 2.479 . . . . 0.0 119.297 173.331 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.4 mtp180 -64.24 132.87 51.56 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.144 1.472 . . . . 0.0 108.767 -178.807 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -64.71 -24.34 67.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -147.0 148.89 32.16 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.094 -2.928 . . . . 0.0 103.094 178.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 8.9 mmm -136.77 148.48 47.25 Favored 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.47 0.481 . . . . 0.0 111.155 -176.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 110' ' ' SER . 85.7 tttt -126.61 133.94 50.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 171.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -126.84 133.76 50.67 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.525 0.73 . . . . 0.0 109.039 -176.075 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.9 tp -94.66 126.26 39.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -116.5 108.7 16.33 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.1 t -105.83 114.87 46.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.237 -176.71 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -83.3 156.08 23.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 176.62 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -128.18 111.48 13.48 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 172.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.9 m -130.11 158.72 38.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.576 0.547 . . . . 0.0 111.453 -173.543 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.9 m -67.06 -47.3 71.7 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.71 0.767 . . . . 0.0 109.051 -179.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -148.48 174.39 12.13 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.012 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.55 145.32 29.73 Favored Pre-proline 0 C--N 1.313 -0.992 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.798 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 146.25 97.48 Favored 'Trans proline' 0 C--N 1.346 0.43 0 O-C-N 122.246 0.603 . . . . 0.0 112.759 176.714 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.9 m -81.8 -21.61 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -86.68 83.3 7.62 Favored 'General case' 0 C--O 1.216 -0.667 0 O-C-N 121.986 -0.446 . . . . 0.0 110.906 -177.618 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 t0 14.81 78.9 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 116.996 2.221 . . . . 0.0 116.996 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -90.08 -13.63 35.45 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.326 -1.306 . . . . 0.0 109.995 177.752 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -65.49 -31.3 72.3 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 107.535 -1.284 . . . . 0.0 107.535 -179.133 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 tp10 -59.24 -34.76 72.6 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 173.835 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.413 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.0 mm -71.2 -40.09 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.91 -22.2 65.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 111.256 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -87.97 0.47 55.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -125.99 130.27 50.87 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.953 0.882 . . . . 0.0 113.064 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.0 m -74.37 128.88 36.66 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 173.766 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -82.91 124.29 30.21 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.38 129.09 45.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.624 0.726 . . . . 0.0 109.537 178.959 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -143.1 122.74 13.29 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.5 179.868 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.09 -112.7 5.21 Favored Glycine 0 C--O 1.225 -0.418 0 N-CA-C 108.8 -1.72 . . . . 0.0 108.8 -178.813 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 9.7 t -122.87 22.67 9.62 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-O 121.722 0.772 . . . . 0.0 109.641 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.24 156.72 5.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.521 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 31.5 t -138.51 127.96 24.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 103.657 -2.72 . . . . 0.0 103.657 178.114 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.98 136.5 58.72 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-O 122.296 1.046 . . . . 0.0 109.223 179.12 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -112.3 114.96 50.32 Favored Pre-proline 0 N--CA 1.429 -1.5 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.939 -177.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -79.56 151.69 22.56 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 116.701 -1.733 . . . . 0.0 112.204 178.269 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 149.74 29.85 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 102.639 -3.097 . . . . 0.0 102.639 174.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 tt -149.43 122.29 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 118.431 0.559 . . . . 0.0 109.63 -176.732 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.7 t -95.32 110.36 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 177.704 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.63 136.23 37.44 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 178.778 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.43 -25.46 57.91 Favored Glycine 0 C--O 1.229 -0.211 0 CA-C-N 116.359 -0.382 . . . . 0.0 113.99 -177.396 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -58.0 -30.4 66.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -139.19 25.14 2.49 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.315 0.579 . . . . 0.0 110.292 -177.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.5 tt -44.41 -37.63 3.53 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -174.541 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -56.93 -49.36 75.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.845 0.748 . . . . 0.0 111.772 -178.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -78.66 -39.24 37.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 122.362 1.077 . . . . 0.0 111.141 178.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -63.35 -38.14 90.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.776 -175.268 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.662 HD11 HD11 ' A' ' 11' ' ' ILE . 1.9 tm? -66.59 -48.36 69.81 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.006 -0.434 . . . . 0.0 110.18 -178.628 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -69.35 -17.04 63.66 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.961 -176.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.87 62.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.695 -0.23 . . . . 0.0 110.929 178.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 p -109.06 -37.32 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 120.794 0.33 . . . . 0.0 111.137 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.38 80.5 72.04 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 121.954 -0.466 . . . . 0.0 111.247 178.963 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -71.29 0.29 6.98 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 114.294 0.844 . . . . 0.0 114.294 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 42.8 p -82.4 -2.63 53.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.166 0.508 . . . . 0.0 110.942 177.622 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -70.5 120.57 16.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.442 0.639 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.9 ttt85 . . . . . 0 C--N 1.323 -0.55 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.352 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 . . . . . 0 C--O 1.224 -0.288 0 CA-C-O 120.372 0.13 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.47 -43.74 71.96 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.12 -31.33 65.92 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.698 -179.395 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 76.6 mtp -70.51 -28.93 65.34 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.733 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.01 72.05 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.872 -0.517 . . . . 0.0 110.241 177.556 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -67.07 -44.67 79.52 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -65.06 -40.24 94.41 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.763 0.792 . . . . 0.0 109.57 -178.98 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -58.85 -44.62 91.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.195 177.295 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -68.35 -43.33 77.7 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 178.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.3 mt -63.28 -34.88 78.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.865 0.364 . . . . 0.0 110.042 -179.367 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 26.2 m -72.72 -38.57 67.43 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.516 0.674 . . . . 0.0 110.166 175.526 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.6 tt -64.75 -39.11 93.07 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.121 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.88 -42.93 90.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 119.056 0.843 . . . . 0.0 111.561 -177.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 C--O 1.217 -0.62 0 O-C-N 121.372 -0.83 . . . . 0.0 108.861 178.323 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 mm? . . . . . 0 C--O 1.218 -0.572 0 CA-C-O 120.888 0.375 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 78.0 mt -53.74 -35.23 60.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 179.091 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.466 ' HB2' ' HB1' ' A' ' 147' ' ' ALA . 40.0 mt-10 -61.34 -28.89 69.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.662 0.268 . . . . 0.0 110.734 -178.215 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -60.31 -55.1 37.81 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -41.34 68.69 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.921 -179.484 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -56.23 -55.76 29.24 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -177.833 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -69.83 -30.85 68.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -176.747 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -75.43 -25.76 57.76 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.183 -1.007 . . . . 0.0 112.038 178.158 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mm -73.13 -39.13 56.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 174.686 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.64 85.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.043 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.68 80.68 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.472 177.45 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -57.09 -43.88 82.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.582 -179.407 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -65.2 -44.71 87.52 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 0.0 110.133 179.177 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.91 -40.06 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.711 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.455 HD21 HD21 ' A' ' 157' ' ' LEU . 14.3 m120 -66.06 -29.17 69.46 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.636 -0.665 . . . . 0.0 110.346 179.492 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t -76.07 3.71 9.91 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.637 0.375 . . . . 0.0 111.574 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.28 -0.15 59.96 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 115.138 0.815 . . . . 0.0 115.138 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -67.22 125.77 27.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.044 0.922 . . . . 0.0 109.131 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.53 124.46 8.11 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.519 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -75.8 124.52 34.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.098 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.8 mt -90.06 -41.52 13.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -177.447 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -147.82 123.34 10.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.542 -177.475 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.492 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 174.198 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 . . . . . 0 C--O 1.225 -0.214 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.12 138.36 31.58 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 117.937 0.335 . . . . 0.0 110.567 178.687 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -140.12 132.7 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 176.624 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -109.03 135.33 50.37 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 178.602 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -129.43 137.21 50.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 124.067 0.947 . . . . 0.0 109.19 -176.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -101.24 137.3 39.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 176.911 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.05 106.42 7.91 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.836 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.45 -28.57 26.57 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 117.049 -1.501 . . . . 0.0 114.646 -176.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -78.01 -1.81 34.02 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.579 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.7 mtmt 58.28 43.31 20.38 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.1 m -64.56 -177.63 0.33 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.328 -1.76 . . . . 0.0 113.098 -178.651 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -41.43 -26.98 0.07 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 178.178 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -130.17 135.69 48.45 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -70.41 -37.7 74.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.412 0.625 . . . . 0.0 110.858 -178.64 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.9 mt -137.68 157.37 46.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.003 -177.607 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.44 137.18 53.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 176.682 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.03 135.95 49.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 173.118 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -102.1 132.88 47.71 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 179.338 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.35 115.78 12.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -179.187 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -86.8 96.37 10.17 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.881 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -147.34 128.79 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.663 0.744 . . . . 0.0 111.67 -176.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.13 147.25 36.68 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 125.081 1.352 . . . . 0.0 108.769 175.263 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.6 mt -143.8 118.2 9.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -177.282 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -87.43 -43.73 11.86 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 122.077 0.942 . . . . 0.0 111.467 -179.58 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -127.34 148.76 50.25 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.04 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.574 ' HD2' HD11 ' A' ' 99' ' ' ILE . 38.2 ptt180 -65.05 -16.0 62.97 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.307 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -63.05 -33.55 75.67 Favored 'General case' 0 C--O 1.216 -0.68 0 C-N-CA 119.702 -0.799 . . . . 0.0 109.675 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -77.57 -31.86 53.41 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 121.602 -0.687 . . . . 0.0 109.883 176.335 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.8 ttt -62.44 -51.84 65.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.372 178.008 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.8 m -61.07 -36.3 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-O 120.718 0.294 . . . . 0.0 111.59 179.849 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.5 -38.44 89.89 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.169 -177.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -59.47 -45.18 92.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.212 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.443 HG23 HG11 ' A' ' 111' ' ' VAL . 2.6 mp -73.16 -34.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.753 -0.592 . . . . 0.0 111.534 -178.318 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -59.23 -35.8 74.3 Favored 'General case' 0 C--O 1.244 0.803 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -45.64 29.99 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.657 178.825 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -55.2 -41.51 72.07 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.285 179.346 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.5 73.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 122.201 -0.312 . . . . 0.0 111.705 -178.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -73.16 -36.09 66.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.742 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -44.76 95.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 175.852 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.61 -36.04 72.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -60.42 -40.18 90.08 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.321 -0.862 . . . . 0.0 109.68 176.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -67.64 -33.64 75.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.486 178.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.2 t -73.87 -47.97 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 122.299 -0.251 . . . . 0.0 111.431 177.678 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -62.22 -30.36 71.03 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.618 -0.677 . . . . 0.0 111.781 -177.912 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -59.46 -45.62 91.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -73.3 -42.39 62.46 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 179.563 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.3 mp -78.35 -18.08 55.63 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 -175.256 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.34 9.25 60.68 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 116.751 1.46 . . . . 0.0 116.751 177.176 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -69.99 141.68 52.92 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.202 1.001 . . . . 0.0 109.03 -178.877 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.19 -34.73 77.0 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -174.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -144.37 161.86 37.92 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 101.837 -3.394 . . . . 0.0 101.837 176.545 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.3 mmm -135.69 112.54 10.22 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 123.552 0.533 . . . . 0.0 109.799 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -93.72 132.25 38.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.855 177.484 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -128.06 121.83 30.63 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.6 tp -89.52 121.61 31.9 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.469 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -112.04 113.29 25.49 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.0 t -112.76 106.27 20.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-O 121.253 0.549 . . . . 0.0 111.301 -178.724 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -74.6 152.06 39.3 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -128.48 109.01 11.01 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.436 -1.69 . . . . 0.0 106.436 172.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 89.2 p -131.88 164.96 24.94 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.196 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 t -77.48 -29.01 52.42 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.674 -0.641 . . . . 0.0 109.55 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -152.59 165.52 34.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 179.714 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.95 154.61 40.74 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.534 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -57.03 145.31 86.44 Favored 'Trans proline' 0 C--N 1.351 0.66 0 N-CA-C 114.829 1.05 . . . . 0.0 114.829 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.3 m -77.62 -21.37 13.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.223 0.535 . . . . 0.0 111.331 -179.693 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -90.85 99.12 12.21 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.972 179.571 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 14.72 58.8 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 176.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -68.34 -18.72 64.56 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.446 0.641 . . . . 0.0 110.486 179.044 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.74 -36.36 82.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.884 -177.467 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -37.67 74.11 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.614 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.574 HD11 ' HD2' ' A' ' 54' ' ' ARG . 5.3 mm -66.55 -39.99 85.27 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.604 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.267 -178.205 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.15 -23.92 65.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.514 0.674 . . . . 0.0 110.987 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.6 mtmt -94.9 6.16 49.83 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.773 179.295 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -118.94 95.94 5.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -176.833 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -68.34 124.97 24.97 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.515 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -85.72 107.44 17.59 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.944 0.878 . . . . 0.0 109.83 -178.501 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -99.53 123.53 43.88 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.824 -1.08 . . . . 0.0 108.662 -178.578 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -130.17 75.4 1.65 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -178.775 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.38 -112.68 3.7 Favored Glycine 0 C--O 1.223 -0.574 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -178.334 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.7 p -83.04 -20.82 34.27 Favored 'General case' 0 C--N 1.322 -0.59 0 O-C-N 122.217 -0.578 . . . . 0.0 110.367 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 53.1 t -74.92 140.62 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.9 m -130.79 112.85 13.42 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 171.081 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.443 HG11 HG23 ' A' ' 61' ' ' ILE . 54.1 t -106.29 129.65 59.26 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.504 0 O-C-N 121.527 -0.733 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.64 104.0 22.01 Favored Pre-proline 0 N--CA 1.435 -1.22 0 CA-C-N 113.995 -1.457 . . . . 0.0 108.039 178.458 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -78.24 142.91 19.48 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 116.721 -1.719 . . . . 0.0 112.13 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 153.28 38.42 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 178.05 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.6 tt -146.86 123.57 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.143 0.497 . . . . 0.0 109.766 -177.334 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 1.9 t -89.87 126.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 104.098 -2.556 . . . . 0.0 104.098 174.592 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.61 136.27 54.45 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 175.907 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -22.44 66.38 Favored Glycine 0 C--O 1.227 -0.298 0 C-N-CA 121.178 -0.534 . . . . 0.0 113.899 -176.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.7 p -57.35 -26.74 61.44 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -177.253 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.5 ptm -141.16 30.58 1.78 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.546 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -44.37 -42.45 6.88 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 116.417 2.006 . . . . 0.0 116.417 -171.612 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -58.56 -51.33 70.34 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.685 -0.634 . . . . 0.0 112.395 -178.366 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -75.22 -33.06 61.33 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.582 0.706 . . . . 0.0 111.334 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -72.08 -42.02 66.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 20.8 tp -64.27 -41.81 96.75 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 121.717 -0.615 . . . . 0.0 111.272 -176.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.63 -13.31 60.33 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.648 -178.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.0 t -91.64 -40.35 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 121.33 0.586 . . . . 0.0 110.234 179.096 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -123.02 77.21 50.86 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.602 -179.398 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.25 -13.86 38.94 Favored 'Trans proline' 0 C--N 1.348 0.543 0 N-CA-C 114.127 0.78 . . . . 0.0 114.127 -177.841 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.5 m -77.83 -7.22 56.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.719 0.295 . . . . 0.0 111.57 177.308 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -99.4 132.98 44.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.236 0.541 . . . . 0.0 110.674 -178.736 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 . . . . . 0 C--N 1.327 -0.412 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.824 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 . . . . . 0 N--CA 1.465 0.293 0 CA-C-O 121.524 0.678 . . . . 0.0 109.417 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.466 ' HB1' ' HB2' ' A' ' 5' ' ' GLU . . . -63.29 -44.93 93.64 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 179.192 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.76 -31.33 56.99 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.465 -179.42 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.3 mmt -65.3 -28.78 69.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.142 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.89 70.26 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.53 -0.271 . . . . 0.0 111.298 178.401 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -65.52 -51.28 61.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.48 177.694 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.11 -42.12 97.93 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.163 0.982 . . . . 0.0 108.6 -178.211 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -58.9 -40.15 83.64 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.995 178.839 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -64.91 -43.19 93.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.317 0.508 . . . . 0.0 112.063 177.152 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.7 -41.31 98.13 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.346 -179.496 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.6 t -65.86 -38.82 89.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 0.0 110.466 177.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.455 HD21 HD21 ' A' ' 17' ' ' ASN . 2.5 tm? -61.31 -45.92 92.45 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 123.103 0.561 . . . . 0.0 110.908 179.749 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 56.0 t -56.79 -50.12 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.324 -0.512 0 CA-C-O 120.965 0.412 . . . . 0.0 110.497 -178.662 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pp . . . . . 0 C--O 1.224 -0.264 0 CA-C-O 121.577 0.703 . . . . 0.0 111.1 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.78 -35.2 64.93 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.306 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -65.78 -29.33 69.81 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.364 0.602 . . . . 0.0 110.272 -176.924 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -62.23 -45.16 94.6 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.196 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 m -70.54 -40.31 73.5 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.302 178.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -55.35 -51.15 67.72 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.018 0.927 . . . . 0.0 111.082 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.664 -0.647 . . . . 0.0 111.769 178.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 55.6 mttt -66.71 -37.56 84.95 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.855 -0.528 . . . . 0.0 110.955 176.665 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 mm -71.19 -39.35 73.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.009 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.32 -44.58 80.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.51 -47.24 79.61 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.56 178.018 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 34.8 t60 -55.46 -45.56 76.89 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.683 0.393 . . . . 0.0 111.415 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.7 mt -70.44 -47.89 58.57 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.588 -178.839 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.85 -40.29 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-N 118.422 0.556 . . . . 0.0 109.983 175.639 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -64.17 -27.22 68.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.147 -0.346 . . . . 0.0 111.511 179.151 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 m -86.62 10.25 16.14 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 177.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.85 0.28 58.98 Favored Glycine 0 C--O 1.229 -0.159 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 175.602 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.408 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 26.0 m-85 -67.81 129.25 39.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.311 1.056 . . . . 0.0 109.748 178.611 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.17 109.41 2.98 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 179.318 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.8 p -70.32 129.15 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.192 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 85.9 mt -94.89 -47.11 13.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.773 -1.103 . . . . 0.0 108.358 -177.321 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -142.36 139.95 31.92 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 -177.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.459 0 CA-C-N 118.111 0.414 . . . . 0.0 110.262 -179.214 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 . . . . . 0 C--O 1.234 0.288 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 45' ' ' ARG . 47.8 mt-10 -112.92 144.69 42.04 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.674 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 90.8 mt -135.36 127.78 47.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 172.71 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -110.84 133.11 53.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.068 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 mp -131.72 129.69 41.01 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.213 0.605 . . . . 0.0 109.788 -178.383 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -81.43 132.76 35.34 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.491 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.85 117.77 60.82 Favored Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 177.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 79.2 Cg_endo -72.6 -26.12 16.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 115.892 -2.272 . . . . 0.0 112.807 -175.899 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -72.49 -26.5 61.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.701 -179.859 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.8 mttp 59.24 41.95 19.26 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.646 1.688 . . . . 0.0 108.113 -178.83 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 96.4 p -71.09 -177.61 1.73 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 111.042 -2.799 . . . . 0.0 108.39 176.85 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.2 p -45.85 -26.63 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 176.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -101.51 127.19 48.31 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 174.367 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -89.8 -37.7 14.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -178.523 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.9 mt -137.36 161.61 35.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.7 t -127.29 134.53 65.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.402 HH21 ' CD ' ' A' ' 30' ' ' GLU . 31.6 ttt180 -122.46 112.99 18.72 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.176 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.79 131.12 35.2 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 175.069 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -136.36 114.67 11.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.217 0.532 . . . . 0.0 111.416 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -82.56 94.71 7.56 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 178.541 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -151.62 136.59 17.31 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.26 146.11 24.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.234 -178.729 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.26 119.35 26.14 Favored 'General case' 0 C--O 1.22 -0.45 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 -177.236 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -79.12 -43.5 23.92 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 122.661 1.219 . . . . 0.0 109.845 178.316 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -127.83 164.67 21.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.87 -178.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -64.21 -15.82 60.75 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.579 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -62.4 -41.37 98.62 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.6 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -66.59 -39.37 88.39 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.7 ttm -63.11 -51.85 64.93 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.396 -178.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.87 -31.85 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.641 0.655 . . . . 0.0 112.585 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -68.51 -35.03 76.92 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.667 -178.138 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.72 -41.73 91.5 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.297 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -67.12 -30.88 50.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.077 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -58.45 -40.06 81.58 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.097 179.529 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -76.63 -43.91 36.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.423 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.45 -36.52 69.13 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.934 -178.536 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.478 ' HA ' HG11 ' A' ' 109' ' ' VAL . . . -64.17 -40.43 96.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 O-C-N 121.938 -0.476 . . . . 0.0 111.102 179.463 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -76.02 -29.68 58.21 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.313 -0.867 . . . . 0.0 109.638 178.385 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -60.7 -41.48 95.26 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 173.62 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.456 HG11 HG13 ' A' ' 109' ' ' VAL . 45.9 t -64.83 -39.67 86.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.05 177.275 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -54.56 -37.95 66.06 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.779 0.718 . . . . 0.0 111.69 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -61.68 -48.08 82.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.996 179.579 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.3 t -70.63 -41.41 77.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.564 0.697 . . . . 0.0 110.943 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -41.67 93.54 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.971 -0.456 . . . . 0.0 109.942 179.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -64.59 -45.82 85.33 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.106 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -58.64 -42.28 87.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.433 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.75 -3.69 58.02 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -179.489 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.68 20.1 67.83 Favored Glycine 0 C--O 1.242 0.615 0 C-N-CA 121.508 -0.377 . . . . 0.0 113.654 179.656 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -73.04 147.84 44.69 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.825 -0.809 . . . . 0.0 110.944 -176.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -69.45 -37.52 77.37 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.47 159.62 39.94 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 171.569 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.9 ttp -134.15 147.19 50.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.745 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 110' ' ' SER . 83.6 tttt -116.0 136.67 52.81 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 179.482 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.4 tp -119.81 134.0 55.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 123.056 0.543 . . . . 0.0 110.699 178.448 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.78 109.85 22.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.066 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -97.71 127.34 43.59 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.053 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.9 t -122.08 109.31 24.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.177 0.513 . . . . 0.0 110.937 179.055 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -81.24 151.83 27.94 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 176.489 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -127.29 107.63 10.16 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 103.61 -2.737 . . . . 0.0 103.61 171.658 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.3 m -127.17 158.65 36.53 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.683 0.614 . . . . 0.0 110.896 -174.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.5 m -67.06 -45.21 78.07 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -177.434 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -146.81 176.74 9.65 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.711 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.19 143.39 29.6 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.395 -0.821 . . . . 0.0 108.874 -176.119 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.71 147.06 73.81 Favored 'Trans proline' 0 C--N 1.35 0.622 0 N-CA-C 114.93 1.088 . . . . 0.0 114.93 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 26.9 m -81.17 -10.23 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 N-CA-C 114.525 1.305 . . . . 0.0 114.525 -177.092 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -112.67 95.77 5.61 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 119.339 -0.362 . . . . 0.0 111.559 -178.378 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.9 t0 14.83 67.33 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 176.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 56.6 p-90 -83.99 -13.99 51.9 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.195 179.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -66.65 -31.48 72.19 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.119 -0.988 . . . . 0.0 111.905 -175.21 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -65.31 -21.74 66.75 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.958 175.615 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.502 HG22 ' HG3' ' A' ' 113' ' ' PRO . 15.5 mm -72.7 -40.48 61.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.3 -5.03 33.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.983 179.22 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -111.35 3.14 18.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.797 -179.383 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -126.74 128.42 46.62 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.88 0.847 . . . . 0.0 112.142 179.068 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 26.5 m -78.46 126.79 31.26 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 176.819 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -82.64 111.44 18.61 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 177.016 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -118.17 120.99 39.39 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.461 0.648 . . . . 0.0 109.76 -178.392 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -116.69 75.31 0.96 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 178.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.31 -112.7 4.85 Favored Glycine 0 C--O 1.225 -0.466 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.774 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.0 p -81.96 24.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.561 0.744 . . . . 0.0 112.173 -178.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.478 HG11 ' HA ' ' A' ' 65' ' ' ALA . 86.2 t -134.83 140.63 45.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.264 -178.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.404 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 33.8 t -130.62 126.49 36.78 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 175.67 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.9 t -136.7 136.42 48.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 176.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -125.56 131.33 24.01 Favored Pre-proline 0 C--N 1.317 -0.841 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 175.865 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.502 ' HG3' HG22 ' A' ' 99' ' ' ILE . 47.9 Cg_endo -84.56 154.73 12.05 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 CA-C-O 122.101 0.792 . . . . 0.0 113.774 -177.61 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.78 150.73 39.0 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 174.438 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.7 tt -146.42 124.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -176.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 52.1 t -97.44 115.95 38.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 175.057 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.35 138.17 39.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.061 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.86 -25.88 53.48 Favored Glycine 0 C--O 1.223 -0.591 0 N-CA-C 114.728 0.651 . . . . 0.0 114.728 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.7 p -59.66 -27.2 66.17 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.545 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.8 ptm -143.07 18.42 1.94 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.925 0.869 . . . . 0.0 109.906 -177.831 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tt -42.08 -42.41 2.91 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 118.418 2.747 . . . . 0.0 118.418 -170.613 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -60.79 -51.54 68.91 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 119.562 -0.855 . . . . 0.0 112.278 -174.078 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -78.54 -33.27 48.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 176.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -58.86 -32.15 69.18 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.432 1.111 . . . . 0.0 110.818 -178.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.63 -36.35 73.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.953 -1.021 . . . . 0.0 113.178 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -75.33 -15.0 60.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -176.269 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.55 -28.56 62.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.163 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 22.7 t -95.56 -41.63 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.858 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -126.22 80.19 68.89 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.33 -178.908 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -67.55 -14.53 42.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 118.08 -0.813 . . . . 0.0 112.774 179.752 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.2 m -75.72 -5.71 46.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.923 176.461 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -99.48 135.5 40.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.706 0.765 . . . . 0.0 110.575 -179.022 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 . . . . . 0 C--N 1.322 -0.59 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.344 179.963 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 . . . . . 0 N--CA 1.454 -0.252 0 CA-C-O 120.566 0.222 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.49 90.69 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.404 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -62.73 -51.08 68.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 21.5 ptp -65.33 -28.84 69.59 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.353 179.419 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.05 -37.37 85.68 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.456 -0.778 . . . . 0.0 110.034 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 44.5 ttt180 -65.64 -45.86 81.39 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.595 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -65.01 -40.31 94.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.843 0.83 . . . . 0.0 110.316 -178.821 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -64.71 -40.0 94.62 Favored 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.872 178.491 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.34 -41.22 98.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.83 0.348 . . . . 0.0 111.639 176.568 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.8 mt -65.17 -33.13 75.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.043 0.449 . . . . 0.0 109.823 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.05 -34.81 61.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.624 0.726 . . . . 0.0 110.571 175.086 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -65.06 -44.15 89.92 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.639 -178.624 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.7 p -62.16 -36.78 76.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.014 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 C--O 1.207 -1.165 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.024 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 108.797 -0.816 . . . . 0.0 108.797 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.25 -35.3 80.61 Favored 'General case' 0 C--O 1.208 -1.084 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.277 178.507 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -65.14 -42.21 94.03 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 178.575 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 177.484 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -59.12 -43.69 91.97 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.613 -178.216 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -57.26 -52.31 65.84 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 123.073 0.549 . . . . 0.0 110.363 179.906 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -69.3 -33.32 73.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.979 -179.268 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.69 -31.48 69.55 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.683 -0.636 . . . . 0.0 111.018 178.803 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.8 mm -77.06 -39.2 28.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.18 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.1 80.94 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.746 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.09 -45.85 86.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.915 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.95 -47.45 77.57 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.454 0.302 . . . . 0.0 110.623 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 34.4 mt -67.1 -51.03 59.29 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -178.64 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.2 t -57.33 -42.71 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.979 178.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -19.09 65.7 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.351 -0.843 . . . . 0.0 111.814 -179.642 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.4 t -87.53 8.1 26.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.021 0.439 . . . . 0.0 111.046 177.876 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.59 1.24 56.53 Favored Glycine 0 C--O 1.228 -0.266 0 N-CA-C 116.033 1.173 . . . . 0.0 116.033 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.463 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 38.3 m-85 -71.9 110.52 6.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 118.046 0.923 . . . . 0.0 109.018 178.215 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.41 134.48 30.89 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.945 -177.454 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -75.79 125.81 35.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.717 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.437 HD11 HD22 ' A' ' 43' ' ' LEU . 45.3 mt -92.22 -43.83 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.014 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -153.41 127.55 9.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.793 175.661 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 174.352 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 . . . . . 0 N--CA 1.457 -0.107 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -136.39 146.97 47.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 178.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 83.6 mt -134.92 134.23 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.681 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -110.41 135.57 50.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.0 0.429 . . . . 0.0 111.45 -179.229 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 4.1 mp -132.37 143.02 49.55 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.105 0.962 . . . . 0.0 109.226 -177.58 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -102.47 135.56 43.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.76 115.62 39.73 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 93.9 Cg_endo -73.56 -24.43 16.09 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 117.373 -1.285 . . . . 0.0 112.547 -177.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -76.28 -24.45 54.43 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.971 178.78 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.69 42.72 6.09 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -178.378 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 m -59.87 -177.52 0.06 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 112.559 -2.11 . . . . 0.0 115.078 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.4 m -52.98 -28.84 25.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.652 173.603 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.436 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 14.4 p-80 -100.53 140.48 34.74 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 172.101 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -97.42 -43.83 7.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.032 0.444 . . . . 0.0 111.761 -172.818 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.437 HD22 HD11 ' A' ' 23' ' ' ILE . 51.1 mt -130.5 158.1 40.86 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.959 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.8 t -127.6 136.63 59.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 177.777 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.48 134.26 35.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.871 0.843 . . . . 0.0 109.371 173.032 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -97.55 137.06 37.05 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -178.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -136.01 108.81 7.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -175.381 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.22 94.78 6.12 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 179.505 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -151.52 118.88 5.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.342 0.592 . . . . 0.0 111.657 -175.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -87.16 151.48 23.15 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.47 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.3 mt -141.19 143.53 34.25 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.856 -172.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -98.11 -39.46 8.89 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.102 0.477 . . . . 0.0 110.356 176.628 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -133.77 151.09 51.49 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -176.835 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.411 ' H ' ' HB3' ' A' ' 94' ' ' ASP . 9.3 ptt180 -64.48 -21.13 66.57 Favored 'General case' 0 C--O 1.212 -0.908 0 O-C-N 121.528 -0.733 . . . . 0.0 112.535 179.937 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.426 HE21 ' HG3' ' A' ' 56' ' ' GLU . 0.2 OUTLIER -61.15 -33.05 72.78 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.914 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.426 ' HG3' HE21 ' A' ' 55' ' ' GLN . 42.4 mt-10 -72.49 -45.51 59.12 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.517 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.0 ttt -55.0 -49.03 72.5 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.591 -178.584 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.6 m -65.06 -35.25 75.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.758 178.529 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -71.13 -32.99 69.66 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.214 -177.106 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.4 -38.02 76.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 175.897 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.1 mm -71.58 -30.91 40.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.745 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.89 -40.18 87.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -74.55 -42.7 58.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 178.816 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.22 -43.71 87.82 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.012 -0.43 . . . . 0.0 110.683 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.7 -40.27 84.32 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.633 -178.529 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -64.17 -49.37 72.33 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.294 -0.563 . . . . 0.0 109.59 177.883 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -40.61 95.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.89 -33.33 43.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.675 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -66.74 -38.23 86.24 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -60.32 -43.83 96.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.092 -176.398 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.23 -35.82 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.626 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -30.31 66.51 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.888 -1.133 . . . . 0.0 113.552 -178.542 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -58.18 -31.75 67.59 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.554 179.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -20.47 65.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.705 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.01 9.37 34.47 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.927 0.394 . . . . 0.0 110.195 177.503 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.79 29.19 71.56 Favored Glycine 0 C--O 1.236 0.24 0 N-CA-C 115.754 1.062 . . . . 0.0 115.754 175.81 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 38.2 ttt85 -69.89 128.29 35.87 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 121.728 -0.866 . . . . 0.0 108.678 -178.819 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.73 -36.16 82.95 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.326 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.22 149.17 29.82 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 176.932 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -120.66 147.98 44.53 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.66 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -134.96 117.47 15.83 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.257 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 tp -112.89 128.31 56.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.13 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -94.26 104.1 16.11 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 174.232 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -101.85 128.48 48.2 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.319 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.6 t -123.48 109.38 23.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.316 176.551 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -72.9 141.91 47.88 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 175.247 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -118.27 103.75 10.12 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 174.261 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 83.5 p -123.07 158.74 29.97 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.991 0.424 . . . . 0.0 110.557 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -75.94 -28.87 58.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 121.482 -0.761 . . . . 0.0 108.999 -179.335 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -155.32 166.61 33.01 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 177.247 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.18 150.31 43.0 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 110.507 -0.183 . . . . 0.0 110.507 -176.008 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.87 145.23 85.49 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 118.03 -0.847 . . . . 0.0 112.046 177.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 m -76.25 -19.74 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -172.56 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.411 ' HB3' ' H ' ' A' ' 54' ' ' ARG . 43.7 t0 -84.31 87.43 7.2 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-O 119.484 -0.293 . . . . 0.0 111.333 -177.526 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 27.56 48.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 118.041 2.608 . . . . 0.0 118.041 176.221 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 34.1 p-90 -62.06 -20.21 63.74 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.03 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -61.03 -31.23 70.86 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.841 -0.537 . . . . 0.0 110.356 -179.253 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -60.03 -35.19 74.56 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.7 mm -72.45 -43.52 63.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.94 -176.06 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.33 64.52 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.755 -0.591 . . . . 0.0 112.244 -178.525 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -101.92 17.06 24.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -131.02 104.25 7.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.601 -176.507 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.0 m -68.25 125.9 27.87 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -82.71 127.79 33.75 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 179.255 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -126.03 133.06 51.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.795 0.807 . . . . 0.0 111.311 179.351 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -142.26 111.47 6.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.441 -1.254 . . . . 0.0 108.08 178.354 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.75 -115.94 8.26 Favored Glycine 0 C--N 1.322 -0.195 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.091 179.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 60.7 p -87.46 -12.61 45.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.442 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.6 t -94.1 141.33 15.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -174.163 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.3 m -120.76 138.45 54.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 167.234 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 25.2 t -132.39 134.03 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -96.09 114.48 64.28 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 176.818 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -84.28 59.63 5.97 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 121.987 1.792 . . . . 0.0 114.209 -177.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.33 153.01 44.27 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.88 -178.328 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.7 tt -147.46 135.43 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.0 m -112.18 132.72 60.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.2 141.17 50.16 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -176.307 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.1 -26.44 55.82 Favored Glycine 0 C--O 1.227 -0.283 0 N-CA-C 114.808 0.683 . . . . 0.0 114.808 -176.559 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.0 p -55.3 -29.6 58.54 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -179.345 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.7 ptm -141.63 26.49 1.93 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.348 0.594 . . . . 0.0 110.298 -178.025 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 12.1 tp -45.35 -37.75 5.2 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 119.328 3.084 . . . . 0.0 119.328 -169.301 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -65.98 -43.37 88.01 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.301 0.955 . . . . 0.0 110.778 -179.235 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -73.7 -36.0 65.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 122.218 1.009 . . . . 0.0 109.495 178.562 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -62.81 -42.72 99.84 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 11.2 mt -62.13 -43.93 97.76 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -75.07 -15.24 60.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.355 -177.311 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.61 -40.85 48.13 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.232 -0.292 . . . . 0.0 110.716 178.123 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . 0.422 HG13 ' CD2' ' A' ' 129' ' ' PHE . 12.2 p -92.25 -32.91 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 120.995 0.426 . . . . 0.0 111.252 179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . 0.422 ' CD2' HG13 ' A' ' 128' ' ' VAL . 38.5 m-85 -127.24 80.67 71.29 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.396 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -65.5 -11.84 32.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 N-CA-C 114.694 0.998 . . . . 0.0 114.694 -177.704 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.9 m -77.97 -2.85 38.97 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.123 -0.361 . . . . 0.0 111.666 176.332 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -77.0 127.43 32.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.596 0.712 . . . . 0.0 111.85 -179.1 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 59.9 mtt180 . . . . . 0 C--N 1.322 -0.6 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.701 178.795 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 31.5 m120 . . . . . 0 C--O 1.22 -0.471 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -32.49 57.53 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.96 -0.463 . . . . 0.0 111.759 178.43 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -62.99 -41.05 99.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.635 0.731 . . . . 0.0 109.41 177.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtp -70.84 -29.01 65.03 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.567 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.36 -40.42 95.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.164 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.2 ttt180 -63.43 -46.63 85.45 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -59.43 -42.7 92.47 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.301 0.572 . . . . 0.0 110.317 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -58.73 -44.68 90.52 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.951 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -65.9 -46.2 79.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 179.171 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.7 -41.51 86.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.219 0.533 . . . . 0.0 109.667 -178.156 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.7 m -69.76 -35.73 75.18 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.418 178.585 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.7 tt -65.47 -39.44 91.97 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -177.126 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 88.7 t -53.68 -54.01 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.586 0.63 . . . . 0.0 112.696 -174.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? . . . . . 0 C--N 1.326 -0.445 0 CA-C-O 121.342 0.592 . . . . 0.0 109.833 -179.555 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.8 tt . . . . . 0 C--O 1.218 -0.573 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.79 -35.3 80.31 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.315 179.255 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.14 -32.15 70.75 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.149 0.5 . . . . 0.0 109.793 -179.817 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.78 -54.47 38.54 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.6 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.8 m -64.17 -38.13 89.96 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.196 0.522 . . . . 0.0 111.381 -179.646 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -56.23 -52.98 62.47 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.46 0.704 . . . . 0.0 110.538 178.234 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -70.72 -28.09 64.46 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.211 -0.931 . . . . 0.0 111.744 179.094 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -65.26 -43.43 91.33 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 176.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.403 HD11 HD11 ' A' ' 125' ' ' LEU . 18.0 mm -69.28 -38.55 77.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 -45.18 80.08 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.15 -42.5 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.954 0.407 . . . . 0.0 111.382 178.98 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -60.15 -46.81 88.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.399 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 mt -65.1 -53.52 44.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.86 0.362 . . . . 0.0 111.132 -179.911 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.6 t -59.41 -43.57 90.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.465 -175.226 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -14.2 62.71 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.513 -0.742 . . . . 0.0 112.592 -179.385 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.9 m -89.71 1.49 56.0 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 177.914 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.05 -3.0 27.04 Favored Glycine 0 C--O 1.224 -0.48 0 N-CA-C 115.588 0.995 . . . . 0.0 115.588 176.806 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -67.35 118.33 10.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 118.284 1.042 . . . . 0.0 109.427 178.571 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.64 133.95 14.52 Favored Glycine 0 C--O 1.226 -0.403 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -177.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.4 t -77.1 132.62 32.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.34 0.591 . . . . 0.0 110.154 179.457 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 53.7 mt -105.5 -48.51 9.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 174.436 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -141.64 116.2 9.63 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 118.25 0.477 . . . . 0.0 111.597 178.19 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -116.66 151.9 35.36 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.365 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.8 mt -137.62 126.48 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 104.597 -2.372 . . . . 0.0 104.597 165.082 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -108.09 125.48 51.63 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.427 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.71 135.24 54.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.821 -177.874 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -84.88 132.95 34.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 175.238 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.11 124.95 91.87 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.259 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -74.52 -23.67 14.68 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 116.591 -1.806 . . . . 0.0 112.486 -179.79 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -67.96 -37.24 81.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.792 -178.633 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.7 mttt 59.07 28.13 17.3 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 123.548 1.642 . . . . 0.0 109.858 -176.073 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -77.38 -173.13 2.75 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 110.871 -2.877 . . . . 0.0 108.5 173.802 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.48 -28.84 0.14 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 117.418 2.377 . . . . 0.0 117.418 -174.576 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.553 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 11.6 p80 -107.69 131.54 54.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.004 1.275 . . . . 0.0 108.709 169.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -87.12 -39.79 15.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.837 -1.529 . . . . 0.0 111.582 -172.267 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.3 mt -135.37 164.08 28.58 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.333 -178.6 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 96.6 t -128.68 136.76 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 175.678 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -120.95 116.48 25.19 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -93.68 130.08 39.76 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 175.459 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -136.2 124.39 23.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -174.92 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.87 94.87 5.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.213 0.53 . . . . 0.0 110.076 -179.315 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -144.16 141.64 30.07 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.561 -0.904 . . . . 0.0 108.561 178.188 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -99.17 137.0 38.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 -177.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.84 145.59 47.92 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 -174.903 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -107.36 -39.69 5.59 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.172 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -122.47 161.26 23.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.878 179.411 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -66.19 -15.47 63.17 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.095 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.74 -43.15 94.38 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.53 -46.8 88.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.367 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.424 ' O ' HD12 ' A' ' 61' ' ' ILE . 81.0 mtp -56.64 -51.96 66.7 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.34 -179.426 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.9 m -67.08 -31.84 55.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.325 -175.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.0 mtt-85 -67.53 -43.77 79.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.478 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -58.37 -45.22 88.67 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.602 -179.378 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.424 HD12 ' O ' ' A' ' 57' ' ' MET . 2.5 mt -74.12 -34.2 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.313 -0.867 . . . . 0.0 112.067 -177.446 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.33 -37.68 72.92 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 177.321 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -76.62 -46.22 26.91 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.925 179.219 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.428 ' O ' HG23 ' A' ' 68' ' ' VAL . 50.7 mt-30 -55.29 -43.8 75.12 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.244 -178.557 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.72 -39.68 81.53 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.382 0.537 . . . . 0.0 111.312 -177.518 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.411 ' HB3' HH21 ' A' ' 70' ' ' ARG . 26.1 mt-10 -73.42 -30.23 63.1 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 121.436 -0.79 . . . . 0.0 111.094 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -40.03 78.55 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 174.918 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 64' ' ' GLN . 73.0 t -65.9 -36.45 77.54 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.731 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -54.35 -38.72 66.4 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.902 0.774 . . . . 0.0 111.69 178.726 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.411 HH21 ' HB3' ' A' ' 66' ' ' GLU . 6.8 mmt180 -67.31 -43.27 82.1 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.847 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.76 -42.89 90.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.78 -44.34 86.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 123.101 0.56 . . . . 0.0 109.999 178.573 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -65.61 -42.22 91.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.656 0.265 . . . . 0.0 110.467 179.605 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -62.54 -40.59 97.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 0.0 111.161 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.94 0.97 41.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -179.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.31 22.59 71.17 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 114.24 0.456 . . . . 0.0 114.24 178.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -76.68 140.25 40.82 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.972 -0.722 . . . . 0.0 110.8 -176.931 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.64 -35.72 62.88 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 178.869 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -150.65 162.37 40.79 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 102.631 -3.1 . . . . 0.0 102.631 176.399 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.6 mtp -137.31 152.93 50.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.496 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.553 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 7.0 tttp -129.75 133.7 47.17 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 176.588 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.23 125.44 34.88 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.387 0.43 . . . . 0.0 110.588 -174.571 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.8 tp -88.04 107.81 18.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 176.601 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -101.96 128.65 48.28 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.3 t -121.31 110.0 26.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 117.945 0.338 . . . . 0.0 111.232 178.443 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -75.04 149.41 39.22 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -128.79 103.67 7.19 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 174.351 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 88.8 p -130.24 150.57 51.43 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.84 0.352 . . . . 0.0 111.823 -175.946 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -67.08 -29.36 69.11 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -178.083 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -138.61 167.4 22.02 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 -178.099 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.13 144.02 27.37 Favored Pre-proline 0 C--N 1.318 -0.787 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 177.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.47 149.47 66.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 114.802 1.039 . . . . 0.0 114.802 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 15.1 m -76.64 -15.34 14.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 117.209 2.3 . . . . 0.0 117.209 -174.71 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -123.73 98.31 5.76 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -176.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.4 t0 38.07 50.02 1.3 Allowed 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 170.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . 0.427 ' HA ' HG12 ' A' ' 99' ' ' ILE . 53.0 p-90 -80.03 -14.39 58.59 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 176.849 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -66.84 -31.79 72.63 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 121.489 -0.757 . . . . 0.0 110.625 -177.439 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.12 -20.66 66.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 109.99 173.951 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.427 HG12 ' HA ' ' A' ' 96' ' ' TRP . 12.3 mm -79.27 -45.52 23.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.897 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 -179.299 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.03 -24.42 67.48 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.74 0.781 . . . . 0.0 110.184 178.09 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -77.6 -16.11 58.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.373 -179.29 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -113.1 126.58 55.62 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -176.039 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 46.5 m -70.44 126.41 29.57 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 103.496 -2.779 . . . . 0.0 103.496 171.545 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -82.82 119.31 24.21 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.012 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -121.73 122.68 40.1 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.912 0.863 . . . . 0.0 109.51 178.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -143.79 129.25 19.01 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.81 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.11 -127.0 32.21 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 107.899 -2.08 . . . . 0.0 107.899 -176.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -104.46 7.89 35.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.171 0.51 . . . . 0.0 110.228 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.9 t -97.72 147.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -176.088 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 m -125.22 138.78 54.12 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 171.196 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.1 t -137.29 134.61 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -99.63 114.27 65.51 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.769 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -81.52 77.18 4.04 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.515 2.143 . . . . 0.0 114.644 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -86.15 155.25 20.83 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . 0.411 HG21 ' CZ3' ' A' ' 96' ' ' TRP . 11.6 tt -147.83 146.16 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -176.617 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 72.7 t -114.48 118.16 57.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.85 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -73.4 143.27 46.84 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.01 175.42 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.42 -41.96 8.14 Favored Glycine 0 C--O 1.223 -0.548 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 169.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.9 t -57.74 -23.9 54.33 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -178.278 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.8 ptm -139.94 40.35 1.98 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 122.151 0.977 . . . . 0.0 109.721 177.759 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.79 -45.79 59.41 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -172.615 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 23.3 mtm105 -57.06 -51.31 69.8 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.967 0.803 . . . . 0.0 111.686 -178.301 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -73.79 -35.22 64.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.551 -175.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.7 -38.23 54.75 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -178.5 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.403 HD11 HD11 ' A' ' 11' ' ' ILE . 3.2 tm? -63.35 -41.98 98.89 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.745 -0.597 . . . . 0.0 110.964 -177.381 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -69.72 -13.38 62.26 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.235 -177.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.42 49.94 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -93.01 -36.57 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 120.872 0.367 . . . . 0.0 110.373 179.383 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -127.83 75.67 77.94 Favored Pre-proline 0 C--N 1.326 -0.434 0 O-C-N 122.149 -0.344 . . . . 0.0 111.246 178.229 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 -15.04 42.14 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-O 121.276 0.448 . . . . 0.0 112.953 178.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.5 m -79.99 -7.14 58.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 178.771 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -75.87 132.91 40.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.451 0.643 . . . . 0.0 110.72 -179.461 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 . . . . . 0 C--N 1.323 -0.574 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 175.353 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.224 -0.256 0 CA-C-O 120.502 0.191 . . . . 0.0 110.972 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.88 -37.62 79.87 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.71 0.29 . . . . 0.0 110.682 175.304 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.5 -42.29 68.23 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.527 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 23.9 mmt -60.28 -33.8 72.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 0.0 110.137 178.424 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.69 -38.64 87.18 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.056 -0.403 . . . . 0.0 110.328 178.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.25 -43.89 85.23 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.023 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.05 -41.59 97.33 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.2 0.524 . . . . 0.0 109.886 -178.517 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -63.01 -42.31 99.78 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -62.15 -41.53 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.168 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.0 mt -63.58 -37.68 88.25 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.098 0.475 . . . . 0.0 110.034 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.9 m -69.83 -35.16 74.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.695 0.76 . . . . 0.0 110.505 176.146 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.85 -47.32 69.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.621 -178.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.1 p -64.99 -40.3 88.6 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.639 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.226 -178.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? . . . . . 0 C--N 1.326 -0.428 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.913 -179.418 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.492 HD12 ' O ' ' A' ' 3' ' ' LEU . 10.7 tp . . . . . 0 C--O 1.234 0.249 0 CA-C-O 120.813 0.34 . . . . 25.0 110.834 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 88' ' ' SER . 3.5 mm? -73.73 -55.25 6.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.442 . . . . 25.0 110.958 179.877 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.04 -35.45 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 25.0 110.851 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.68 ' HB2' ' HB2' ' A' ' 147' ' ' ALA . 14.7 t80 -52.46 -46.1 66.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 25.0 110.948 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.497 ' CG2' HD11 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -71.22 -54.32 11.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.093 -179.977 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -51.19 -38.94 55.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.421 . . . . 25.0 110.926 -179.893 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -75.63 -48.26 22.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -48.3 74.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.84 -48.09 81.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 25.0 111.138 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.49 -44.15 62.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.552 ' HB1' HD13 ' A' ' 157' ' ' LEU . . . -72.0 -33.09 67.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.087 179.941 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.85 -51.86 59.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.484 ' CB ' HD13 ' A' ' 33' ' ' LEU . 3.8 mt -56.66 -56.13 25.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 25.0 110.903 -179.947 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -56.57 -33.0 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 25.0 111.134 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.97 -17.88 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.283 -0.417 . . . . 25.0 110.891 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.0 33.87 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.86 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.82 94.86 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.713 -0.756 . . . . 25.0 112.457 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -103.4 104.06 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.857 0.36 . . . . 25.0 110.878 -179.764 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -50.9 111.42 1.26 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.798 -0.715 . . . . 25.0 112.438 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.548 HG11 ' HB2' ' A' ' 25' ' ' ALA . 21.7 t -69.98 106.53 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.763 0.316 . . . . 25.0 111.078 -179.926 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.56 HD11 HD22 ' A' ' 43' ' ' LEU . 3.9 mt -69.12 -34.77 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.138 -0.483 . . . . 25.0 111.106 179.905 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -169.28 116.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.863 179.957 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.548 ' HB2' HG11 ' A' ' 22' ' ' VAL . . . . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.079 179.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.778 0.323 . . . . 25.0 110.869 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.57 173.12 15.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.916 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.9 mt -103.65 130.24 54.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.18 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -109.76 135.73 50.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.124 -0.489 . . . . 25.0 110.918 179.94 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.484 HD13 ' CB ' ' A' ' 15' ' ' LEU . 11.3 mt -146.03 124.51 12.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 25.0 110.942 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.24 133.64 42.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 25.0 110.9 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.4 104.04 38.97 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.594 0.711 . . . . 25.0 111.112 179.907 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -32.35 18.68 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.627 2.218 . . . . 25.0 112.328 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -25.63 60.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 25.0 110.823 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 66.27 39.7 4.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.93 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.07 -176.52 1.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 25.0 110.843 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.07 -34.54 13.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 25.0 110.945 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -105.51 122.8 46.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 25.0 110.909 179.848 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.12 -56.03 5.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.56 HD22 HD11 ' A' ' 23' ' ' ILE . 63.0 mt -119.59 155.26 32.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 25.0 110.895 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.9 148.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 25.0 111.169 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.634 ' HG3' HD11 ' A' ' 82' ' ' LEU . 1.3 mtt180 -132.23 140.15 48.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 25.0 110.827 -179.909 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.522 HD12 ' O ' ' A' ' 45' ' ' ARG . 4.5 mp -134.35 126.56 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.891 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -126.71 150.01 49.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 25.0 110.987 -179.967 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 94.84 4.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.164 -0.471 . . . . 25.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -151.57 148.95 28.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 25.0 110.875 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -92.99 140.06 29.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 25.0 110.874 179.958 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.34 152.09 35.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 25.0 110.871 -179.878 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.32 -36.25 7.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 25.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -135.97 -175.13 3.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 25.0 110.932 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt85 -80.38 -30.54 37.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 25.0 110.796 -179.894 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -35.1 62.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 25.0 110.917 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -34.87 61.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 25.0 110.905 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . 0.568 ' O ' HD12 ' A' ' 61' ' ' ILE . 1.8 tpp -72.57 -52.28 16.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.877 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.502 ' CG1' HD12 ' A' ' 99' ' ' ILE . 34.2 m -58.95 -34.26 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.268 -0.424 . . . . 25.0 111.154 179.911 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 mtm-85 -66.51 -37.68 85.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.165 -0.47 . . . . 25.0 110.868 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -54.13 46.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 25.0 110.879 179.949 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.568 HD12 ' O ' ' A' ' 57' ' ' MET . 2.4 mp -60.73 -37.85 77.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.288 -0.414 . . . . 25.0 111.139 179.948 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -51.43 -34.89 37.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 25.0 110.942 179.944 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -76.78 -35.67 57.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 25.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.74 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.8 mp0 -54.42 -59.72 4.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 25.0 110.924 -179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.507 ' HB1' ' CB ' ' A' ' 106' ' ' LYS . . . -52.22 -38.35 57.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.083 179.924 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.89 -42.04 97.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 25.0 110.886 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.48 -37.2 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.884 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . 0.744 HG11 HG13 ' A' ' 109' ' ' VAL . 68.1 t -52.85 -35.74 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 25.0 111.124 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -53.93 -36.69 63.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.813 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -72.29 -37.12 69.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.176 -0.466 . . . . 25.0 110.842 -179.891 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 86.5 t -70.87 -52.8 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 25.0 111.166 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -36.36 75.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.806 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -58.25 -45.27 88.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.818 -179.924 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -72.54 -37.55 68.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 25.0 110.9 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mp -70.98 -19.63 62.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.896 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.32 33.34 58.2 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.773 -0.727 . . . . 25.0 112.501 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.03 175.34 6.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 25.0 110.897 -179.89 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -71.27 -52.83 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -148.74 163.86 36.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 25.0 110.859 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 mmm -134.9 130.97 36.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 25.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.7 120.12 39.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 25.0 110.901 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.661 ' O ' HG13 ' A' ' 111' ' ' VAL . 0.6 OUTLIER -111.57 130.99 55.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.314 -0.403 . . . . 25.0 110.967 179.878 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.62 ' N ' HD13 ' A' ' 82' ' ' LEU . 2.3 tp -104.08 97.72 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.917 179.856 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -100.21 126.68 46.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 25.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.544 HG23 ' CB ' ' A' ' 114' ' ' ALA . 7.0 p -129.6 154.87 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 25.0 111.133 179.971 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -122.56 127.4 49.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.866 -179.953 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -98.39 114.61 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.865 -179.938 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.598 ' O ' HD11 ' A' ' 4' ' ' LEU . 60.2 p -143.76 169.52 17.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.862 -179.778 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.8 m -89.86 -51.22 5.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 25.0 111.157 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -120.58 135.24 55.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.837 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.773 ' HB2' ' HD2' ' A' ' 117' ' ' ARG . . . -69.24 160.15 80.1 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.54 0.686 . . . . 25.0 111.092 179.959 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.571 ' HD2' ' HB1' ' A' ' 91' ' ' ALA . 54.3 Cg_endo -69.58 -170.48 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.753 2.302 . . . . 25.0 112.383 -179.997 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.6 m -145.79 80.67 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 25.0 111.151 179.83 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -172.98 45.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.786 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.9 t70 63.51 55.85 1.7 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.858 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 24.3 p-90 -84.39 -29.63 26.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 25.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -50.7 -48.2 58.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.199 -0.455 . . . . 25.0 110.846 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.92 -33.57 37.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.847 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' ILE . . . . . 0.557 HG22 ' HG3' ' A' ' 113' ' ' PRO . 21.6 mm -59.99 -46.4 94.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 25.0 111.098 -179.98 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.82 -31.11 71.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.02 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -73.0 -38.07 66.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 25.0 110.932 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt -89.08 156.54 18.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.881 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.3 m -122.81 143.98 49.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.445 . . . . 25.0 111.161 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -90.75 104.16 16.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -112.43 101.09 9.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 25.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 106' ' ' LYS . . . . . 0.507 ' CB ' ' HB1' ' A' ' 65' ' ' ALA . 0.2 OUTLIER -98.01 103.28 15.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 25.0 110.823 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 52.75 -112.41 2.14 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.725 . . . . 25.0 112.437 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.1 p -95.08 29.81 2.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 25.0 111.125 -179.824 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.744 HG13 HG11 ' A' ' 68' ' ' VAL . 17.5 t -122.46 151.61 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 25.0 111.096 179.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.8 t -137.73 112.5 8.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 25.0 110.893 -179.818 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 111' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 82' ' ' LEU . 18.9 t -140.94 138.9 34.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 25.0 111.082 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.04 141.86 38.21 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.648 0.737 . . . . 25.0 110.885 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 113' ' ' PRO . . . . . 0.557 ' HG3' HG22 ' A' ' 99' ' ' ILE . 54.6 Cg_endo -69.65 135.61 31.16 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.669 2.246 . . . . 25.0 112.351 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 114' ' ' ALA . . . . . 0.544 ' CB ' HG23 ' A' ' 85' ' ' VAL . . . -134.26 135.14 42.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 25.0 111.111 179.875 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.98 137.93 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 25.0 111.165 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 116' ' ' VAL . . . . . 0.695 HG12 ' HB3' ' A' ' 124' ' ' ASP . 4.7 m -130.74 101.85 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 25.0 111.203 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.773 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -95.2 154.73 17.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.889 -179.961 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.65 -29.46 18.37 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.765 -0.731 . . . . 25.0 112.482 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.1 p -57.51 -45.37 85.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 25.0 111.172 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 1.7 mtm -134.59 46.93 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.819 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.453 ' CD1' HD12 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -61.31 -59.19 5.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 25.0 110.85 -179.963 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.72 -35.58 80.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.91 179.908 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.57 -41.09 89.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 25.0 110.8 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . 0.695 ' HB3' HG12 ' A' ' 116' ' ' VAL . 1.1 m-20 -77.43 -33.25 54.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 25.0 110.897 -179.964 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 125' ' ' LEU . . . . . 0.497 HD11 ' CG2' ' A' ' 7' ' ' THR . 0.2 OUTLIER -52.66 -33.8 48.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.495 . . . . 25.0 110.932 -179.954 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -75.36 -30.2 60.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 25.0 110.846 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.54 -37.83 65.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 25.0 111.17 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -90.34 -60.63 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.441 . . . . 25.0 111.108 179.979 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 129' ' ' PHE . . . . . 0.478 ' HZ ' HD11 ' A' ' 46' ' ' LEU . 31.0 m-85 -112.44 77.54 2.32 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.586 0.708 . . . . 25.0 110.881 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 -29.45 23.44 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.643 2.229 . . . . 25.0 112.321 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 43.3 t -69.44 -16.04 63.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 25.0 110.799 -179.813 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -54.24 146.17 15.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.854 -179.877 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.854 -179.93 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.458 -0.051 0 CA-C-O 120.854 0.359 . . . . 25.0 110.969 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 147' ' ' ALA . . . . . 0.68 ' HB2' ' HB2' ' A' ' 6' ' ' TYR . . . -53.88 -35.39 61.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 25.0 111.154 179.763 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -61.47 -44.76 96.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.852 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.2 mmt -76.93 -35.73 57.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.437 . . . . 25.0 110.852 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.65 66.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.252 -0.431 . . . . 25.0 111.132 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.3 ttt180 -65.13 -53.81 39.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -43.79 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 25.0 110.877 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -39.5 93.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.959 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 154' ' ' PHE . . . . . 0.588 ' O ' HG23 ' A' ' 158' ' ' VAL . 38.9 t80 -53.57 -44.23 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.861 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -51.93 -46.12 64.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 25.0 110.884 -179.908 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.5 m -76.15 -36.22 58.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.869 -179.933 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 157' ' ' LEU . . . . . 0.552 HD13 ' HB1' ' A' ' 13' ' ' ALA . 10.5 tt -57.17 -34.99 69.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.89 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 158' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 154' ' ' PHE . 84.1 t -52.63 -54.5 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.101 179.795 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 159' ' ' LEU . . . . . 0.653 HD13 ' O ' ' A' ' 159' ' ' LEU . 3.3 tm? . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 25.0 110.886 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.7 mpt? . . . . . 0 N--CA 1.489 1.509 0 N-CA-C 110.081 -0.34 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -133.59 156.96 46.9 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 122.32 -0.238 . . . . 0.0 110.675 -177.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -64.14 -43.81 94.09 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.312 0.577 . . . . 0.0 109.996 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.68 -34.63 78.3 Favored 'General case' 0 C--O 1.215 -0.763 0 O-C-N 122.017 -0.427 . . . . 0.0 110.976 178.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -61.62 -32.95 73.12 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.602 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -63.15 -52.44 62.45 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.2 m -59.38 -40.82 87.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.972 -0.558 . . . . 0.0 112.371 -179.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -55.26 -48.35 74.12 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 123.425 0.69 . . . . 0.0 110.983 178.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 86.8 m95 -70.49 -34.08 71.96 Favored 'General case' 0 N--CA 1.468 0.436 0 O-C-N 121.718 -0.614 . . . . 0.0 111.749 178.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -67.97 -34.88 77.4 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 122.095 -0.378 . . . . 0.0 111.397 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 24.2 mm -71.85 -41.1 69.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 177.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.14 -40.86 78.04 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.51 -49.8 73.92 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.519 178.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -64.99 -37.92 89.26 Favored 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 119.642 -0.823 . . . . 0.0 111.28 -176.503 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.1 mt -68.47 -48.79 63.56 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 4.2 p -65.22 -30.61 50.81 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 119.306 -0.958 . . . . 0.0 109.202 -178.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.9 t30 -78.17 -8.56 58.45 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 121.971 -0.455 . . . . 0.0 111.312 178.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 55.4 m -101.25 9.94 41.27 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.95 0.83 61.76 Favored Glycine 0 N--CA 1.452 -0.282 0 N-CA-C 116.836 1.494 . . . . 0.0 116.836 176.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 -68.42 132.08 46.41 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.858 -1.164 . . . . 0.0 107.858 177.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -82.13 131.29 10.28 Favored Glycine 0 C--O 1.22 -0.753 0 N-CA-C 110.271 -1.132 . . . . 0.0 110.271 -178.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -77.44 106.23 7.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 118.332 1.066 . . . . 0.0 109.329 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 74.3 mt -72.78 -42.46 61.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 178.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -148.7 116.34 6.26 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.32 116.4 10.47 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 123.189 0.306 . . . . 0.0 111.035 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 168.12 -31.93 0.18 Allowed Glycine 0 C--N 1.319 -0.406 0 C-N-CA 120.552 -0.832 . . . . 0.0 112.228 175.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.5 mp0 -66.45 154.69 39.59 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 179.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.7 m -95.7 0.56 52.72 Favored 'General case' 0 C--N 1.323 -0.549 0 O-C-N 121.985 -0.447 . . . . 0.0 111.554 -176.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -126.78 -27.42 3.07 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 114.291 1.219 . . . . 0.0 114.291 -178.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -131.6 131.68 43.45 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.217 0.821 . . . . 0.0 113.217 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 37.8 mt -136.6 132.79 48.7 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 175.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.7 m95 -108.17 129.2 55.19 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -121.88 126.26 48.28 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 123.434 0.694 . . . . 0.0 109.565 -178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -76.32 132.26 39.68 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 177.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.29 116.62 50.93 Favored Pre-proline 0 CA--C 1.546 0.809 0 N-CA-C 107.544 -1.28 . . . . 0.0 107.544 179.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -72.28 -23.58 20.7 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 117.592 -1.139 . . . . 0.0 113.812 -175.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -66.9 -27.49 67.54 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.654 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 88.7 mttt 54.83 39.54 31.5 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 123.952 1.834 . . . . 0.0 108.353 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 19.7 t -73.95 -176.26 2.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 110.816 -2.902 . . . . 0.0 107.927 176.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.2 m -47.22 -30.62 3.1 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -90.03 129.9 36.28 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 172.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -89.15 -37.36 15.11 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.956 0.408 . . . . 0.0 111.891 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.49 166.42 30.24 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.257 0.551 . . . . 0.0 111.534 -175.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 49.1 t -127.16 136.39 60.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -114.98 126.35 54.66 Favored 'General case' 0 N--CA 1.47 0.573 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 mp -95.87 129.46 43.11 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 102.98 -2.97 . . . . 0.0 102.98 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.5 t80 -136.45 113.43 10.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.644 0.735 . . . . 0.0 112.478 179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 26.6 ttpt -87.67 96.88 10.59 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.82 -178.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -151.62 139.19 19.62 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 46.9 m-20 -93.68 137.82 32.54 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 106.655 -1.609 . . . . 0.0 106.655 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -121.81 120.1 33.59 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.353 0.121 . . . . 0.0 111.115 -175.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -80.09 -48.63 12.94 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 121.559 0.695 . . . . 0.0 111.297 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -120.2 156.33 31.36 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-O 121.256 0.551 . . . . 0.0 112.4 -177.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HE ' ' CB ' ' A' ' 95' ' ' ASP . 8.4 ptt85 -64.33 -15.52 60.49 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.249 173.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -65.11 -45.66 84.2 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -72.52 -36.29 68.29 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 -178.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 20.5 ttt -57.46 -48.08 80.12 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.969 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -72.29 -31.81 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 120.137 -0.625 . . . . 0.0 110.744 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.48 -36.43 84.16 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.823 -0.626 . . . . 0.0 111.248 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -60.81 -41.23 95.28 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -66.34 -30.93 51.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 O-C-N 122.12 -0.363 . . . . 0.0 111.527 -177.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -61.04 -39.44 89.81 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 178.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -76.55 -41.83 45.11 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.019 0.437 . . . . 0.0 110.168 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -55.99 -43.23 77.45 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.71 -37.79 88.68 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -179.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -71.78 -34.18 69.2 Favored 'General case' 0 C--N 1.321 -0.661 0 O-C-N 121.72 -0.613 . . . . 0.0 109.989 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -63.28 -42.16 99.07 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.44 HG11 HG13 ' A' ' 109' ' ' VAL . 45.5 t -67.17 -32.24 56.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.782 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -57.9 -33.56 68.87 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.239 -0.913 . . . . 0.0 110.447 177.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 76.9 mtp85 -68.87 -40.45 79.26 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.99 0.424 . . . . 0.0 109.97 177.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 48.5 t -68.73 -36.75 75.79 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.082 0.468 . . . . 0.0 109.746 -179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 33.2 ttp180 -55.79 -39.44 71.28 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.113 -0.367 . . . . 0.0 110.668 178.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 85.6 t60 -59.28 -50.86 72.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.048 -178.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -73.37 -22.45 60.27 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -82.59 -18.06 42.61 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 122.015 -0.428 . . . . 0.0 112.032 179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.09 2.06 12.05 Favored Glycine 0 CA--C 1.525 0.673 0 N-CA-C 116.197 1.239 . . . . 0.0 116.197 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -75.58 152.71 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 118.108 0.954 . . . . 0.0 112.976 -177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.5 ttt85 -69.11 -22.84 63.95 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 114.761 -1.109 . . . . 0.0 111.903 179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 -147.35 151.85 37.23 Favored 'General case' 0 CA--C 1.512 -0.513 0 N-CA-C 104.16 -2.533 . . . . 0.0 104.16 177.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -119.99 135.79 54.79 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 105.882 -1.895 . . . . 0.0 105.882 178.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -126.13 126.13 43.65 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 175.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 53.8 tp -114.13 134.47 54.87 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.765 -1.107 . . . . 0.0 110.817 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.6 tp -95.08 120.43 35.28 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 104.244 -2.502 . . . . 0.0 104.244 169.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -114.24 114.79 26.45 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 118.312 0.505 . . . . 0.0 110.362 -179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.5 t -109.08 111.01 34.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.004 0.431 . . . . 0.0 112.048 -177.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -77.21 141.69 39.94 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 175.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -116.11 103.68 10.8 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 104.789 -2.3 . . . . 0.0 104.789 174.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 5.7 m -128.36 150.62 50.02 Favored 'General case' 0 C--N 1.327 -0.397 0 O-C-N 123.546 0.529 . . . . 0.0 111.141 -174.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.3 t -70.61 -29.0 65.27 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.511 -0.743 . . . . 0.0 110.458 -179.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -148.54 164.06 35.35 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -88.64 157.51 49.37 Favored Pre-proline 0 C--N 1.319 -0.718 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -55.87 147.33 62.8 Favored 'Trans proline' 0 C--N 1.35 0.651 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.44 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 19.8 m -65.84 -14.16 16.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 116.686 2.106 . . . . 0.0 116.686 -172.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -152.0 146.64 25.73 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.296 0.85 . . . . 0.0 113.296 -177.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.48 ' CB ' ' HE ' ' A' ' 54' ' ' ARG . 60.1 m-20 47.22 6.28 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 120.243 3.423 . . . . 0.0 120.243 176.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -58.95 -25.89 63.93 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 120.86 -1.15 . . . . 0.0 112.61 -175.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -62.67 -32.24 73.27 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.996 -0.44 . . . . 0.0 112.18 -177.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.1 mt-10 -63.07 -33.49 75.54 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-O 121.853 0.835 . . . . 0.0 109.187 178.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.3 mm -69.21 -41.14 81.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.153 -0.93 . . . . 0.0 110.483 -173.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.87 -12.55 61.02 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.082 0.468 . . . . 0.0 111.469 178.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -98.56 0.24 44.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.416 -178.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 55.6 pttt -121.88 135.75 54.9 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 121.479 0.656 . . . . 0.0 112.346 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 94.8 m -82.59 126.95 32.88 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 174.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -85.42 119.0 25.29 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 176.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -123.45 131.79 53.75 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 178.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -139.31 103.6 4.78 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 114.528 -1.215 . . . . 0.0 108.738 -178.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.96 -112.7 4.35 Favored Glycine 0 C--O 1.224 -0.497 0 N-CA-C 109.062 -1.615 . . . . 0.0 109.062 -177.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 20.0 p -108.59 8.31 27.06 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.171 0.51 . . . . 0.0 110.578 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.44 HG13 HG11 ' A' ' 68' ' ' VAL . 86.1 t -95.38 141.49 15.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 179.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.6 t -127.35 135.67 50.84 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 104.745 -2.317 . . . . 0.0 104.745 175.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.4 t -134.25 134.94 54.88 Favored 'Isoleucine or valine' 0 CA--C 1.483 -1.603 0 CA-C-O 122.107 0.956 . . . . 0.0 109.284 179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -103.18 101.88 24.94 Favored Pre-proline 0 N--CA 1.427 -1.582 0 CA-C-N 113.26 -1.791 . . . . 0.0 108.207 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -77.31 145.43 24.02 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 116.941 -1.573 . . . . 0.0 112.451 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.36 154.57 40.13 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 105.484 -2.043 . . . . 0.0 105.484 176.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.9 tt -147.33 128.78 6.16 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 24.8 m -107.36 121.53 60.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 N-CA-C 104.198 -2.519 . . . . 0.0 104.198 175.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -108.45 140.03 42.34 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 -175.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.56 -32.54 53.42 Favored Glycine 0 C--O 1.229 -0.176 0 CA-C-N 115.568 -0.742 . . . . 0.0 114.188 -177.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 32.9 p -53.35 -30.19 38.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 115.718 1.747 . . . . 0.0 115.718 -178.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.5 ptm -140.94 26.92 2.02 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.86 0.838 . . . . 0.0 109.44 -178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.7 tp -47.86 -40.88 22.69 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 118.263 2.69 . . . . 0.0 118.263 -168.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -41.75 94.93 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.675 1.125 . . . . 0.0 112.028 -177.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -78.55 -40.25 35.47 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.981 0.896 . . . . 0.0 110.878 179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -61.69 -41.86 98.15 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 114.725 -1.125 . . . . 0.0 111.589 -176.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 17.5 tp -65.96 -42.48 89.87 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.44 -177.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -76.64 -15.09 59.91 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.657 -0.417 . . . . 0.0 110.626 -178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.35 -34.63 63.45 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 57.4 t -90.18 -43.17 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-O 121.179 0.514 . . . . 0.0 109.903 178.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -120.49 78.89 28.78 Favored Pre-proline 0 C--N 1.324 -0.506 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.773 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -69.68 -9.12 25.36 Favored 'Trans proline' 0 CA--C 1.532 0.403 0 C-N-CA 117.669 -1.087 . . . . 0.0 112.515 178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 1.3 p -74.28 -14.92 60.98 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.396 176.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -96.72 134.17 40.34 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.973 -0.751 . . . . 0.0 108.973 179.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 49.9 mtp85 -90.04 130.03 36.28 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.564 -0.532 . . . . 0.0 109.564 -177.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 77.1 p -66.3 -23.15 66.33 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.107 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -64.46 -26.69 68.55 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.022 0.439 . . . . 0.0 111.078 177.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -76.43 -11.65 59.92 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-O 121.962 0.887 . . . . 0.0 110.176 -179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 17.0 t -118.74 44.58 2.25 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 178.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.83 143.77 46.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.288 -0.869 . . . . 0.0 108.958 179.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 77.5 tt0 -59.33 -34.48 72.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.155 0.502 . . . . 0.0 112.209 -176.128 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 51.8 mt-10 -69.78 -11.61 60.99 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -116.77 -26.62 6.9 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.278 0.561 . . . . 0.0 111.27 -177.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -81.94 88.82 6.36 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 121.86 -0.525 . . . . 0.0 110.643 179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 24.5 p -130.94 164.6 24.95 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.333 0.587 . . . . 0.0 111.089 177.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -59.93 -38.46 82.43 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.551 -0.75 . . . . 0.0 111.195 -178.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -72.55 -37.84 68.14 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.014 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -62.59 -24.38 67.53 Favored 'General case' 0 C--O 1.214 -0.797 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.506 -178.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -31.72 55.91 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.112 -0.368 . . . . 0.0 111.662 177.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 35.8 mt-30 -64.58 -48.31 75.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 177.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.0 mmt -66.4 -35.64 80.83 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 115.445 -0.798 . . . . 0.0 109.913 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.55 -38.33 77.57 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 122.33 -0.231 . . . . 0.0 110.628 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 65.7 ttt180 -65.34 -45.9 82.41 Favored 'General case' 0 C--O 1.213 -0.864 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -61.29 -43.43 98.88 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.148 0.499 . . . . 0.0 111.029 -178.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 55.9 mmt-85 -63.17 -44.01 96.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -59.14 -41.56 88.6 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.28 0.474 . . . . 0.0 112.28 177.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 80.2 mt -65.48 -35.8 81.96 Favored 'General case' 0 C--N 1.321 -0.657 0 O-C-N 121.646 -0.658 . . . . 0.0 111.2 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 87.6 p -75.81 -27.81 58.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 121.487 -0.758 . . . . 0.0 110.53 175.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -71.69 -43.68 65.55 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.474 -177.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -62.3 -33.07 57.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -73.84 -41.27 62.51 Favored 'General case' 0 C--N 1.327 -0.387 0 O-C-N 121.719 -0.613 . . . . 0.0 109.584 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -61.71 -32.35 72.56 Favored 'General case' 0 N--CA 1.469 0.478 0 O-C-N 121.464 -0.772 . . . . 0.0 111.059 178.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.77 -28.58 61.51 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 122.729 0.411 . . . . 0.0 110.689 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 80.6 mt-10 -62.37 -39.52 93.44 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.295 0.569 . . . . 0.0 109.739 -179.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -76.03 -38.55 57.11 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.358 0.599 . . . . 0.0 109.729 179.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 18.9 mm100 -59.65 -43.19 94.0 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 -66.39 -17.84 65.01 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 87.3 mttt -72.59 -48.57 38.68 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 178.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 43.9 p -72.43 -25.75 61.59 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 111.788 0.292 . . . . 0.0 111.788 178.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -58.37 -28.98 65.64 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.531 0.732 . . . . 0.0 112.342 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.02 -26.97 51.09 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -84.19 62.54 7.18 Favored 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 177.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 31.6 m -60.59 140.89 17.82 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.592 0.71 . . . . 0.0 110.835 -178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 54.3 p90 -145.29 3.7 1.03 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -176.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -148.97 149.58 31.42 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 122.222 -0.299 . . . . 0.0 110.671 -175.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -146.88 160.69 42.0 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 178.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -170.06 171.88 43.63 Favored Glycine 0 C--O 1.228 -0.257 0 N-CA-C 109.123 -1.591 . . . . 0.0 109.123 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 51.5 pttt -158.06 169.79 23.76 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 39.4 tp -123.48 -35.46 2.93 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.159 0.799 . . . . 0.0 113.159 -178.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 55.39 33.61 21.23 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 114.269 1.211 . . . . 0.0 114.269 179.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 8.1 tmm_? -73.03 110.75 7.55 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -128.49 150.8 50.0 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 105.968 -1.864 . . . . 0.0 105.968 177.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -152.35 -57.98 0.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 111.615 0.228 . . . . 0.0 111.615 -178.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.52 ' HG ' ' H ' ' A' ' 183' ' ' TYR . 10.4 tp 58.35 -161.52 0.24 Allowed 'General case' 0 N--CA 1.472 0.663 0 O-C-N 123.975 0.797 . . . . 0.0 109.687 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . 0.52 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 49.6 p90 -159.68 159.94 33.57 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 104.224 -2.509 . . . . 0.0 104.224 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -160.93 169.44 22.6 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 105.709 -1.96 . . . . 0.0 105.709 -178.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 . . . . . 0 C--O 1.253 1.265 0 N-CA-C 104.14 -2.541 . . . . 0.0 104.14 179.971 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.797 -0.62 . . . . 0.0 109.509 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -132.52 -51.31 0.93 Allowed 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.528 0.936 . . . . 0.0 113.528 -178.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -64.33 -34.61 78.54 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 177.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 23.8 tp -63.08 -42.19 99.59 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.448 176.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -64.63 -41.05 96.43 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -58.59 -48.14 81.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 22.9 m -66.12 -43.46 87.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.352 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -55.09 -51.63 65.78 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 122.622 0.369 . . . . 0.0 110.984 -179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -72.3 -29.95 64.34 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.728 -0.607 . . . . 0.0 112.143 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 8.3 mtmt -71.1 -35.54 71.84 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.557 -0.715 . . . . 0.0 111.166 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.1 mm -71.29 -37.83 67.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.14 -45.15 87.87 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 176.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.66 -40.8 96.07 Favored 'General case' 0 C--O 1.208 -1.123 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.033 177.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -58.94 -49.81 76.44 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 -178.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.2 mp -68.35 -45.42 72.9 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 119.816 -0.754 . . . . 0.0 110.089 -179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.76 -42.77 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 120.153 -0.619 . . . . 0.0 109.937 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -61.97 -26.53 68.26 Favored 'General case' 0 C--O 1.219 -0.545 0 O-C-N 121.915 -0.491 . . . . 0.0 111.72 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 20.0 m -82.53 5.24 21.44 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 122.575 0.35 . . . . 0.0 111.763 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.12 -1.51 44.06 Favored Glycine 0 CA--C 1.517 0.164 0 N-CA-C 115.483 0.953 . . . . 0.0 115.483 176.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -68.01 123.05 19.55 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 117.817 0.808 . . . . 0.0 109.393 178.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.01 129.39 9.66 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 107.468 -2.253 . . . . 0.0 107.468 178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -78.31 133.99 29.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 178.661 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 66.2 mt -97.07 -41.94 11.55 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 N-CA-C 106.785 -1.561 . . . . 0.0 106.785 -179.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -149.2 142.24 24.87 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 104.804 -2.295 . . . . 0.0 104.804 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.2 105.2 4.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.02 41.68 26.73 Favored Glycine 0 C--O 1.225 -0.434 0 C-N-CA 120.784 -0.722 . . . . 0.0 113.128 175.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -60.43 -35.8 76.68 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 122.369 1.08 . . . . 0.0 108.773 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 m -158.4 -69.43 0.09 Allowed 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 105.511 -2.033 . . . . 0.0 105.511 174.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -135.42 14.12 3.48 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.67 -177.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -133.18 152.28 51.95 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 114.537 1.31 . . . . 0.0 114.537 -177.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 93.2 mt -135.21 133.48 52.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -114.44 136.11 53.37 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 123.14 0.576 . . . . 0.0 109.654 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mp -132.91 137.97 46.8 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 123.349 0.66 . . . . 0.0 109.923 -178.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 57.4 tt0 -93.86 135.82 34.78 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.77 111.93 15.38 Favored Pre-proline 0 CA--C 1.549 0.91 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -73.59 -24.96 15.48 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 117.523 -1.184 . . . . 0.0 114.173 -174.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -74.19 -8.3 55.72 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 113.165 0.802 . . . . 0.0 113.165 -179.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt 58.15 43.95 19.81 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 105.738 -1.949 . . . . 0.0 105.738 -173.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -68.19 -177.66 0.91 Allowed 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 113.273 -1.785 . . . . 0.0 110.915 -177.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 p -56.27 -27.64 55.97 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.484 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 18.5 m-70 -105.76 133.4 50.55 Favored 'General case' 0 CA--C 1.514 -0.438 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 175.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -80.11 -39.81 28.77 Favored 'General case' 0 C--N 1.321 -0.63 0 CA-C-O 120.96 0.409 . . . . 0.0 109.933 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.4 mt -137.38 160.35 39.32 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.716 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 58.5 t -131.51 137.43 55.33 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 175.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 60.4 ttt180 -123.35 132.27 53.93 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -103.2 124.08 47.92 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 105.464 -2.05 . . . . 0.0 105.464 174.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.2 t80 -136.54 150.0 48.4 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.7 pttt -125.81 119.91 29.14 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 118.181 0.446 . . . . 0.0 112.019 179.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.71 140.43 20.83 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 18.7 m-20 -92.61 111.98 23.76 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 104.405 -2.443 . . . . 0.0 104.405 173.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 16.7 mt -104.09 125.19 50.23 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 -175.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -87.22 -34.7 18.89 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.18 0.514 . . . . 0.0 110.708 -179.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 35.3 m-85 -130.29 148.01 52.07 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -177.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.403 ' CZ ' ' HB2' ' A' ' 95' ' ' ASP . 14.1 ptt180 -67.38 -21.05 65.63 Favored 'General case' 0 CA--C 1.505 -0.768 0 O-C-N 121.088 -1.008 . . . . 0.0 111.803 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -62.11 -28.52 69.69 Favored 'General case' 0 C--O 1.213 -0.865 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 177.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -77.69 -45.07 25.95 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 175.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.4 ttm -54.56 -49.97 69.07 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.484 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.2 m -60.17 -31.87 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -177.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -68.25 -34.57 76.45 Favored 'General case' 0 CA--C 1.506 -0.745 0 C-N-CA 121.141 -0.223 . . . . 0.0 111.238 -176.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.03 -42.24 89.71 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -74.18 -34.43 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 O-C-N 122.019 -0.426 . . . . 0.0 111.355 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.94 -41.54 92.05 Favored 'General case' 0 C--O 1.243 0.741 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 177.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -76.3 -33.73 59.07 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.715 -0.675 . . . . 0.0 109.948 -179.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.1 tp-100 -58.2 -46.62 85.51 Favored 'General case' 0 C--O 1.219 -0.52 0 O-C-N 121.966 -0.459 . . . . 0.0 109.798 176.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.05 -32.68 74.11 Favored 'General case' 0 N--CA 1.444 -0.755 0 O-C-N 122.403 -0.185 . . . . 0.0 110.623 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.59 -46.54 85.35 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 176.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.5 mmp_? -61.67 -41.31 97.38 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.422 HG11 HG13 ' A' ' 109' ' ' VAL . 86.7 t -61.31 -35.34 65.56 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.74 0 CA-C-O 119.2 -0.428 . . . . 0.0 110.986 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 57.9 mt-10 -55.48 -38.99 69.85 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 119.493 1.042 . . . . 0.0 110.597 178.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.3 mpt_? -73.93 -45.79 48.3 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.705 0.288 . . . . 0.0 111.118 177.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 93.9 t -65.06 -44.33 95.82 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 120.652 0.263 . . . . 0.0 111.698 -177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.2 -30.1 70.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.151 -0.968 . . . . 0.0 110.167 179.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -68.89 -43.15 75.86 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 110.067 -0.346 . . . . 0.0 110.067 177.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.12 -30.99 70.28 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 120.879 0.371 . . . . 0.0 111.246 -179.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.2 mt -83.33 -14.0 53.86 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.852 0.358 . . . . 0.0 111.489 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 72.98 -3.09 30.63 Favored Glycine 0 CA--C 1.522 0.469 0 N-CA-C 114.191 0.437 . . . . 0.0 114.191 -179.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -71.0 136.02 48.15 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 -177.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 56.3 ttm-85 -64.24 -45.79 86.64 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 122.124 -0.36 . . . . 0.0 111.785 -176.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.1 mtm180 -119.98 162.26 19.52 Favored 'General case' 0 CA--C 1.502 -0.887 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 178.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.4 ttp -145.31 138.84 26.64 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.363 174.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.1 mtpt -113.63 143.46 44.53 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 123.647 0.592 . . . . 0.0 109.863 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 6.1 tt -139.47 136.85 35.03 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 58.0 tp -99.22 106.35 18.49 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 106.656 -1.609 . . . . 0.0 106.656 174.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -97.31 108.52 21.26 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 -177.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.41 116.31 46.95 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 -175.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 69.1 m-85 -85.98 151.37 23.79 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 175.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -126.3 129.43 48.85 Favored 'General case' 0 C--N 1.317 -0.813 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 172.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.5 p -147.62 163.02 37.94 Favored 'General case' 0 C--N 1.323 -0.572 0 O-C-N 123.017 0.198 . . . . 0.0 110.784 -174.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 25.0 m -67.09 -48.96 66.59 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 173.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 16.0 tt0 -151.41 165.99 32.44 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 105.188 -2.153 . . . . 0.0 105.188 -178.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.16 158.14 36.5 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.14 -176.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_exo -54.48 146.01 54.7 Favored 'Trans proline' 0 C--N 1.349 0.571 0 N-CA-C 116.902 1.847 . . . . 0.0 116.902 -178.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.6 m -77.18 -19.51 14.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.01 177.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 36.4 t0 -87.71 87.22 7.31 Favored 'General case' 0 C--O 1.213 -0.841 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.755 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.403 ' HB2' ' CZ ' ' A' ' 54' ' ' ARG . 68.8 m-20 19.84 51.25 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 119.054 2.983 . . . . 0.0 119.054 176.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 35.2 p-90 -63.05 -20.59 65.48 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.519 -0.738 . . . . 0.0 112.875 -179.278 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -59.35 -31.29 69.06 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 122.246 -0.284 . . . . 0.0 111.451 -177.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -63.73 -30.35 71.46 Favored 'General case' 0 C--O 1.218 -0.553 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.685 178.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.4 HD11 ' HD2' ' A' ' 54' ' ' ARG . 9.4 mm -73.46 -38.51 53.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-O 120.86 0.362 . . . . 0.0 110.3 -176.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.07 -25.3 67.74 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 122.101 0.953 . . . . 0.0 110.441 179.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -97.69 21.71 10.04 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.215 -177.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.3 ttmm -139.36 98.02 3.41 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -173.574 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 65.1 m -68.24 127.07 31.58 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 107.638 -1.245 . . . . 0.0 107.638 175.266 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 64.5 t80 -86.39 112.12 21.16 Favored 'General case' 0 C--N 1.319 -0.747 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -108.4 131.98 54.21 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.809 0.814 . . . . 0.0 110.103 178.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -128.86 84.51 2.24 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.94 -110.44 3.15 Favored Glycine 0 C--O 1.22 -0.78 0 N-CA-C 108.671 -1.772 . . . . 0.0 108.671 -178.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 71.7 p -98.09 -1.32 42.68 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.422 HG13 HG11 ' A' ' 68' ' ' VAL . 95.9 t -89.52 138.55 19.08 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.401 -0.963 . . . . 0.0 108.401 177.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 7.0 m -133.98 112.72 11.46 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 173.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.9 t -121.53 130.58 74.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -113.58 133.0 22.28 Favored Pre-proline 0 C--O 1.244 0.808 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 177.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -81.58 160.88 19.4 Favored 'Trans proline' 0 N--CA 1.459 -0.506 0 O-C-N 122.253 0.607 . . . . 0.0 112.446 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.86 152.59 36.72 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 102.444 -3.169 . . . . 0.0 102.444 174.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.9 tt -147.76 135.46 14.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.687 0 N-CA-C 107.626 -1.249 . . . . 0.0 107.626 -178.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 51.7 t -108.98 117.32 54.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 108.312 -0.995 . . . . 0.0 108.312 178.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.41 146.91 42.54 Favored 'General case' 0 C--O 1.214 -0.803 0 CA-C-N 115.334 -0.848 . . . . 0.0 109.295 177.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.49 -41.5 8.35 Favored Glycine 0 N--CA 1.449 -0.479 0 N-CA-C 109.379 -1.488 . . . . 0.0 109.379 172.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.3 t -65.51 -19.75 66.06 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 115.5 1.667 . . . . 0.0 115.5 -177.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 24.4 ptm -136.63 32.0 2.78 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 122.095 0.95 . . . . 0.0 109.355 177.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -49.19 -43.83 42.58 Favored 'General case' 0 C--O 1.213 -0.821 0 N-CA-C 116.545 2.054 . . . . 0.0 116.545 -172.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.4 ptt-85 -54.69 -51.35 65.82 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 118.309 0.504 . . . . 0.0 112.052 -177.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -75.05 -39.66 60.81 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.951 -177.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 t0 -70.37 -32.12 69.66 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -175.586 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.45 -41.22 93.62 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.721 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -65.11 -21.23 66.77 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -176.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.7 -22.69 60.86 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.648 0.261 . . . . 0.0 110.91 179.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.0 t -109.06 -42.65 5.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.167 0.508 . . . . 0.0 111.554 -178.227 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -125.54 73.88 68.82 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.366 -178.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.83 -12.38 32.65 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 117.991 -0.873 . . . . 0.0 113.362 -179.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.0 m -80.39 -5.08 55.91 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.229 0.455 . . . . 0.0 112.229 178.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 71.1 t80 -103.6 132.95 49.41 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 39.5 mtp85 -70.51 102.97 2.34 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 176.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 3.7 t -68.26 -18.04 64.44 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 -178.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 135' ' ' GLU . 18.5 mp0 -74.31 -12.05 60.43 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 123.241 0.617 . . . . 0.0 111.416 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -82.34 7.4 14.13 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 177.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 19.8 t -128.49 137.09 51.63 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 104.453 -2.425 . . . . 0.0 104.453 177.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 36.4 t -138.45 132.26 31.05 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.545 0.688 . . . . 0.0 112.564 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 57.1 tt0 -68.28 -37.31 80.55 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.513 -1.222 . . . . 0.0 109.285 177.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -64.62 -27.94 69.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.967 -177.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -93.54 -9.4 38.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.017 -178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . 63.25 -44.73 0.22 Allowed 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 115.977 1.843 . . . . 0.0 115.977 -178.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 14.6 m 54.51 25.68 6.44 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 114.081 1.141 . . . . 0.0 114.081 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 20.0 m-30 -64.72 -50.52 66.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.771 0.319 . . . . 0.0 111.565 -177.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -72.45 -28.8 63.16 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.892 0.853 . . . . 0.0 109.841 178.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -66.26 -23.54 66.42 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.688 -177.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -39.85 72.95 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.731 0.3 . . . . 0.0 111.524 177.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -68.67 -41.94 78.58 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.531 0.681 . . . . 0.0 109.266 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 46.3 mtt -64.41 -37.0 86.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.978 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.84 -37.55 87.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.447 179.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 72.9 ttt180 -64.61 -52.6 56.64 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -63.85 -36.02 82.55 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.373 0.606 . . . . 0.0 111.148 -177.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.5 ttt180 -63.86 -39.67 94.75 Favored 'General case' 0 C--O 1.22 -0.474 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 176.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -66.95 -42.14 85.74 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 122.129 0.171 . . . . 0.0 111.289 177.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.37 -34.84 75.99 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.177 0.513 . . . . 0.0 109.822 179.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 24.0 m -75.97 -35.69 59.55 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 121.392 0.615 . . . . 0.0 111.477 176.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 5.7 tt -65.56 -43.16 90.74 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.5 p -57.72 -40.76 77.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 C-N-CA 120.729 -0.389 . . . . 0.0 111.739 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -67.91 -40.51 83.39 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.539 . . . . 0.0 110.265 179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -67.44 -31.1 71.04 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 121.677 -0.639 . . . . 0.0 111.452 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 3.8 tm0? -59.1 -28.48 66.56 Favored 'General case' 0 C--N 1.319 -0.72 0 O-C-N 121.953 -0.467 . . . . 0.0 111.835 -178.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -57.36 -37.19 72.22 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.089 0.471 . . . . 0.0 110.095 178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -76.98 -45.91 25.84 Favored 'General case' 0 C--O 1.24 0.597 0 CA-C-O 121.482 0.658 . . . . 0.0 109.864 177.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -60.23 -51.62 68.79 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 115.714 1.746 . . . . 0.0 115.714 -175.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 34.0 ptt-85 -64.96 -22.11 66.95 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-N 119.59 1.086 . . . . 0.0 113.38 -175.425 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -70.9 -39.3 72.83 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 21.5 m -72.41 -46.44 55.18 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.92 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 72.9 mt-10 -66.61 -24.24 66.29 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -177.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -59.96 -23.11 63.32 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 120.519 0.199 . . . . 0.0 111.523 177.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -81.96 69.18 8.61 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.806 -1.183 . . . . 0.0 107.806 176.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 30.0 m -65.93 143.71 15.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -158.91 -42.97 0.06 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.008 -0.997 . . . . 0.0 109.548 175.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 5.0 pm0 40.08 -145.15 0.03 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.838 1.255 . . . . 0.0 113.81 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 9.2 p-10 -154.42 166.4 33.36 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -82.09 102.04 2.25 Favored Glycine 0 C--N 1.323 -0.185 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.54 179.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -152.43 166.1 32.98 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 176.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -154.71 162.45 41.12 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 105.373 -2.084 . . . . 0.0 105.373 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -138.6 164.18 30.15 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.62 -1.622 . . . . 0.0 106.62 179.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 53.7 ptt85 -157.99 148.17 20.34 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 177.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -154.96 171.41 19.75 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 103.975 -2.602 . . . . 0.0 103.975 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -147.83 138.5 23.17 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.838 0.744 . . . . 0.0 111.171 179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 4.0 tt -111.18 -25.25 9.82 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 123.913 0.758 . . . . 0.0 110.698 177.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 12.1 m-85 -80.72 106.76 12.97 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.778 0.799 . . . . 0.0 113.033 -175.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -127.46 114.55 17.62 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 105.468 -2.049 . . . . 0.0 105.468 176.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.25 1.111 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -175.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 ttt . . . . . 0 N--CA 1.486 1.375 0 CA-C-O 119.258 -0.401 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -123.55 160.59 26.7 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 118.638 0.654 . . . . 0.0 109.639 178.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.9 tt -67.83 -44.67 76.68 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -176.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -60.99 -32.41 71.98 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.649 0.737 . . . . 0.0 112.052 -178.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -56.98 -27.15 61.13 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.123 -0.944 . . . . 0.0 111.358 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -61.29 -52.3 65.27 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 109.319 -0.622 . . . . 0.0 109.319 178.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.5 m -69.45 -40.22 77.31 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.141 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -52.82 -58.03 8.24 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.289 0.848 . . . . 0.0 113.289 -178.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -68.01 -28.07 67.1 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 121.476 -0.765 . . . . 0.0 111.905 -177.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 30.2 mttt -73.18 -29.87 63.14 Favored 'General case' 0 C--N 1.323 -0.576 0 O-C-N 122.09 -0.381 . . . . 0.0 111.455 178.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.424 HD11 HD11 ' A' ' 125' ' ' LEU . 12.9 mm -69.87 -41.88 79.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.56 80.28 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 178.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.01 -41.42 98.05 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.077 -0.511 . . . . 0.0 112.094 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -39.32 86.33 Favored 'General case' 0 C--O 1.22 -0.476 0 C-N-CA 120.644 -0.423 . . . . 0.0 111.27 -179.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.45 -44.23 83.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 49.9 t -59.84 -42.58 89.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.027 179.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -77.96 -2.41 36.79 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 121.358 -0.839 . . . . 0.0 112.692 179.211 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -98.37 7.96 45.5 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.47 -0.937 . . . . 0.0 108.47 173.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.54 -1.32 57.02 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 116.694 1.437 . . . . 0.0 116.694 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.445 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 12.8 m-85 -69.69 125.32 26.36 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 118.336 1.068 . . . . 0.0 110.442 -178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.46 133.67 13.1 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 110.804 -0.918 . . . . 0.0 110.804 -177.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.6 t -78.25 117.09 22.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.465 HD11 HD22 ' A' ' 43' ' ' LEU . 75.3 mt -87.24 -44.74 16.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 176.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -149.56 123.26 9.21 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.827 -178.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 127.62 21.4 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 104.115 -2.55 . . . . 0.0 104.115 172.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 167.22 -38.57 0.24 Allowed Glycine 0 CA--C 1.503 -0.658 0 N-CA-C 108.898 -1.681 . . . . 0.0 108.898 179.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -67.93 146.87 53.18 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 106.298 -1.742 . . . . 0.0 106.298 175.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.3 m -79.34 -14.94 58.66 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -178.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -115.88 -18.04 10.84 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 115.829 1.788 . . . . 0.0 115.829 -173.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -135.53 141.02 45.17 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 42.3 mt -136.1 131.69 49.44 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 177.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 87.6 m95 -106.83 128.74 54.52 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 -179.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -124.09 133.45 53.61 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.564 -178.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -87.52 137.03 32.69 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -85.03 107.25 11.03 Favored Pre-proline 0 CA--C 1.549 0.921 0 O-C-N 123.034 0.209 . . . . 0.0 111.554 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 90.2 Cg_endo -73.49 -20.23 20.92 Favored 'Trans proline' 0 C--N 1.353 0.807 0 C-N-CA 118.009 -0.861 . . . . 0.0 112.418 -178.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -66.88 -25.45 66.4 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 114.787 -1.097 . . . . 0.0 112.708 -178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.0 mttt 59.59 40.75 19.86 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 106.546 -1.65 . . . . 0.0 106.546 -173.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 61.0 p -75.79 -177.52 3.82 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 112.498 -2.137 . . . . 0.0 108.728 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.2 -1.56 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 179.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 40.3 m-70 -136.08 133.57 37.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.067 -2.197 . . . . 0.0 105.067 175.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -76.91 -35.75 57.12 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.449 0.643 . . . . 0.0 109.898 -177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.465 HD22 HD11 ' A' ' 23' ' ' ILE . 54.8 mt -136.24 162.62 32.47 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 -179.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.0 t -126.4 133.7 68.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.962 -1.496 . . . . 0.0 106.962 175.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.2 ttt85 -118.47 115.67 25.1 Favored 'General case' 0 CA--C 1.509 -0.6 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 177.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 tp -90.24 123.31 33.93 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 105.84 -1.911 . . . . 0.0 105.84 176.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.1 t80 -136.35 141.9 43.77 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 117.902 0.319 . . . . 0.0 111.548 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -111.39 119.73 39.8 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.8 t-160 -151.71 123.62 8.06 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 -177.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.21 121.0 26.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 177.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -110.42 108.3 18.28 Favored 'General case' 0 C--O 1.22 -0.483 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 -176.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -70.29 -46.84 63.49 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 122.458 1.123 . . . . 0.0 109.856 177.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.5 m-85 -119.78 155.46 32.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.051 -176.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -62.56 -22.29 66.23 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.7 pt20 -65.58 -32.26 73.75 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 110.046 -0.353 . . . . 0.0 110.046 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -66.42 -31.36 72.07 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -69.96 -49.12 54.94 Favored 'General case' 0 C--O 1.219 -0.522 0 C-N-CA 120.605 -0.438 . . . . 0.0 110.534 177.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -66.48 -32.07 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -175.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.0 ptt85 -71.24 -27.65 63.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.686 -0.405 . . . . 0.0 111.303 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -68.5 -37.52 80.14 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.393 -0.965 . . . . 0.0 108.393 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.7 mm -68.84 -30.64 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.334 -179.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -61.88 -42.13 98.69 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -70.05 -41.8 73.71 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.029 0.919 . . . . 0.0 109.187 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.59 -37.11 77.67 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.396 -0.82 . . . . 0.0 111.005 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.34 -41.92 96.53 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-O 119.464 -0.303 . . . . 0.0 110.853 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -64.26 -39.95 94.99 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.117 -0.698 . . . . 0.0 109.117 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.95 -44.52 97.15 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.3 t -67.08 -40.86 86.29 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.666 0 CA-C-O 119.737 -0.173 . . . . 0.0 110.57 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -35.01 72.06 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.262 0.553 . . . . 0.0 109.932 -178.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 56.1 mtp180 -73.6 -45.73 51.29 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 121.803 -0.561 . . . . 0.0 110.786 176.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.68 -42.69 90.01 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -178.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -59.36 -30.23 68.26 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 121.341 -0.849 . . . . 0.0 110.729 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.9 t-80 -66.16 -36.73 83.86 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -70.27 -39.66 74.82 Favored 'General case' 0 C--O 1.221 -0.407 0 CA-C-O 121.315 0.579 . . . . 0.0 109.689 178.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 74.6 mt -75.38 -7.79 54.95 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.638 -0.71 . . . . 0.0 112.264 -179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.53 10.53 63.64 Favored Glycine 0 CA--C 1.522 0.485 0 CA-C-O 121.316 0.398 . . . . 0.0 113.368 -179.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -76.23 137.67 40.12 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.366 0.603 . . . . 0.0 110.333 -176.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.4 mmt85 -72.0 -30.53 65.33 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.994 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.7 ttm180 -151.46 149.34 29.14 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 103.791 -2.67 . . . . 0.0 103.791 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.7 ttp -131.42 143.15 50.24 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 118.913 0.779 . . . . 0.0 109.901 177.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.1 mtpt -107.57 136.94 46.49 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 175.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 44.0 tp -125.75 137.31 53.8 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.3 tp -94.81 121.27 36.23 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 106.793 -1.558 . . . . 0.0 106.793 171.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -101.36 135.53 42.71 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 175.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.0 t -132.79 111.62 17.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 174.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -82.75 150.58 26.59 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 123.584 0.553 . . . . 0.0 110.541 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -128.94 115.87 18.5 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.885 -2.265 . . . . 0.0 104.885 173.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 96.2 p -137.06 160.8 37.88 Favored 'General case' 0 C--N 1.328 -0.37 0 O-C-N 123.478 0.486 . . . . 0.0 110.6 -177.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.7 t -70.55 -30.89 67.74 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.909 -0.495 . . . . 0.0 110.992 -179.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -152.93 170.82 19.44 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.85 154.8 61.45 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 -177.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -58.73 148.41 83.06 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 117.469 -1.221 . . . . 0.0 111.902 175.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 25.6 m -61.41 -22.22 27.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 117.699 2.481 . . . . 0.0 117.699 -172.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -155.49 147.2 23.14 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 48.4 9.24 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 N-CA-C 120.027 3.343 . . . . 0.0 120.027 172.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.2 p-90 -63.46 -23.11 67.26 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 114.252 1.205 . . . . 0.0 114.252 -176.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -60.58 -31.35 70.49 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.927 -0.483 . . . . 0.0 112.006 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -58.47 -32.93 69.22 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.622 0.725 . . . . 0.0 109.873 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.6 mm -69.85 -39.37 77.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.91 -8.02 53.7 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.279 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -112.0 2.82 17.06 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 121.12 -0.232 . . . . 0.0 111.439 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.8 pttt -112.73 133.68 54.63 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.405 0.621 . . . . 0.0 111.426 -178.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 54.2 m -79.39 125.0 28.96 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 106.812 -1.551 . . . . 0.0 106.812 175.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -86.34 121.05 28.37 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 106.535 -1.654 . . . . 0.0 106.535 177.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -128.07 139.89 52.27 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 122.024 0.916 . . . . 0.0 113.448 -177.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -140.34 75.27 1.5 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 114.056 -1.429 . . . . 0.0 108.831 177.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.13 -110.8 3.6 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 119.575 -1.298 . . . . 0.0 112.331 177.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 62.3 p -73.82 10.53 1.11 Allowed 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.164 0.985 . . . . 0.0 112.941 -179.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 60.8 t -130.46 142.94 42.42 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 121.869 -0.52 . . . . 0.0 111.079 -177.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 29.0 t -142.22 131.52 23.54 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 173.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 41.8 t -134.02 138.83 49.62 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.111 0 CA-C-O 121.942 0.877 . . . . 0.0 110.27 -177.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -111.89 110.07 54.67 Favored Pre-proline 0 N--CA 1.435 -1.178 0 CA-C-N 113.6 -1.637 . . . . 0.0 109.485 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.19 157.68 20.08 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 115.878 -2.281 . . . . 0.0 113.345 178.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.1 156.76 37.85 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 104.926 -2.25 . . . . 0.0 104.926 176.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.2 tt -146.88 132.88 12.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.47 0.653 . . . . 0.0 111.517 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 97.9 t -110.1 119.95 60.15 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 104.418 -2.438 . . . . 0.0 104.418 175.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.6 136.36 53.12 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -179.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.09 -35.95 42.62 Favored Glycine 0 C--O 1.221 -0.669 0 N-CA-C 117.182 1.633 . . . . 0.0 117.182 -174.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -22.54 57.18 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 114.871 1.434 . . . . 0.0 114.871 -178.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -147.58 40.66 1.01 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 122.735 1.255 . . . . 0.0 108.631 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.2 tt -48.48 -54.17 15.24 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -172.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.0 ttt180 -57.32 -36.19 70.82 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 119.785 1.175 . . . . 0.0 113.931 -176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -73.06 -41.23 64.36 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.069 0.462 . . . . 0.0 110.425 -177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -66.04 -39.09 89.89 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 122.396 1.093 . . . . 0.0 109.362 178.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.424 HD11 HD11 ' A' ' 11' ' ' ILE . 1.1 tm? -62.77 -48.66 78.19 Favored 'General case' 0 N--CA 1.443 -0.805 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.316 -176.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -72.33 -16.07 61.88 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.432 -178.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.1 -36.2 55.85 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.407 177.421 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.9 t -91.05 -44.08 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 121.435 0.635 . . . . 0.0 110.443 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.8 m-85 -128.5 77.16 77.67 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.931 -178.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -66.69 -16.04 49.25 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 118.195 -0.736 . . . . 0.0 112.896 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.5 m -74.8 -10.52 59.59 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.028 0.751 . . . . 0.0 113.028 178.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -71.35 129.31 38.53 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.892 0.853 . . . . 0.0 110.868 -178.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -83.95 86.5 7.17 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.704 -177.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 21.6 p -67.24 -13.59 62.12 Favored 'General case' 0 C--O 1.216 -0.699 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.748 177.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -73.58 -29.43 62.41 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.404 0.621 . . . . 0.0 110.441 176.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -88.47 -29.17 20.36 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.054 0.931 . . . . 0.0 109.412 178.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 88.5 m -129.17 66.63 1.44 Allowed 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.224 -178.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 3.6 m -65.03 144.23 57.41 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -67.24 -24.0 65.76 Favored 'General case' 0 C--O 1.219 -0.521 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.837 179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -59.33 -22.38 61.19 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.666 0.746 . . . . 0.0 110.971 176.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 21.9 m170 -106.97 11.42 29.84 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.342 -177.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -77.87 117.89 19.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 15.2 m -144.02 153.11 41.88 Favored 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 178.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 34.2 p90 -66.23 -30.07 70.44 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.892 0.33 . . . . 0.0 111.892 -176.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -72.65 -44.95 61.22 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.617 0.723 . . . . 0.0 110.084 175.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -61.77 -24.3 66.75 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.99 -178.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.36 -30.86 69.82 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 176.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -68.28 -39.54 82.11 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.4 mtt -68.16 -28.92 67.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.71 -35.21 79.0 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.342 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -65.27 -49.54 69.19 Favored 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 178.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -60.38 -42.15 95.24 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.492 -177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -61.46 -40.72 95.54 Favored 'General case' 0 C--O 1.22 -0.48 0 N-CA-C 110.089 -0.337 . . . . 0.0 110.089 178.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -64.66 -43.46 93.55 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 70.4 mt -65.02 -37.94 89.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.164 0.507 . . . . 0.0 110.148 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 35.4 m -69.25 -34.67 75.14 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.409 0.623 . . . . 0.0 110.382 177.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.8 tt -66.28 -45.88 78.93 Favored 'General case' 0 C--O 1.216 -0.682 0 CA-C-N 116.015 -0.539 . . . . 0.0 112.353 -178.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.7 p -63.78 -34.04 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.068 0.849 . . . . 0.0 110.959 -177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -65.38 -46.97 78.01 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -66.33 -29.89 70.17 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.12 0.486 . . . . 0.0 111.431 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 39.2 tp60 -58.35 -28.37 65.04 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 121.185 -0.947 . . . . 0.0 109.463 177.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.26 -36.08 76.75 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.865 -0.522 . . . . 0.0 111.021 -179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . 0.412 ' HA ' ' HE2' ' A' ' 166' ' ' LYS . 16.9 pt-20 -76.78 -33.6 58.03 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.339 -0.986 . . . . 0.0 108.339 178.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -66.59 -31.49 72.23 Favored 'General case' 0 C--O 1.217 -0.612 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.389 176.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.403 ' HE ' ' CD ' ' A' ' 168' ' ' GLU . 0.0 OUTLIER -53.22 -28.72 28.53 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.911 0.708 . . . . 0.0 112.911 -177.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.412 ' HE2' ' HA ' ' A' ' 163' ' ' GLU . 15.1 mttm -67.27 -45.94 75.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.464 -179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 36.5 p -77.28 -28.42 53.4 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 122.24 -0.288 . . . . 0.0 111.762 175.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.403 ' CD ' ' HE ' ' A' ' 165' ' ' ARG . 35.0 tt0 -60.32 -24.2 64.82 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.911 0.885 . . . . 0.0 112.54 -178.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.93 -14.22 59.31 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 178.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -75.2 125.13 28.32 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.061 0.457 . . . . 0.0 110.087 179.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 48.8 t -68.94 123.72 23.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.2 167.79 26.7 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -138.36 152.65 48.63 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 38.1 t-20 -140.26 80.07 1.74 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.186 0.517 . . . . 0.0 111.103 -178.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 77.15 -168.73 54.77 Favored Glycine 0 CA--C 1.518 0.225 0 CA-C-N 115.945 -0.57 . . . . 0.0 112.513 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -153.62 174.26 14.7 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 106.675 -1.602 . . . . 0.0 106.675 177.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.8 tt -126.88 136.89 52.95 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 104.464 -2.421 . . . . 0.0 104.464 177.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -145.52 143.83 30.19 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.333 -0.988 . . . . 0.0 108.333 -179.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -142.98 134.79 26.75 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 177.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -117.31 148.91 41.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 107.358 -1.349 . . . . 0.0 107.358 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -154.43 134.79 13.33 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 111.601 0.223 . . . . 0.0 111.601 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -162.72 167.24 23.33 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 104.477 -2.416 . . . . 0.0 104.477 176.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 36.0 p90 -115.93 -33.54 5.06 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 67.57 150.8 0.07 Allowed 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.068 1.347 . . . . 0.0 113.81 -177.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 . . . . . 0 C--O 1.253 1.242 0 N-CA-C 104.473 -2.417 . . . . 0.0 104.473 179.828 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.5 mpt? . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -150.83 167.36 27.73 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -177.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 60.1 tp -55.73 -46.38 77.78 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 46.7 mt -59.62 -37.96 80.04 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.905 -178.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -62.52 -35.9 80.86 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.828 -0.623 . . . . 0.0 111.545 -175.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -62.52 -48.28 80.24 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.955 -0.758 . . . . 0.0 108.955 179.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 21.0 m -69.35 -37.33 77.6 Favored 'General case' 0 C--O 1.218 -0.557 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.412 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -57.17 -51.3 69.86 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.518 0.727 . . . . 0.0 110.296 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.7 m95 -69.29 -29.75 67.69 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 121.625 -0.672 . . . . 0.0 111.098 178.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 13.4 mmtt -68.48 -36.06 78.4 Favored 'General case' 0 N--CA 1.47 0.542 0 O-C-N 121.814 -0.554 . . . . 0.0 111.044 176.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.491 HD11 HD11 ' A' ' 125' ' ' LEU . 13.9 mm -72.34 -38.88 62.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 176.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.51 -43.86 84.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.78 -42.0 95.41 Favored 'General case' 0 C--O 1.216 -0.679 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.612 178.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 76.6 t60 -60.67 -45.6 93.52 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 122.708 0.403 . . . . 0.0 110.619 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 66.3 mt -66.11 -46.32 78.03 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.711 0.291 . . . . 0.0 110.562 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.57 -37.91 80.84 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.951 -179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -63.98 -31.87 73.21 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 121.997 -0.439 . . . . 0.0 110.479 177.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.2 t -79.17 9.42 4.53 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 122.883 0.473 . . . . 0.0 111.52 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 92.17 1.05 70.07 Favored Glycine 0 N--CA 1.453 -0.189 0 N-CA-C 116.295 1.278 . . . . 0.0 116.295 175.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.0 m-85 -64.74 126.08 26.79 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 118.278 1.039 . . . . 0.0 109.454 179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.93 132.11 11.58 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.011 -1.235 . . . . 0.0 110.011 -178.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.8 t -77.34 117.51 22.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.45 HD11 HD22 ' A' ' 43' ' ' LEU . 63.4 mt -87.02 -47.01 16.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -149.78 123.15 9.01 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.053 -0.976 . . . . 0.0 110.297 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.23 105.27 4.99 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 104.137 -2.542 . . . . 0.0 104.137 173.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -125.79 -79.54 0.35 Allowed Glycine 0 CA--C 1.504 -0.595 0 N-CA-C 109.831 -1.308 . . . . 0.0 109.831 -178.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -87.59 174.5 8.42 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.239 0.543 . . . . 0.0 110.641 178.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 1.7 m -83.65 12.03 6.42 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.685 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -95.14 -43.86 7.91 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -176.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -141.92 150.36 41.38 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -178.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 38.3 mt -138.19 127.65 33.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 175.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 63.0 m95 -103.6 130.0 50.95 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 178.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -124.51 138.13 54.36 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 123.626 0.77 . . . . 0.0 110.239 -178.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -92.37 134.72 34.66 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 176.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 112.12 15.42 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 122.133 0.173 . . . . 0.0 110.74 -178.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -75.81 -26.98 9.14 Favored 'Trans proline' 0 C--N 1.352 0.759 0 N-CA-C 114.932 1.089 . . . . 0.0 114.932 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -73.77 -5.02 38.22 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -178.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 24.3 mttt 57.62 42.19 24.38 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 -176.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.1 p -70.0 -177.68 1.4 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 113.338 -1.755 . . . . 0.0 112.367 -176.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 38.1 m -56.18 -30.36 62.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.091 176.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.429 ' HA ' ' HB2' ' A' ' 81' ' ' LYS . 84.3 m-70 -92.78 134.54 34.95 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -78.53 -45.45 21.88 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 179.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.45 HD22 HD11 ' A' ' 23' ' ' ILE . 84.6 mt -141.84 164.74 29.37 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.548 -174.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 85.6 t -133.59 138.88 50.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.457 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -121.91 128.15 51.23 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 173.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -98.17 131.97 44.09 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 104.203 -2.517 . . . . 0.0 104.203 174.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -136.19 141.31 44.02 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 118.134 0.425 . . . . 0.0 110.204 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -125.8 95.59 4.48 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.557 0.577 . . . . 0.0 112.557 -176.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -151.67 146.26 25.66 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.727 0.298 . . . . 0.0 111.129 178.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -86.7 151.57 23.29 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 18.3 mt -138.73 129.12 25.86 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 122.251 0.22 . . . . 0.0 110.645 -175.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -91.51 -37.3 13.22 Favored 'General case' 0 C--O 1.239 0.549 0 CA-C-O 120.974 0.416 . . . . 0.0 110.302 179.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -129.56 147.79 51.4 Favored 'General case' 0 N--CA 1.468 0.461 0 N-CA-C 112.763 0.653 . . . . 0.0 112.763 -177.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.422 ' HD2' HD11 ' A' ' 99' ' ' ILE . 24.2 ptt-85 -65.38 -22.16 66.76 Favored 'General case' 0 CA--C 1.507 -0.708 0 O-C-N 121.645 -0.659 . . . . 0.0 111.945 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -62.09 -31.04 71.43 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -74.01 -39.35 63.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 178.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.7 ttm -62.51 -50.48 71.24 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.717 -0.393 . . . . 0.0 110.489 179.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 17.9 m -60.36 -31.97 49.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 120.482 -0.487 . . . . 0.0 111.39 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.7 mmp_? -69.16 -34.0 74.28 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.664 -178.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -63.99 -40.7 96.98 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.403 0.62 . . . . 0.0 109.669 177.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.431 HG23 HG11 ' A' ' 111' ' ' VAL . 3.1 mt -70.88 -33.3 51.68 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.777 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 90.8 mt-10 -62.61 -32.75 73.82 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 176.21 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -67.91 -49.88 59.35 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 178.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -55.42 -39.25 70.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.231 -179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.97 -37.28 81.88 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -68.06 -42.22 80.82 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.602 0.715 . . . . 0.0 109.186 178.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -62.43 -42.49 99.49 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-O 121.407 0.622 . . . . 0.0 109.738 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 71.9 t -68.73 -42.96 83.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.707 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.953 -178.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.2 pt-20 -66.99 -33.47 75.64 Favored 'General case' 0 N--CA 1.468 0.466 0 O-C-N 121.191 -0.943 . . . . 0.0 110.101 -179.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -41.78 86.81 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 176.366 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 95.3 t -73.02 -38.76 56.41 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.088 -0.338 . . . . 0.0 110.088 177.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -61.49 -35.33 77.37 Favored 'General case' 0 CA--C 1.511 -0.521 0 O-C-N 121.288 -0.882 . . . . 0.0 111.595 179.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 63.6 t-80 -58.33 -39.94 80.79 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.176 0.512 . . . . 0.0 109.87 177.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -73.41 -20.67 60.67 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.0 mp -106.01 -15.73 14.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 114.809 1.411 . . . . 0.0 114.809 -174.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.09 4.43 42.46 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 115.778 1.071 . . . . 0.0 115.778 178.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -76.89 135.63 38.83 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 121.632 -0.922 . . . . 0.0 109.338 -178.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -66.84 -20.66 65.97 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 -175.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.424 HH21 ' CD ' ' A' ' 105' ' ' GLU . 40.6 ttt180 -152.06 154.08 35.24 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.576 -1.638 . . . . 0.0 106.576 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -129.6 151.39 50.25 Favored 'General case' 0 CA--C 1.504 -0.827 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 177.038 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.429 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 85.7 mttt -126.11 117.46 23.21 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 170.309 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -116.81 126.75 53.53 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.3 tp -90.69 123.92 34.68 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 176.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -119.26 109.64 16.07 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 -179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.6 t -106.83 112.84 41.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 112.462 0.541 . . . . 0.0 112.462 -176.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -83.16 133.03 35.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 122.87 0.468 . . . . 0.0 110.066 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -108.38 110.12 21.6 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.927 -2.249 . . . . 0.0 104.927 171.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 95.0 p -130.89 152.75 49.88 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -175.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 24.1 m -67.22 -46.51 73.6 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-O 121.864 0.84 . . . . 0.0 109.226 -179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -147.24 161.11 41.6 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 102.855 -3.017 . . . . 0.0 102.855 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.96 158.65 34.63 Favored Pre-proline 0 C--N 1.312 -1.058 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.797 -175.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -54.02 150.84 29.54 Favored 'Trans proline' 0 C--N 1.349 0.563 0 N-CA-C 116.254 1.598 . . . . 0.0 116.254 -179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.5 m -76.5 -11.96 14.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 115.013 1.486 . . . . 0.0 115.013 -177.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.88 101.66 8.03 Favored 'General case' 0 C--O 1.215 -0.743 0 N-CA-C 115.453 1.649 . . . . 0.0 115.453 -174.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 40.14 27.55 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 119.442 3.127 . . . . 0.0 119.442 172.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.4 p-90 -59.72 -20.97 59.86 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.47 -0.769 . . . . 0.0 112.88 -179.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -60.08 -31.29 69.88 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.78 0.659 . . . . 0.0 112.78 -175.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 71.2 mt-10 -66.15 -34.63 78.48 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.422 HD11 ' HD2' ' A' ' 54' ' ' ARG . 11.7 mm -65.37 -43.89 94.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.502 -174.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -74.33 -1.27 20.08 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -111.98 -2.82 14.99 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 176.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.0 tttp -103.31 115.23 30.16 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.91 -175.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 57.1 m -68.24 126.59 30.03 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 172.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -88.32 128.05 35.49 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 175.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.424 ' CD ' HH21 ' A' ' 79' ' ' ARG . 8.0 mt-10 -126.91 140.65 52.18 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.453 0.644 . . . . 0.0 111.433 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -140.87 75.49 1.51 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.179 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 69.89 -111.97 4.14 Favored Glycine 0 C--O 1.224 -0.483 0 C-N-CA 119.897 -1.144 . . . . 0.0 111.609 179.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 41.1 p -80.23 13.21 2.45 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.288 0.477 . . . . 0.0 112.288 -179.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 57.5 t -123.83 137.97 55.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 112.486 0.55 . . . . 0.0 112.486 -176.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 3.0 m -133.58 133.6 42.28 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 104.668 -2.345 . . . . 0.0 104.668 169.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.431 HG11 HG23 ' A' ' 61' ' ' ILE . 84.2 t -123.59 138.58 52.93 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.875 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -102.46 99.64 13.62 Favored Pre-proline 0 C--N 1.317 -0.824 0 N-CA-C 107.338 -1.356 . . . . 0.0 107.338 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -82.84 120.01 2.99 Favored 'Trans proline' 0 C--N 1.349 0.597 0 CA-C-O 121.395 0.498 . . . . 0.0 113.035 179.361 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -127.22 145.4 50.78 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.128 -1.804 . . . . 0.0 106.128 -179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.5 tt -138.72 139.16 41.45 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 -176.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.3 m -116.83 133.71 62.68 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 CA-C-O 122.109 0.957 . . . . 0.0 108.484 174.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.46 152.64 27.27 Favored 'General case' 0 C--O 1.207 -1.152 0 CA-C-N 114.363 -1.289 . . . . 0.0 108.456 177.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.4 -41.21 8.55 Favored Glycine 0 C--N 1.317 -0.509 0 N-CA-C 108.424 -1.87 . . . . 0.0 108.424 172.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 1.8 t -61.74 -26.19 67.91 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -178.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 27.0 ptm -131.41 32.87 4.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 122.201 1.001 . . . . 0.0 110.573 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 28.1 tp -51.3 -41.49 60.53 Favored 'General case' 0 C--O 1.211 -0.959 0 N-CA-C 116.503 2.038 . . . . 0.0 116.503 -174.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -58.56 -43.36 89.32 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 119.924 -0.71 . . . . 0.0 111.744 -176.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -78.37 -40.14 37.19 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.618 0.723 . . . . 0.0 111.936 -179.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -67.49 -39.06 85.21 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.5 0.667 . . . . 0.0 112.508 -178.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.491 HD11 HD11 ' A' ' 11' ' ' ILE . 3.0 tm? -63.47 -43.32 97.66 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.061 -0.399 . . . . 0.0 111.268 -177.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.0 pt20 -72.58 -14.7 61.68 Favored 'General case' 0 C--N 1.327 -0.396 0 C-N-CA 120.711 -0.396 . . . . 0.0 111.678 -177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.2 -32.09 62.91 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 177.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.3 t -92.08 -43.65 13.99 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-O 121.245 0.545 . . . . 0.0 110.264 179.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -124.66 78.05 63.73 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.187 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.11 -11.17 31.03 Favored 'Trans proline' 0 C--N 1.346 0.446 0 N-CA-C 114.197 0.807 . . . . 0.0 114.197 -179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 19.3 t -78.0 -14.85 59.37 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.278 0.561 . . . . 0.0 110.426 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -80.88 124.93 29.51 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.314 0.578 . . . . 0.0 110.254 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 38.3 mtp-105 -78.31 130.41 36.16 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 -179.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 26.2 p -66.5 -20.14 65.96 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.019 0.438 . . . . 0.0 111.607 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -58.76 -30.26 67.4 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 123.408 0.683 . . . . 0.0 111.203 178.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -66.79 -16.96 64.62 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -178.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 96.7 m -128.0 70.49 1.35 Allowed 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 112.408 0.521 . . . . 0.0 112.408 -178.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 70.2 m -75.15 144.44 42.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -64.1 -31.62 72.88 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.124 0.488 . . . . 0.0 111.635 -178.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -62.45 -28.46 69.83 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.687 0.756 . . . . 0.0 111.103 178.431 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -86.01 -11.69 52.25 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.936 -179.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -76.28 91.56 3.23 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.643 0.735 . . . . 0.0 112.334 -176.019 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.8 t -131.2 152.08 50.84 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 42.7 p90 -58.5 -38.96 78.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.007 0.432 . . . . 0.0 111.155 -177.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.417 ' H ' ' HG2' ' A' ' 145' ' ' GLU . 3.8 pt-20 -72.58 -41.06 66.09 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 122.312 -0.243 . . . . 0.0 110.981 179.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 52.7 m-20 -62.59 -30.83 71.62 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.791 0.329 . . . . 0.0 110.667 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.19 90.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.81 0.338 . . . . 0.0 110.608 177.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -70.37 -43.46 70.08 Favored 'General case' 0 C--O 1.222 -0.394 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 74.4 mtp -61.35 -27.61 68.63 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.265 -179.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.76 -32.86 70.97 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.859 -0.526 . . . . 0.0 110.683 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -64.41 -45.95 85.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 177.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.8 mt-10 -60.08 -42.54 94.82 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.42 0.628 . . . . 0.0 110.184 -178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 70.5 mmt-85 -66.5 -40.16 89.1 Favored 'General case' 0 C--O 1.215 -0.721 0 CA-C-N 116.163 -0.471 . . . . 0.0 109.814 -179.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -62.68 -42.52 99.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.229 0.468 . . . . 0.0 111.262 176.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.34 -39.42 94.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.877 0.37 . . . . 0.0 110.164 179.392 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 84.8 p -71.58 -27.84 63.42 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.744 -0.598 . . . . 0.0 110.804 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.1 tt -72.33 -43.29 64.33 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 119.286 -0.388 . . . . 0.0 111.838 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 8.8 p -63.62 -36.19 75.53 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 118.935 0.789 . . . . 0.0 108.883 179.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -66.18 -40.91 90.83 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 177.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.0 ttmm -66.98 -36.5 82.32 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.698 -0.627 . . . . 0.0 111.487 178.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.14 -28.64 69.9 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 179.513 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.85 -35.66 80.68 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 24.7 tp10 -76.87 -42.99 37.8 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 121.794 -0.566 . . . . 0.0 110.431 176.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -60.73 -40.39 92.17 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 113.024 0.749 . . . . 0.0 113.024 -178.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.465 ' HA ' ' HB2' ' A' ' 168' ' ' GLU . 8.6 ptm180 -62.98 -17.81 62.53 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -176.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 87.1 mttt -68.6 -43.53 76.25 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 38.9 p -76.01 -33.6 59.69 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.84 0.352 . . . . 0.0 110.618 177.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.465 ' HB2' ' HA ' ' A' ' 165' ' ' ARG . 0.7 OUTLIER -61.92 -24.08 66.74 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 179.376 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.34 -14.06 35.64 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -66.62 150.8 48.51 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.622 0.725 . . . . 0.0 109.704 178.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 23.1 t -87.4 88.97 2.96 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 O-C-N 121.683 -0.636 . . . . 0.0 110.724 -178.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 51.0 p90 -129.73 -25.21 2.62 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 112.982 0.734 . . . . 0.0 112.982 177.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 41.9 tt0 64.3 -56.09 0.25 Allowed 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 117.077 2.251 . . . . 0.0 117.077 178.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 50.2 t30 56.88 36.45 27.76 Favored 'General case' 0 N--CA 1.475 0.825 0 N-CA-C 113.496 0.925 . . . . 0.0 113.496 -177.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 89.54 -172.69 39.55 Favored Glycine 0 C--O 1.221 -0.698 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.096 179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -152.57 142.71 22.35 Favored 'General case' 0 C--N 1.327 -0.376 0 O-C-N 122.056 -0.673 . . . . 0.0 110.697 -178.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 65.6 tp -104.04 129.52 51.67 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 103.596 -2.742 . . . . 0.0 103.596 172.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -147.39 146.44 29.62 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.046 0.384 . . . . 0.0 111.092 -176.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.32 133.38 24.28 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 177.334 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -122.68 167.91 12.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 178.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 60.61 119.86 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 117.786 2.513 . . . . 0.0 117.786 176.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 63.2 tp -135.72 144.17 45.74 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 103.971 -2.604 . . . . 0.0 103.971 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 35.8 p90 -83.57 156.94 22.51 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 -178.298 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 95.3 m-85 -145.26 64.42 1.27 Allowed 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 178.418 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 . . . . . 0 C--O 1.241 0.632 0 N-CA-C 104.652 -2.351 . . . . 0.0 104.652 -176.249 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.4 ttt . . . . . 0 N--CA 1.496 1.847 0 N-CA-C 110.229 -0.286 . . . . 0.0 110.229 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -64.07 -27.74 69.31 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 114.298 1.222 . . . . 0.0 114.298 -175.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.89 -31.03 68.22 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.129 0.49 . . . . 0.0 111.041 178.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 81.7 mt -64.62 -46.94 80.47 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 120.306 -0.557 . . . . 0.0 110.55 178.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.483 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 8.2 pt-20 -73.81 -29.14 61.99 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 119.298 -0.961 . . . . 0.0 110.698 -178.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -56.93 -45.46 82.72 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.211 -1.404 . . . . 0.0 107.211 175.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 29.9 m -71.66 -44.52 64.15 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.292 0.568 . . . . 0.0 111.519 178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.483 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 73.0 t80 -55.51 -51.25 67.65 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 123.873 0.869 . . . . 0.0 113.15 -178.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -68.64 -31.28 70.31 Favored 'General case' 0 C--N 1.327 -0.404 0 O-C-N 121.98 -0.45 . . . . 0.0 110.341 -179.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.7 mttt -70.84 -35.14 72.32 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.902 -0.499 . . . . 0.0 111.259 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 13.5 mm -69.06 -40.75 81.15 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 176.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.92 -42.7 90.29 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.7 -47.17 84.78 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.002 177.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -57.06 -47.28 81.35 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.988 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.2 mt -68.69 -46.18 69.72 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 111.544 0.202 . . . . 0.0 111.544 -179.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.11 -44.49 74.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-O 121.319 0.58 . . . . 0.0 110.153 175.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.5 t30 -72.44 -7.62 50.78 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.1 m -97.97 9.05 43.73 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 176.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 104.49 -6.17 45.16 Favored Glycine 0 CA--C 1.517 0.202 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 175.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -66.6 133.74 50.91 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 118.091 0.945 . . . . 0.0 109.598 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -87.5 115.65 4.36 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 107.47 -2.252 . . . . 0.0 107.47 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 12.5 p -71.08 130.13 34.97 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 179.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 98.9 mt -94.34 -42.94 13.05 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 -178.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -147.57 138.48 23.47 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 106.621 -1.622 . . . . 0.0 106.621 178.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -123.2 105.1 9.6 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -178.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.92 53.64 5.22 Favored Glycine 0 N--CA 1.448 -0.528 0 C-N-CA 120.542 -0.837 . . . . 0.0 113.385 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -58.16 -36.76 73.48 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 176.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.6 m -166.67 -73.24 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 103.72 -2.696 . . . . 0.0 103.72 173.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -127.33 16.7 7.13 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.84 -1.073 . . . . 0.0 108.536 179.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -125.64 139.31 53.67 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.857 -1.065 . . . . 0.0 112.919 -172.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 80.8 mt -135.03 133.81 53.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 107.297 -1.371 . . . . 0.0 107.297 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -112.14 135.61 52.59 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -131.14 129.95 42.45 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 18.5 tt0 -83.92 132.73 34.75 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.26 118.85 71.02 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 178.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -76.81 -23.99 10.44 Favored 'Trans proline' 0 C--N 1.348 0.55 0 C-N-CA 117.408 -1.261 . . . . 0.0 115.089 -175.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -75.49 -17.95 59.97 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 112.93 0.715 . . . . 0.0 112.93 -177.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 65.9 mmtt 61.03 37.77 17.74 Favored 'General case' 0 N--CA 1.476 0.862 0 CA-C-O 122.484 1.135 . . . . 0.0 110.266 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.61 -173.34 0.07 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 112.754 -2.021 . . . . 0.0 110.653 174.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 4.8 p -49.88 -42.61 48.21 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 173.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 89.1 m-70 -78.8 138.25 38.11 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-O 121.068 0.461 . . . . 0.0 111.168 174.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -101.71 -37.2 8.43 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.058 176.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 86.4 mt -139.78 163.79 31.67 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 112.57 0.581 . . . . 0.0 112.57 -172.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.8 t -131.52 134.95 60.06 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 174.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -119.57 113.72 21.15 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 84.9 mt -95.61 125.0 39.9 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -136.35 130.47 32.9 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 117.624 0.193 . . . . 0.0 110.598 -177.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -107.95 114.18 27.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.072 0.463 . . . . 0.0 109.959 -179.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 5.2 t60 -151.64 142.71 23.15 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.105 -176.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -93.05 98.72 11.51 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 38.7 mt -87.06 103.31 15.25 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.884 -1.053 . . . . 0.0 110.946 -176.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.7 t0 -68.49 -42.6 78.42 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.784 0.802 . . . . 0.0 111.958 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -121.71 156.4 33.17 Favored 'General case' 0 CA--C 1.512 -0.517 0 O-C-N 121.859 -0.525 . . . . 0.0 111.478 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt180 -66.73 -16.06 63.98 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.147 176.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.4 mt-30 -63.74 -40.16 96.06 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 107.629 -1.249 . . . . 0.0 107.629 177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -69.96 -36.73 75.48 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 55.7 ttm -61.33 -50.24 73.74 Favored 'General case' 0 C--O 1.218 -0.602 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.86 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.7 m -70.09 -31.95 49.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.243 -178.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 -66.9 -34.65 78.25 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 121.124 -0.23 . . . . 0.0 111.206 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -64.56 -33.97 77.16 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 177.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mm -71.84 -30.89 39.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 O-C-N 121.634 -0.666 . . . . 0.0 110.956 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -64.23 -40.34 95.85 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -64.38 -44.25 91.95 Favored 'General case' 0 C--O 1.244 0.803 0 CA-C-O 121.935 0.874 . . . . 0.0 109.21 178.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -62.68 -39.67 94.69 Favored 'General case' 0 C--O 1.206 -1.222 0 CA-C-N 115.284 -0.871 . . . . 0.0 112.233 178.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.49 -40.44 82.78 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 118.998 0.817 . . . . 0.0 111.518 -177.124 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 68.4 mm-40 -66.8 -41.47 87.52 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.565 0.697 . . . . 0.0 109.832 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.78 -47.29 84.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.522 0.677 . . . . 0.0 110.141 178.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.86 -42.64 97.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.258 -175.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -67.42 -31.7 72.07 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 119.97 1.259 . . . . 0.0 111.401 179.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -64.72 -44.1 91.31 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.2 t -68.99 -36.03 71.95 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.185 178.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.4 ttp-105 -59.24 -35.2 73.24 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.801 -0.562 . . . . 0.0 110.687 178.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.2 t-160 -62.11 -39.04 91.16 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.889 -0.411 . . . . 0.0 109.889 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 -73.4 -39.86 64.75 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.378 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.7 mp -73.28 -17.96 61.26 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 73.17 -2.98 32.82 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 116.163 1.225 . . . . 0.0 116.163 177.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.3 mtt180 -71.39 152.6 43.0 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 118.384 1.092 . . . . 0.0 108.681 178.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -72.62 -27.19 61.99 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.795 -178.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 56.5 mtp180 -142.03 159.43 42.24 Favored 'General case' 0 CA--C 1.511 -0.521 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -122.19 141.78 51.11 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 53.5 tttp -123.35 127.95 49.21 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 54.4 tp -129.3 123.71 32.54 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 -174.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.3 tp -86.46 109.43 19.06 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 174.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -98.84 127.54 44.79 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 108.944 -0.762 . . . . 0.0 108.944 178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 22.7 t -124.21 113.5 36.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 CA-C-O 121.169 0.509 . . . . 0.0 111.469 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -84.18 142.81 30.05 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.78 177.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 27.3 m-85 -119.55 109.82 16.16 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 173.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.0 p -125.59 161.09 27.99 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 112.195 0.442 . . . . 0.0 112.195 -173.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.3 m -67.17 -49.28 65.29 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 177.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -148.72 156.88 42.97 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 101.798 -3.408 . . . . 0.0 101.798 179.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.29 159.19 86.05 Favored Pre-proline 0 C--N 1.313 -0.989 0 O-C-N 124.268 0.98 . . . . 0.0 109.294 -179.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -56.16 154.12 29.82 Favored 'Trans proline' 0 C--N 1.353 0.765 0 N-CA-C 115.081 1.147 . . . . 0.0 115.081 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 29.1 m -63.26 -24.48 36.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 118.089 2.626 . . . . 0.0 118.089 -174.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -155.44 145.03 21.2 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 -177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.5 t0 45.88 19.48 0.06 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 117.896 2.554 . . . . 0.0 117.896 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 29.9 p-90 -76.08 -23.54 55.01 Favored 'General case' 0 C--O 1.216 -0.685 0 O-C-N 120.864 -1.147 . . . . 0.0 111.967 -178.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -58.65 -37.7 76.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -172.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.81 -18.4 64.84 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.829 0.347 . . . . 0.0 111.832 179.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 13.7 mm -72.93 -40.17 59.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.88 0.61 17.6 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.153 0.501 . . . . 0.0 111.566 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -111.85 3.13 17.41 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.426 179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -122.17 155.87 34.89 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 121.293 0.568 . . . . 0.0 111.396 -178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 24.7 m -102.0 126.04 48.82 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 177.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -83.46 112.56 20.07 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 105.795 -1.928 . . . . 0.0 105.795 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -118.29 123.14 44.65 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.518 0.675 . . . . 0.0 112.337 -176.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 24.0 tttt -124.24 75.49 1.39 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.161 -1.051 . . . . 0.0 108.161 178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.57 -112.32 4.89 Favored Glycine 0 C--O 1.226 -0.401 0 C-N-CA 119.912 -1.137 . . . . 0.0 111.504 178.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 50.9 p -72.85 11.92 0.6 Allowed 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 87.5 t -127.83 140.51 48.96 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.682 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 -178.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.2 p -138.05 125.39 21.8 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 105.77 -1.937 . . . . 0.0 105.77 169.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.9 t -128.85 133.4 66.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 178.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -113.45 116.74 45.94 Favored Pre-proline 0 C--N 1.32 -0.693 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -78.74 156.13 27.47 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 118.109 -0.794 . . . . 0.0 112.892 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -147.54 155.05 41.48 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 102.889 -3.004 . . . . 0.0 102.889 175.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 16.3 tt -145.98 138.58 20.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-O 121.262 0.553 . . . . 0.0 109.733 -177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 8.2 m -115.9 142.06 30.76 Favored 'Isoleucine or valine' 0 C--O 1.245 0.868 0 N-CA-C 103.48 -2.785 . . . . 0.0 103.48 172.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.95 150.72 40.05 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.593 -2.373 . . . . 0.0 104.593 179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.98 -22.68 64.99 Favored Glycine 0 C--N 1.32 -0.351 0 C-N-CA 120.547 -0.835 . . . . 0.0 112.339 -177.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 30.0 p -72.83 -30.05 63.72 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -176.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 5.3 mtm -129.25 20.84 5.75 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.378 0.609 . . . . 0.0 110.593 179.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.4 tt -42.18 -42.49 3.02 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 116.817 2.154 . . . . 0.0 116.817 -173.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 52.4 ptt85 -62.82 -40.53 97.68 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 121.632 -0.667 . . . . 0.0 111.934 -179.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -78.66 -40.11 35.0 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.705 0.764 . . . . 0.0 109.867 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -59.22 -42.72 91.68 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.484 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.3 mt -62.22 -43.5 98.68 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -178.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.5 pt20 -75.35 -14.14 60.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 119.593 -0.843 . . . . 0.0 110.965 -177.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.59 -39.74 62.03 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.417 HG13 ' CD1' ' A' ' 129' ' ' PHE . 5.7 p -95.8 -38.54 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . 0.417 ' CD1' HG13 ' A' ' 128' ' ' VAL . 49.1 m-85 -125.21 77.32 67.76 Favored Pre-proline 0 C--N 1.325 -0.491 0 C-N-CA 123.14 0.576 . . . . 0.0 110.393 179.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.49 -7.45 20.31 Favored 'Trans proline' 0 C--N 1.345 0.393 0 N-CA-C 114.211 0.812 . . . . 0.0 114.211 -178.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.4 m -92.67 1.68 57.13 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 112.452 0.538 . . . . 0.0 112.452 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -81.45 140.37 34.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.061 0.458 . . . . 0.0 110.237 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -84.06 94.81 8.4 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.882 -0.784 . . . . 0.0 108.882 179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.3 p -62.93 -21.25 65.92 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -61.75 -27.18 68.55 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.075 0.465 . . . . 0.0 111.282 177.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -68.66 -16.15 63.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.571 0.7 . . . . 0.0 110.222 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 72.4 m -113.87 25.77 10.91 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.003 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 59.7 m -62.74 155.99 25.01 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -59.62 -28.45 67.22 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 -177.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -66.22 -15.95 63.6 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 177.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -119.1 -1.84 10.85 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.996 0.427 . . . . 0.0 110.981 -177.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -86.09 34.85 0.62 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -173.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 43.3 t -65.06 144.06 57.51 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 177.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -66.75 -28.93 68.81 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.332 0.493 . . . . 0.0 112.332 -178.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -68.97 -26.39 65.02 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.711 0.767 . . . . 0.0 109.983 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -65.53 -19.67 66.02 Favored 'General case' 0 C--O 1.216 -0.672 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.164 -179.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -59.08 -39.19 81.4 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 122.057 -0.402 . . . . 0.0 110.188 177.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -66.43 -43.99 84.14 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 178.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 38.0 mmt -62.63 -36.7 83.64 Favored 'General case' 0 C--O 1.211 -0.965 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.412 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.25 -41.98 85.42 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 122.101 -0.374 . . . . 0.0 110.288 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -65.2 -50.41 66.0 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 120.791 0.329 . . . . 0.0 110.311 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -61.18 -41.86 97.54 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.378 0.608 . . . . 0.0 111.669 -177.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 8.9 mmt85 -67.49 -36.49 81.2 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-O 118.443 -0.789 . . . . 0.0 109.84 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -62.33 -44.67 95.96 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 119.253 0.933 . . . . 0.0 111.365 176.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -61.61 -38.51 87.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 19.5 m -69.98 -35.2 74.25 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.448 0.642 . . . . 0.0 111.428 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.92 -37.7 86.76 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 123.794 0.838 . . . . 0.0 110.514 -178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 49.2 t -57.45 -47.29 85.21 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.578 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.51 -38.41 80.9 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.487 0.66 . . . . 0.0 109.914 179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -63.27 -30.59 71.7 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 121.908 -0.495 . . . . 0.0 112.271 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.85 -26.66 66.01 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 117.983 0.356 . . . . 0.0 111.768 -177.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 72.7 mm-40 -61.81 -39.97 93.63 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.515 0.674 . . . . 0.0 110.221 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 37.6 tp10 -67.32 -35.32 79.18 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.181 -0.674 . . . . 0.0 109.181 177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 57.3 mm-40 -70.88 -31.49 68.17 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 -179.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 34.5 mmt180 -50.56 -40.16 51.31 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.543 1.312 . . . . 0.0 114.543 -175.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.8 pttt -63.09 -17.78 62.68 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -176.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 81.8 p -68.85 -16.54 63.8 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.501 0.556 . . . . 0.0 112.501 -179.122 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -62.13 -24.33 67.09 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.829 0.347 . . . . 0.0 111.082 178.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -59.25 -14.02 9.69 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 179.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -79.52 -1.34 37.21 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 177.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 1.8 t 50.93 57.17 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 N-CA-C 115.612 1.708 . . . . 0.0 115.612 173.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 32.1 p90 -144.81 151.23 38.48 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 121.61 -0.681 . . . . 0.0 110.217 176.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 10.9 pt20 -164.31 167.88 19.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -108.7 8.43 26.88 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.811 0.339 . . . . 0.0 111.019 -179.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 79.61 -169.28 53.35 Favored Glycine 0 N--CA 1.454 -0.142 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 -176.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 23.7 pttp -148.29 165.07 32.11 Favored 'General case' 0 CA--C 1.514 -0.415 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -128.26 160.12 33.12 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 104.708 -2.33 . . . . 0.0 104.708 178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -143.69 163.55 32.95 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 89.6 mtt180 -121.11 21.09 11.36 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -65.89 121.15 14.41 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 -179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 17.0 p-10 -138.47 98.64 3.63 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.305 0.574 . . . . 0.0 110.301 -178.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 61.97 -160.05 0.31 Allowed 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -176.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 41.2 p90 -158.39 160.17 36.6 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.664 -2.347 . . . . 0.0 104.664 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -143.82 152.04 40.69 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 179.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 . . . . . 0 C--O 1.249 1.044 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 -177.355 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 ptp . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 120.738 0.304 . . . . 0.0 110.749 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -136.74 158.06 45.32 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -66.41 -40.63 89.7 Favored 'General case' 0 C--O 1.215 -0.731 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 177.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -63.57 -33.22 75.11 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.359 0.599 . . . . 0.0 111.82 178.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -63.28 -30.07 71.28 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -62.06 -41.07 97.77 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 176.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.482 ' HA ' ' HE3' ' A' ' 10' ' ' LYS . 44.6 m -69.41 -44.11 72.06 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 122.461 -0.149 . . . . 0.0 110.973 176.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 3.1 t80 -52.35 -47.4 66.11 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 122.588 0.355 . . . . 0.0 110.557 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -67.8 -43.47 79.58 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 178.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.482 ' HE3' ' HA ' ' A' ' 7' ' ' THR . 19.9 pttp -73.51 -25.31 60.37 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 121.029 -1.044 . . . . 0.0 112.243 -178.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 15.0 mm -72.31 -38.6 61.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 N-CA-C 108.601 -0.888 . . . . 0.0 108.601 174.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.23 -40.91 78.51 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.5 -42.67 99.14 Favored 'General case' 0 C--O 1.214 -0.81 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.504 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.1 -34.18 75.92 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.745 -0.597 . . . . 0.0 112.45 -178.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -71.8 -44.46 63.93 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 27.9 t -53.64 -42.73 52.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.149 171.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -60.51 -31.07 70.14 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 121.72 -0.613 . . . . 0.0 110.66 178.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.3 m -82.56 9.31 9.62 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 -179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.17 1.26 62.9 Favored Glycine 0 CA--C 1.517 0.173 0 N-CA-C 115.827 1.091 . . . . 0.0 115.827 175.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.429 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 32.7 m-85 -71.04 126.6 30.02 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 117.773 0.787 . . . . 0.0 109.662 178.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -78.23 113.72 3.78 Favored Glycine 0 N--CA 1.448 -0.556 0 N-CA-C 107.338 -2.305 . . . . 0.0 107.338 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.9 p -70.31 128.67 33.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 75.8 mt -86.78 -38.84 12.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 -175.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 18.0 pt20 -144.16 134.64 24.68 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.034 -0.728 . . . . 0.0 109.034 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.29 140.91 35.79 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 106.579 -1.637 . . . . 0.0 106.579 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.38 -30.08 6.4 Favored Glycine 0 CA--C 1.506 -0.516 0 N-CA-C 107.75 -2.14 . . . . 0.0 107.75 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.476 ' HG3' ' H ' ' A' ' 30' ' ' GLU . 10.9 tp10 -68.3 136.27 53.21 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 105.406 -2.072 . . . . 0.0 105.406 174.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.6 m -98.5 -18.26 18.3 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 79.8 m-20 -87.37 -47.93 8.39 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 120.757 -0.377 . . . . 0.0 111.502 178.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.476 ' H ' ' HG3' ' A' ' 27' ' ' GLU . 15.5 pt-20 -135.11 137.18 42.56 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 115.3 1.593 . . . . 0.0 115.3 -178.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 23.4 mt -125.3 131.5 72.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.533 0 N-CA-C 106.689 -1.597 . . . . 0.0 106.689 176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 37.3 m95 -111.38 139.57 46.68 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -178.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mt -131.01 129.73 42.43 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 123.997 0.919 . . . . 0.0 108.742 -177.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -82.05 130.61 35.13 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.72 113.03 22.91 Favored Pre-proline 0 CA--C 1.549 0.904 0 CA-C-N 117.715 0.234 . . . . 0.0 110.486 -178.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 88.0 Cg_endo -74.7 -18.71 19.32 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 117.825 -0.983 . . . . 0.0 113.36 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -72.84 -23.34 60.74 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.851 -179.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 34.0 mttt 60.42 38.84 19.11 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 107.786 -1.19 . . . . 0.0 107.786 -178.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.2 p -71.7 -177.63 1.98 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 112.963 -1.926 . . . . 0.0 112.103 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.9 m -61.26 -10.01 6.09 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.037 -0.528 . . . . 0.0 112.345 175.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -110.68 132.32 54.29 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 105.588 -2.004 . . . . 0.0 105.588 170.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 32.4 m-20 -92.33 -40.56 10.85 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.491 0.552 . . . . 0.0 112.491 -174.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 92.2 mt -139.16 162.12 35.73 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 112.06 0.392 . . . . 0.0 112.06 -176.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.59 135.47 63.11 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 176.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 35.0 ttt-85 -124.66 116.31 22.18 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.519 0.728 . . . . 0.0 109.828 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -91.31 132.15 36.35 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 103.39 -2.818 . . . . 0.0 103.39 175.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -136.53 136.03 39.0 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 117.826 0.285 . . . . 0.0 110.901 -179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.7 tmtm? -105.53 113.55 27.19 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.787 -0.571 . . . . 0.0 110.543 179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -151.62 149.88 29.65 Favored 'General case' 0 C--O 1.218 -0.584 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -108.34 131.42 54.75 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 104.396 -2.446 . . . . 0.0 104.396 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 20.5 mt -124.1 120.62 32.9 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 -171.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 44.6 t0 -88.49 -37.81 15.48 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.887 0.851 . . . . 0.0 111.585 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -129.67 144.71 51.41 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.727 -179.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.7 ptt180 -64.33 -17.54 63.78 Favored 'General case' 0 C--O 1.215 -0.736 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -178.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -60.75 -33.33 72.77 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 120.237 -0.585 . . . . 0.0 109.518 178.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -77.65 -34.91 52.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.065 0.459 . . . . 0.0 110.209 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.0 ttt -60.81 -48.83 80.0 Favored 'General case' 0 C--O 1.22 -0.452 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.559 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.2 m -66.31 -31.84 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 CA-C-O 121.433 0.635 . . . . 0.0 110.086 178.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -38.21 87.15 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.198 -177.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -62.36 -38.99 91.68 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.3 mm -68.66 -31.81 52.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 O-C-N 121.949 -0.47 . . . . 0.0 111.441 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.8 mm-40 -61.66 -39.48 91.52 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 177.569 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.49 -44.32 58.17 Favored 'General case' 0 C--O 1.241 0.614 0 CA-C-O 121.689 0.757 . . . . 0.0 110.053 179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 59.9 mt-30 -59.53 -39.74 84.92 Favored 'General case' 0 C--O 1.21 -0.989 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.097 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.84 -39.86 90.65 Favored 'General case' 0 C--N 1.318 -0.802 0 C-N-CA 120.643 -0.423 . . . . 0.0 111.576 -177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 81.2 mt-10 -70.92 -35.95 72.46 Favored 'General case' 0 C--N 1.319 -0.719 0 C-N-CA 119.887 -0.725 . . . . 0.0 109.759 179.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -60.83 -44.77 96.49 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 174.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 53.2 t -66.9 -39.76 84.24 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.773 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.87 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -62.21 -33.53 74.74 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 119.654 1.116 . . . . 0.0 111.187 -179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 18.8 ttt-85 -60.5 -44.43 96.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 175.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.0 t -69.03 -37.41 77.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.935 0.398 . . . . 0.0 110.014 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.15 -41.35 88.13 Favored 'General case' 0 C--N 1.321 -0.646 0 O-C-N 121.855 -0.528 . . . . 0.0 111.052 178.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -66.79 -40.11 88.04 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -63.48 -40.19 96.43 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.022 0.439 . . . . 0.0 110.861 178.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.7 mp -78.02 -13.96 59.68 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.409 0.522 . . . . 0.0 112.409 -179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.65 1.47 38.06 Favored Glycine 0 CA--C 1.522 0.486 0 N-CA-C 115.489 0.955 . . . . 0.0 115.489 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -68.36 156.28 38.1 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 122.008 -0.701 . . . . 0.0 110.082 -177.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -39.35 93.85 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 110.109 -0.33 . . . . 0.0 110.109 -179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 62.8 mtp180 -149.41 167.99 24.65 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 103.453 -2.795 . . . . 0.0 103.453 177.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 ttp -129.18 147.97 51.08 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 118.746 0.703 . . . . 0.0 109.979 177.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -116.33 123.7 48.27 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 123.521 0.513 . . . . 0.0 110.559 177.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 40.4 tp -116.87 128.12 54.94 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 123.253 0.346 . . . . 0.0 111.405 178.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.5 tp -91.32 110.83 22.13 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -102.54 129.12 48.99 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.166 -1.049 . . . . 0.0 108.166 179.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 32.6 t -121.05 109.38 25.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 177.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -76.84 142.95 40.03 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 175.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 92.3 m-85 -119.35 107.62 13.59 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 105.894 -1.891 . . . . 0.0 105.894 172.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 97.7 p -126.74 155.65 42.41 Favored 'General case' 0 C--O 1.217 -0.606 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.33 -171.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 18.2 m -67.09 -47.91 69.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.079 -1.082 . . . . 0.0 108.079 177.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -147.0 158.19 43.85 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 103.813 -2.662 . . . . 0.0 103.813 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.92 157.14 39.83 Favored Pre-proline 0 C--N 1.312 -1.025 0 CA-C-N 114.737 -1.119 . . . . 0.0 109.087 -177.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -55.08 143.73 72.53 Favored 'Trans proline' 0 C--N 1.347 0.46 0 N-CA-C 116.374 1.644 . . . . 0.0 116.374 -179.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.8 m -76.47 -21.72 15.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 CA-C-N 115.473 -0.785 . . . . 0.0 110.638 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -90.81 91.98 8.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.107 -0.497 . . . . 0.0 109.872 178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 25.9 t0 14.88 70.98 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 117.773 2.509 . . . . 0.0 117.773 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -74.01 -16.85 61.04 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.608 177.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 25.1 mt-10 -63.75 -35.22 79.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 122.224 -0.298 . . . . 0.0 110.553 -175.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -60.81 -23.54 65.14 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.825 175.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.1 mm -79.04 -44.46 24.45 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.854 -0.425 . . . . 0.0 109.854 -176.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.04 -1.58 23.45 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.256 0.55 . . . . 0.0 111.917 -179.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 86.9 mttt -108.59 5.35 24.94 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.503 179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -124.72 132.27 53.39 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 121.153 0.502 . . . . 0.0 110.872 178.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 68.0 m -77.68 125.2 28.98 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 104.079 -2.563 . . . . 0.0 104.079 173.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -82.71 120.6 25.79 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.364 -1.717 . . . . 0.0 106.364 177.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 13.0 mt-10 -126.23 127.64 45.97 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.793 0.806 . . . . 0.0 110.008 179.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -139.3 114.71 9.79 Favored 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 60.21 -126.45 41.49 Favored Glycine 0 CA--C 1.519 0.322 0 C-N-CA 119.968 -1.11 . . . . 0.0 111.439 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 37.0 p -96.3 29.05 2.98 Favored 'General case' 0 C--N 1.322 -0.629 0 O-C-N 122.11 -0.641 . . . . 0.0 111.065 -179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 48.5 t -124.61 145.52 31.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.852 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 14.9 m -132.6 134.95 45.54 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 106.138 -1.801 . . . . 0.0 106.138 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.2 t -134.66 138.95 48.62 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.786 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -179.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -102.88 109.06 60.48 Favored Pre-proline 0 CA--C 1.547 0.865 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 178.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -87.94 63.95 3.55 Favored 'Trans proline' 0 CA--C 1.55 1.315 0 C-N-CA 123.151 2.567 . . . . 0.0 117.171 -175.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.96 156.68 38.98 Favored 'General case' 0 CA--C 1.543 0.69 0 O-C-N 121.819 -0.551 . . . . 0.0 110.589 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -147.91 142.36 19.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 O-C-N 121.887 -0.508 . . . . 0.0 110.116 -178.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 90.4 t -117.69 120.84 65.93 Favored 'Isoleucine or valine' 0 C--O 1.241 0.65 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 174.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.29 136.22 40.52 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 121.303 0.573 . . . . 0.0 109.857 177.016 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.45 -34.93 91.23 Favored Glycine 0 CA--C 1.51 -0.232 0 N-CA-C 114.868 0.707 . . . . 0.0 114.868 -176.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 15.2 t -53.16 -26.8 18.31 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 113.75 1.018 . . . . 0.0 113.75 -178.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.9 ptm -140.56 32.85 1.85 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-O 121.634 0.73 . . . . 0.0 109.808 177.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.6 tt -46.64 -36.55 7.13 Favored 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -174.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 mtm180 -58.36 -46.99 85.23 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 121.496 -0.752 . . . . 0.0 111.175 -177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -78.65 -38.66 38.97 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.103 0.954 . . . . 0.0 111.922 178.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -70.63 -35.43 72.93 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 114.134 1.161 . . . . 0.0 114.134 -175.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -70.37 -41.05 73.61 Favored 'General case' 0 C--N 1.323 -0.553 0 O-C-N 121.887 -0.508 . . . . 0.0 110.684 -177.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -69.3 -16.14 63.5 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.629 -177.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.02 -30.82 65.58 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.067 0.461 . . . . 0.0 109.836 177.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 26.8 t -97.57 -43.84 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-O 121.457 0.646 . . . . 0.0 110.643 179.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -129.47 78.14 76.15 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 116.053 -0.521 . . . . 0.0 112.113 -178.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.05 -12.67 34.81 Favored 'Trans proline' 0 C--N 1.349 0.583 0 CA-C-O 121.381 0.492 . . . . 0.0 112.998 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.0 p -76.9 -11.59 59.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.5 t80 -94.92 124.93 39.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.215 0.531 . . . . 0.0 111.164 -178.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.3 mtp-105 -86.39 117.96 25.52 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.431 -0.951 . . . . 0.0 108.431 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 24.2 p -66.97 -24.12 66.02 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 122.161 -0.337 . . . . 0.0 110.985 179.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 71.2 tt0 -65.04 -31.63 72.94 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 178.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -59.69 -35.17 73.94 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 121.283 0.563 . . . . 0.0 109.987 -177.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -169.97 116.44 0.55 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 175.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 42.4 t -115.05 158.52 22.0 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 179.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 87.2 mt-10 -68.23 -19.72 64.76 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.302 0.572 . . . . 0.0 109.744 177.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -66.11 -12.13 53.55 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.242 177.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 39.7 t60 -119.22 24.42 10.75 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -133.52 175.93 8.99 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 122.065 0.936 . . . . 0.0 112.264 -176.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.3 t -144.75 173.28 11.98 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 102.259 -3.237 . . . . 0.0 102.259 176.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 4.8 p90 -62.38 -28.81 70.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 118.016 0.371 . . . . 0.0 111.566 -178.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 -68.41 -31.21 70.38 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-O 121.435 0.636 . . . . 0.0 111.89 177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -63.01 -24.53 67.96 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.935 -177.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.21 89.74 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.625 0.25 . . . . 0.0 110.567 178.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 37.3 tt0 -66.38 -35.53 80.56 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.499 0.666 . . . . 0.0 109.348 178.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 77.0 mtp -71.04 -30.8 67.08 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 121.787 -0.571 . . . . 0.0 109.998 177.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -70.95 -30.41 66.7 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 178.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 61.0 ttt180 -61.19 -52.22 65.73 Favored 'General case' 0 CA--C 1.506 -0.741 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 174.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -63.4 -37.2 86.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.536 0.684 . . . . 0.0 110.449 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 56.3 ttt85 -60.01 -46.87 88.06 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.036 176.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -65.88 -41.86 91.07 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -61.97 -36.88 82.79 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 29.3 m -76.12 -32.94 59.42 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.56 0.695 . . . . 0.0 112.21 176.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -62.31 -42.78 99.65 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -176.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.5 p -57.73 -39.18 69.14 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.579 0 C-N-CA 120.155 -0.618 . . . . 0.0 110.829 -176.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -74.02 -42.6 60.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.302 0.572 . . . . 0.0 110.027 176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -59.96 -32.1 70.49 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -178.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 11.4 mm100 -56.61 -28.2 59.87 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 179.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -57.32 -39.39 75.73 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.026 0.441 . . . . 0.0 110.497 -179.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 19.2 tp10 -76.85 -36.26 56.94 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.179 0.514 . . . . 0.0 110.924 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -66.04 -49.8 66.4 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.979 0.419 . . . . 0.0 111.224 -177.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.33 -17.72 63.74 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.492 -0.483 . . . . 0.0 111.144 -179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -69.17 -46.81 66.59 Favored 'General case' 0 C--O 1.221 -0.408 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 23.6 p -72.55 -33.06 66.56 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.966 -0.293 . . . . 0.0 111.539 178.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.8 tt0 -67.27 -24.32 65.77 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.042 0.448 . . . . 0.0 111.752 179.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.92 -14.14 51.16 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -60.48 149.39 34.48 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 24.6 t -78.58 96.24 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 121.43 0.633 . . . . 0.0 112.059 -176.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -151.03 165.23 34.41 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 105.034 -2.21 . . . . 0.0 105.034 174.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -158.07 164.73 36.4 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 59.0 t30 -156.74 164.6 37.94 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 105.266 -2.124 . . . . 0.0 105.266 177.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -78.31 146.29 30.25 Favored Glycine 0 N--CA 1.452 -0.274 0 N-CA-C 110.779 -0.928 . . . . 0.0 110.779 178.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 80.7 mttt -153.21 163.49 39.79 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 104.861 -2.274 . . . . 0.0 104.861 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 45.6 tp -130.68 -97.43 0.34 Allowed 'General case' 0 C--O 1.217 -0.634 0 N-CA-C 105.903 -1.888 . . . . 0.0 105.903 174.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 51.05 34.57 11.08 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.438 1.273 . . . . 0.0 114.438 177.083 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 27.5 mmm180 -136.07 135.64 39.52 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 122.084 -0.385 . . . . 0.0 110.104 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -142.8 156.19 44.93 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 104.523 -2.399 . . . . 0.0 104.523 175.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -154.48 103.09 2.46 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 -179.009 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 27.3 tp -130.9 144.43 51.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.238 0.542 . . . . 0.0 110.11 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -106.03 84.91 2.12 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.193 -173.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -69.05 -37.67 78.69 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 176.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 31.0 mm100 . . . . . 0 C--O 1.246 0.873 0 CA-C-O 117.558 -1.211 . . . . 0.0 113.195 178.745 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 C--O 1.204 -1.29 0 CA-C-O 118.485 -0.769 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 69.67 141.31 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.633 1.173 . . . . 0.0 112.57 -176.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 33.7 tp -68.43 -35.0 76.99 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.86 -0.525 . . . . 0.0 110.537 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.29 -35.35 78.75 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -178.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -64.81 -27.44 68.88 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.073 0.464 . . . . 0.0 110.222 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -65.13 -50.67 65.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -64.47 -39.79 94.48 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.256 0.551 . . . . 0.0 110.309 179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -55.42 -52.44 63.57 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.318 178.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -71.54 -27.1 62.95 Favored 'General case' 0 N--CA 1.468 0.439 0 O-C-N 121.346 -0.846 . . . . 0.0 111.964 179.124 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 57.3 mmtt -64.97 -39.52 93.6 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 22.2 mm -71.85 -38.2 64.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 110.461 -0.2 . . . . 0.0 110.461 178.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.49 -44.89 81.12 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 176.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.42 -41.73 93.23 Favored 'General case' 0 C--O 1.211 -0.972 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.674 178.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -59.32 -47.03 86.94 Favored 'General case' 0 C--N 1.321 -0.647 0 C-N-CA 122.747 0.419 . . . . 0.0 111.585 -179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.7 mt -68.39 -47.31 67.66 Favored 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.698 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 60.0 t -57.84 -39.77 72.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 O-C-N 121.886 -0.509 . . . . 0.0 110.519 175.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.5 t-20 -62.32 -25.56 67.95 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 121.871 -0.518 . . . . 0.0 111.276 179.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -84.77 4.89 30.75 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.796 0.438 . . . . 0.0 111.366 177.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 103.14 -1.68 47.38 Favored Glycine 0 CA--C 1.518 0.249 0 N-CA-C 115.939 1.135 . . . . 0.0 115.939 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.452 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.3 m-85 -65.78 129.17 38.84 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 117.736 0.768 . . . . 0.0 110.864 -179.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.3 134.88 13.69 Favored Glycine 0 N--CA 1.45 -0.394 0 N-CA-C 109.975 -1.25 . . . . 0.0 109.975 -179.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.6 t -79.38 122.4 34.52 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 76.7 mt -90.73 -44.96 14.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 N-CA-C 105.897 -1.89 . . . . 0.0 105.897 176.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -155.0 146.24 22.87 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 106.133 -1.803 . . . . 0.0 106.133 177.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.16 105.17 4.98 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 178.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.85 43.35 7.25 Favored Glycine 0 N--CA 1.449 -0.476 0 C-N-CA 120.676 -0.773 . . . . 0.0 112.993 176.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -57.29 -40.24 77.41 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 107.254 -1.388 . . . . 0.0 107.254 176.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 3.1 p -154.37 -74.74 0.12 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 104.966 -2.235 . . . . 0.0 104.966 176.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -132.06 15.72 4.67 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.393 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -129.09 151.75 49.43 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 114.804 1.409 . . . . 0.0 114.804 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 95.2 mt -134.54 134.78 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 179.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -115.1 131.58 56.88 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 178.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mp -127.62 132.93 49.7 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.655 0.782 . . . . 0.0 109.908 -178.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -86.22 134.84 33.75 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 176.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -80.13 109.75 13.67 Favored Pre-proline 0 CA--C 1.55 0.944 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.5 Cg_endo -74.38 -24.41 14.25 Favored 'Trans proline' 0 C--N 1.35 0.65 0 C-N-CA 117.889 -0.941 . . . . 0.0 114.054 -174.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 47.4 m-20 -74.88 -4.45 37.98 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.859 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt 44.02 40.4 3.35 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-O 122.948 1.356 . . . . 0.0 111.875 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 7.3 m -67.21 -172.96 0.24 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 112.621 -2.081 . . . . 0.0 110.613 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.9 t -50.35 -35.72 29.12 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 110.163 -0.31 . . . . 0.0 110.163 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.4 m80 -83.3 138.95 33.34 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 173.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -98.04 -37.84 9.6 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.3 mt -142.39 161.59 37.65 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.853 -175.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.5 t -132.55 136.25 56.33 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 8.7 ttp180 -122.11 130.18 53.01 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 176.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 tp -107.06 128.72 54.62 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 177.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -136.43 143.56 43.99 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -124.87 99.81 6.32 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -151.69 149.47 29.13 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -91.49 151.56 20.72 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 177.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.1 mt -133.18 124.54 27.63 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 122.275 0.23 . . . . 0.0 111.468 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -75.96 -42.7 47.7 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -136.04 151.03 49.43 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.203 -175.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 18.0 ptt180 -63.98 -18.72 64.57 Favored 'General case' 0 C--O 1.212 -0.881 0 N-CA-C 113.314 0.857 . . . . 0.0 113.314 -179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -60.61 -33.17 72.36 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -77.22 -40.92 43.26 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.519 -0.919 . . . . 0.0 108.519 177.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 11.9 ttt -59.65 -40.88 89.15 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 32.7 m -71.0 -31.85 46.5 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 O-C-N 121.79 -0.569 . . . . 0.0 111.256 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.9 mtp180 -70.65 -34.62 72.24 Favored 'General case' 0 CA--C 1.506 -0.727 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.628 -176.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -59.32 -38.66 80.84 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.5 mm -71.63 -31.31 41.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 121.99 -0.444 . . . . 0.0 111.457 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.0 mt-10 -63.07 -39.61 95.22 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 177.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -68.19 -45.41 73.48 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.705 179.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.7 mm-40 -58.05 -45.11 87.55 Favored 'General case' 0 C--O 1.216 -0.696 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.189 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.79 -31.18 69.45 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 112.679 0.622 . . . . 0.0 112.679 -176.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.56 -45.43 68.75 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.339 0.59 . . . . 0.0 109.454 177.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -61.51 -44.06 97.74 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.83 0.824 . . . . 0.0 109.299 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 73.6 t -65.73 -32.81 59.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.427 -178.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -62.81 -43.0 99.95 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 121.764 -0.585 . . . . 0.0 109.434 177.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -62.16 -46.03 90.78 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 120.96 0.41 . . . . 0.0 110.273 177.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 79.7 t -61.74 -40.43 86.83 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.888 179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.412 HH21 ' HB2' ' A' ' 75' ' ' LEU . 2.7 tpm_? -66.48 -40.26 89.22 Favored 'General case' 0 C--N 1.324 -0.543 0 O-C-N 121.16 -0.963 . . . . 0.0 111.877 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 -55.47 -46.07 76.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -177.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -73.41 -18.79 61.11 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 -179.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.412 ' HB2' HH21 ' A' ' 72' ' ' ARG . 97.3 mt -99.27 -10.04 22.88 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -177.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.81 -1.53 5.71 Favored Glycine 0 CA--C 1.531 1.052 0 N-CA-C 120.935 3.134 . . . . 0.0 120.935 172.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 14.3 ttt180 -67.9 154.19 42.11 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.161 1.481 . . . . 0.0 108.107 179.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -65.44 -29.51 70.2 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -178.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.6 ttt85 -151.41 147.92 27.47 Favored 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 179.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -102.48 150.32 23.5 Favored 'General case' 0 CA--C 1.499 -0.995 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 177.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.5 tttp -134.43 122.22 22.21 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 106.062 -1.829 . . . . 0.0 106.062 168.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -124.0 129.74 51.42 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 -177.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.8 tp -92.29 121.84 34.19 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 177.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -115.81 108.57 16.48 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 179.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 5.4 t -108.45 117.34 53.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -176.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 90.8 m-85 -84.68 150.58 25.03 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 175.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -129.05 116.77 19.81 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 173.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -139.59 158.24 44.45 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.97 0.414 . . . . 0.0 111.887 -174.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 55.0 m -69.23 -49.23 58.26 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 177.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -128.28 170.43 13.06 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -176.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -110.67 154.17 43.3 Favored Pre-proline 0 C--N 1.319 -0.739 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.75 -176.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.15 146.17 89.43 Favored 'Trans proline' 0 C--N 1.348 0.551 0 N-CA-C 114.579 0.953 . . . . 0.0 114.579 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.9 m -82.17 -6.01 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 113.709 1.003 . . . . 0.0 113.709 -177.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -113.14 100.43 8.59 Favored 'General case' 0 C--O 1.217 -0.65 0 CA-C-O 119.293 -0.384 . . . . 0.0 110.438 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 44.4 t0 14.43 60.41 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 N-CA-C 117.981 2.585 . . . . 0.0 117.981 176.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 52.3 p-90 -73.1 -17.45 61.4 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -63.99 -32.45 73.99 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -60.03 -28.38 67.7 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.178 0.514 . . . . 0.0 110.137 175.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.1 mm -75.37 -40.66 42.7 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 O-C-N 122.013 -0.429 . . . . 0.0 110.588 -177.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -71.12 -18.11 62.54 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 122.138 0.97 . . . . 0.0 109.306 177.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -88.6 -3.02 58.89 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.849 -177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 17.5 ptmt -126.38 130.39 50.67 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.754 0.788 . . . . 0.0 112.296 -177.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.3 m -76.41 125.62 29.52 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 106.226 -1.768 . . . . 0.0 106.226 175.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -83.3 123.08 29.27 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 106.273 -1.751 . . . . 0.0 106.273 176.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -127.65 139.19 52.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.774 0.797 . . . . 0.0 111.649 -179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 29.2 tttp -139.97 82.06 1.85 Allowed 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.627 -1.17 . . . . 0.0 108.928 -179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.06 -112.66 5.02 Favored Glycine 0 C--O 1.227 -0.34 0 C-N-CA 119.698 -1.239 . . . . 0.0 111.726 178.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 36.4 p -86.2 8.69 20.13 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 122.76 0.424 . . . . 0.0 111.281 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -110.0 141.37 25.51 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 C-N-CA 122.574 0.35 . . . . 0.0 110.637 179.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.0 t -135.46 137.4 42.15 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 103.104 -2.924 . . . . 0.0 103.104 171.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 99.8 t -133.77 136.5 53.99 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.379 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -105.03 104.18 45.51 Favored Pre-proline 0 N--CA 1.433 -1.321 0 CA-C-N 113.71 -1.586 . . . . 0.0 108.467 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -77.99 147.71 24.2 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 117.387 -1.275 . . . . 0.0 112.191 178.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 155.91 39.9 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 105.956 -1.868 . . . . 0.0 105.956 176.369 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.9 tt -149.81 142.16 17.48 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 N-CA-C 106.093 -1.817 . . . . 0.0 106.093 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 60.6 t -117.35 103.84 15.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 176.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.64 138.47 31.44 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 178.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.43 -22.92 66.14 Favored Glycine 0 C--N 1.321 -0.29 0 CA-C-N 116.072 -0.513 . . . . 0.0 113.977 -178.274 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 119' ' ' THR . 22.0 p -59.21 -29.27 67.37 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -177.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.4 ptm -144.65 36.52 1.18 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.979 0.895 . . . . 0.0 109.261 179.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.7 tt -44.61 -40.35 5.72 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -173.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 37.6 ttm180 -58.24 -51.45 69.72 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 118.387 0.54 . . . . 0.0 111.411 -176.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -76.99 -34.88 57.49 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.327 0.584 . . . . 0.0 112.07 -178.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -67.43 -36.27 80.91 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.596 0.712 . . . . 0.0 111.707 -177.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.85 -44.1 77.93 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.169 -179.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -71.88 -14.29 61.9 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.273 -0.571 . . . . 0.0 111.321 -176.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.23 -26.42 62.92 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.442 177.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 3.1 p -108.73 -37.83 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 CA-C-O 120.635 0.255 . . . . 0.0 111.465 179.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.3 m-85 -125.19 75.29 67.92 Favored Pre-proline 0 CA--C 1.536 0.421 0 O-C-N 121.863 -0.523 . . . . 0.0 111.289 178.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.22 -7.42 21.31 Favored 'Trans proline' 0 C--N 1.347 0.474 0 N-CA-C 114.724 1.009 . . . . 0.0 114.724 -178.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 20.3 t -85.85 -5.82 59.18 Favored 'General case' 0 C--N 1.328 -0.334 0 O-C-N 121.971 -0.456 . . . . 0.0 111.039 178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -89.37 130.86 35.67 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.101 -1.074 . . . . 0.0 108.101 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 71.8 mtm-85 -86.67 143.31 27.66 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 108.885 -0.784 . . . . 0.0 108.885 -178.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 20.5 p -66.53 -22.99 66.16 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 174.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -59.53 -37.27 77.92 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.128 175.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 69.7 m-20 -66.4 -23.57 66.33 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 120.865 0.364 . . . . 0.0 110.359 -177.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 17.9 t -122.15 54.6 1.17 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 179.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -52.69 132.21 35.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.063 -178.173 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -66.28 -30.69 71.17 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -171.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.71 -26.16 66.88 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.662 0.744 . . . . 0.0 110.888 176.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 27.0 t60 -96.91 -10.23 26.85 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.019 -177.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -74.06 121.57 21.31 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.287 0.565 . . . . 0.0 110.926 -177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 29.6 t -152.82 152.25 31.38 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -66.71 -29.31 69.27 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.878 179.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -74.89 -35.4 62.26 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 122.117 0.96 . . . . 0.0 110.168 178.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -61.39 -24.28 66.39 Favored 'General case' 0 C--O 1.214 -0.768 0 CA-C-N 115.088 -0.96 . . . . 0.0 109.911 -179.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.78 -35.86 64.28 Favored 'General case' 0 CA--C 1.543 0.681 0 O-C-N 121.769 -0.582 . . . . 0.0 111.905 176.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -69.61 -43.09 73.45 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 121.954 -0.466 . . . . 0.0 109.816 178.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 33.3 mmt -64.56 -33.24 75.44 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.87 79.07 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.588 -0.278 . . . . 0.0 111.222 178.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 59.5 ttt180 -68.06 -43.83 77.75 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 177.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 59.7 mt-10 -65.89 -39.43 90.63 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.5 0.667 . . . . 0.0 110.372 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.9 tmt_? -62.92 -38.8 92.43 Favored 'General case' 0 C--O 1.213 -0.854 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 176.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.6 t80 -64.71 -40.33 95.17 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 120.884 0.373 . . . . 0.0 111.86 177.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 30.3 mt -64.54 -36.58 84.68 Favored 'General case' 0 C--N 1.321 -0.654 0 O-C-N 122.12 -0.363 . . . . 0.0 111.059 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 7.6 p -76.06 -32.17 59.17 Favored 'General case' 0 CA--C 1.545 0.774 0 O-C-N 121.585 -0.697 . . . . 0.0 111.281 174.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -42.62 98.09 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -179.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 13.2 p -58.99 -39.2 77.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.413 -176.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.92 -40.37 63.18 Favored 'General case' 0 C--N 1.329 -0.314 0 O-C-N 121.473 -0.767 . . . . 0.0 110.192 177.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 47.8 tttp -59.95 -29.43 68.4 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 121.906 -0.496 . . . . 0.0 110.739 178.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 6.1 tm0? -55.54 -29.84 59.66 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 112.004 0.372 . . . . 0.0 112.004 179.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 72.6 mm-40 -64.73 -39.87 94.36 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.591 0.632 . . . . 0.0 110.905 177.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -67.98 -32.78 73.43 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 24.7 mm100 -69.13 -42.19 76.36 Favored 'General case' 0 C--O 1.214 -0.791 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.144 177.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 7.4 mtp85 -59.02 -39.8 83.01 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 178.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 36.7 tttm -66.64 -44.84 80.9 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.098 179.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 33.1 m -72.48 -49.77 30.76 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.567 0.951 . . . . 0.0 113.567 -178.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -63.69 -21.2 66.27 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -176.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.23 -17.72 8.31 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 177.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.41 100.6 3.26 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 175.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 32.5 t -56.64 132.65 20.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.012 -178.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.39 -176.2 4.94 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 -174.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -146.72 171.74 14.69 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.247 -177.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 9.2 t-20 64.79 -119.92 0.42 Allowed 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.235 1.014 . . . . 0.0 111.21 179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 84.36 20.71 58.25 Favored Glycine 0 C--O 1.222 -0.628 0 CA-C-N 118.993 0.815 . . . . 0.0 114.156 -178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 49.1 tttp 56.4 46.95 19.92 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-O 121.875 0.845 . . . . 0.0 111.714 178.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 5.2 mp -84.48 50.13 1.82 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-O 122.686 1.231 . . . . 0.0 110.568 178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -83.82 159.05 21.47 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.247 -179.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -159.17 141.23 13.62 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.877 -0.416 . . . . 0.0 109.877 -177.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -137.99 124.03 20.24 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 176.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 49.5 t30 -165.79 138.55 4.18 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 178.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 2.7 tp -156.47 138.46 14.46 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 178.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -161.29 165.0 29.83 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 -178.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -142.07 152.27 43.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 106.106 -1.812 . . . . 0.0 106.106 177.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 . . . . . 0 C--O 1.255 1.35 0 N-CA-C 103.544 -2.762 . . . . 0.0 103.544 -179.943 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.6 mtm . . . . . 0 N--CA 1.495 1.785 0 CA-C-O 120.543 0.211 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -39.42 -51.31 2.12 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 118.925 2.935 . . . . 0.0 118.925 -172.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 63.5 tp -57.19 -45.76 83.44 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.677 0.751 . . . . 0.0 111.239 -177.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 52.9 mt -73.67 -37.06 65.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.39 -177.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.69 -34.03 77.34 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.631 -178.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -59.33 -50.58 73.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 m -66.0 -41.9 90.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.89 0.376 . . . . 0.0 111.283 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 54.4 t80 -57.21 -52.13 66.57 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.113 0.565 . . . . 0.0 111.95 179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.402 ' CZ3' HD11 ' A' ' 31' ' ' ILE . 92.6 m95 -70.8 -30.98 67.58 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.807 -0.558 . . . . 0.0 110.656 -179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -69.59 -38.15 77.21 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.874 -0.516 . . . . 0.0 111.693 177.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.4 HD11 HD11 ' A' ' 125' ' ' LEU . 12.0 mm -70.39 -36.51 67.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.33 -43.03 83.02 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.83 -44.82 84.4 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.543 177.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -59.08 -45.05 91.82 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.228 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.6 mt -69.23 -47.61 64.26 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.0 p -62.4 -29.03 45.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.362 177.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -72.4 -24.94 61.32 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.063 0.459 . . . . 0.0 109.905 177.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.4 t -87.84 8.83 24.15 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.501 175.149 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 95.74 2.41 61.37 Favored Glycine 0 CA--C 1.519 0.336 0 N-CA-C 116.79 1.476 . . . . 0.0 116.79 176.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.411 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 6.9 m-85 -72.48 113.05 9.09 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 118.182 0.991 . . . . 0.0 109.458 178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.54 126.0 24.15 Favored Glycine 0 C--O 1.226 -0.39 0 C-N-CA 120.363 -0.922 . . . . 0.0 111.538 -177.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 70.9 t -76.42 121.95 29.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 178.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.6 mt -91.39 -42.09 13.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 N-CA-C 107.911 -1.144 . . . . 0.0 107.911 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -153.11 145.0 23.61 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 106.51 -1.663 . . . . 0.0 106.51 -178.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.21 117.21 11.11 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 118.273 0.488 . . . . 0.0 112.31 -179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 78.3 40.75 18.81 Favored Glycine 0 C--O 1.223 -0.592 0 C-N-CA 120.903 -0.665 . . . . 0.0 111.481 178.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -60.54 -40.52 91.84 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 122.228 1.013 . . . . 0.0 108.66 179.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 23.1 m -165.15 -75.12 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 103.842 -2.651 . . . . 0.0 103.842 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 45.5 m-20 -121.31 7.94 10.22 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -113.43 147.07 38.5 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 117.481 2.4 . . . . 0.0 117.481 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.402 HD11 ' CZ3' ' A' ' 9' ' ' TRP . 96.6 mt -132.76 129.57 58.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 103.069 -2.938 . . . . 0.0 103.069 169.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -108.16 129.3 55.18 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.411 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -130.1 134.72 47.55 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 -179.358 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -84.23 136.87 33.77 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -90.97 105.76 13.41 Favored Pre-proline 0 CA--C 1.547 0.831 0 CA-C-N 118.005 0.366 . . . . 0.0 111.194 -178.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 90.6 Cg_endo -72.06 -17.31 28.4 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 118.402 -0.599 . . . . 0.0 112.892 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 69.3 m-20 -71.33 -15.85 62.41 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.379 0.881 . . . . 0.0 113.379 -178.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.0 mtmt 58.12 38.95 26.51 Favored 'General case' 0 N--CA 1.482 1.139 0 N-CA-C 107.091 -1.448 . . . . 0.0 107.091 -175.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.7 t -62.57 -177.43 0.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 112.945 -1.934 . . . . 0.0 112.377 -178.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.9 m -57.21 -10.66 1.33 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 123.034 0.534 . . . . 0.0 111.828 175.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 22.7 p-80 -127.93 151.26 49.32 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 105.688 -1.967 . . . . 0.0 105.688 173.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -96.9 -31.2 12.69 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 121.083 0.468 . . . . 0.0 109.952 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 57.1 mt -135.33 161.91 34.07 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 54.5 t -123.17 133.58 68.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 59.5 ttt-85 -117.31 108.78 16.02 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 106.587 -1.635 . . . . 0.0 106.587 174.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 90.7 mt -85.89 130.53 34.52 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 103.777 -2.675 . . . . 0.0 103.777 176.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 24.9 t80 -134.65 123.09 23.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 117.993 0.361 . . . . 0.0 111.267 -176.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -102.69 94.55 5.68 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.04 0.447 . . . . 0.0 111.582 -177.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -151.24 139.73 20.53 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 -179.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.4 p-10 -92.65 151.6 20.01 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 26.3 mt -134.64 119.85 18.83 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.68 -173.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -86.48 -37.58 18.13 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.71 0.767 . . . . 0.0 110.52 178.07 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.5 145.79 51.41 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.797 -0.638 . . . . 0.0 112.135 -178.797 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.66 ' HD2' HD11 ' A' ' 99' ' ' ILE . 28.0 ptt180 -66.1 -20.74 66.26 Favored 'General case' 0 C--O 1.215 -0.754 0 CA-C-N 115.806 -0.633 . . . . 0.0 111.097 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -64.09 -33.24 75.32 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.141 177.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.0 mm-40 -77.64 -35.25 52.73 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.475 -0.766 . . . . 0.0 109.21 175.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 18.5 ttt -58.26 -50.41 73.7 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.954 178.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 29.8 m -60.61 -31.87 50.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -69.11 -37.94 78.65 Favored 'General case' 0 CA--C 1.509 -0.626 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -176.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -59.87 -41.71 92.11 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 108.736 -0.839 . . . . 0.0 108.736 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.4 mp -71.78 -36.39 58.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 O-C-N 121.447 -0.783 . . . . 0.0 111.72 -179.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -65.11 -30.72 71.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.3 tt0 -76.53 -41.72 45.73 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.618 0.723 . . . . 0.0 109.564 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -58.06 -35.0 70.72 Favored 'General case' 0 C--O 1.209 -1.034 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.272 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.6 -37.44 78.57 Favored 'General case' 0 C--N 1.319 -0.759 0 O-C-N 122.056 -0.403 . . . . 0.0 111.41 -179.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.4 tp10 -72.89 -36.02 67.23 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.609 0.719 . . . . 0.0 109.168 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.3 -43.18 99.3 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 87.9 t -66.92 -38.42 81.36 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 179.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -57.49 -41.15 80.16 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 119.419 1.009 . . . . 0.0 110.243 177.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -62.55 -41.66 99.03 Favored 'General case' 0 N--CA 1.466 0.326 0 C-N-CA 120.689 -0.404 . . . . 0.0 111.165 178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 87.5 t -69.99 -46.43 73.23 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.454 0.645 . . . . 0.0 109.704 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.54 -40.1 78.1 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 123.546 0.738 . . . . 0.0 111.131 -179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 4.1 t-160 -63.33 -51.72 64.83 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.75 -0.205 . . . . 0.0 111.403 -179.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -71.12 -22.26 62.1 Favored 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 112.389 0.515 . . . . 0.0 112.389 -178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 6.0 mp -82.08 -4.96 57.97 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.886 0.374 . . . . 0.0 110.51 175.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.82 13.71 64.24 Favored Glycine 0 CA--C 1.519 0.317 0 N-CA-C 114.289 0.475 . . . . 0.0 114.289 178.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 22.7 mtp180 -79.64 145.4 33.05 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 121.776 -0.838 . . . . 0.0 112.605 -175.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 74.1 mtp85 -72.41 -32.89 66.74 Favored 'General case' 0 C--O 1.222 -0.376 0 CA-C-N 115.336 -0.847 . . . . 0.0 109.882 177.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.7 ttt180 -153.13 150.8 29.45 Favored 'General case' 0 C--O 1.24 0.566 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 177.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.3 ttp -131.59 150.58 52.1 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.512 -0.551 . . . . 0.0 109.512 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -117.74 139.25 51.32 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -135.16 131.62 37.02 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 118.378 0.535 . . . . 0.0 110.287 -178.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.7 tp -93.55 122.28 35.82 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -110.57 108.45 18.41 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.6 t -105.23 105.6 18.96 Favored 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 120.897 0.38 . . . . 0.0 110.801 -179.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.2 m-85 -75.73 144.59 41.41 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 174.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -121.74 104.14 9.38 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 103.125 -2.916 . . . . 0.0 103.125 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.1 m -123.1 156.56 34.7 Favored 'General case' 0 C--O 1.216 -0.676 0 O-C-N 123.543 0.527 . . . . 0.0 110.149 -173.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 60.6 m -67.06 -52.69 39.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 110.583 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -126.29 -179.41 4.73 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -175.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -102.99 141.8 23.23 Favored Pre-proline 0 C--N 1.317 -0.832 0 N-CA-C 106.025 -1.843 . . . . 0.0 106.025 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -57.12 142.92 94.35 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 117.696 -1.069 . . . . 0.0 113.851 179.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.1 m -77.65 -10.25 12.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -173.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.6 p-10 -110.04 56.21 0.63 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 114.901 1.445 . . . . 0.0 114.901 -173.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 40.3 t0 61.76 52.53 3.48 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-O 123.238 1.494 . . . . 0.0 114.882 174.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 46.6 p-90 -65.45 -17.88 64.89 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 121.349 -0.844 . . . . 0.0 112.69 175.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -58.81 -37.4 76.3 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.322 0.49 . . . . 0.0 112.322 -173.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 74.1 mm-40 -66.9 -18.61 65.46 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.017 0.377 . . . . 0.0 112.017 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.66 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.3 mm -73.02 -37.87 54.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.11 -25.08 63.33 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.427 0.632 . . . . 0.0 110.438 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 77.2 mttt -89.15 3.14 52.88 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.184 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -116.95 98.49 6.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.31 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 47.1 m -68.53 126.11 28.61 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 105.155 -2.165 . . . . 0.0 105.155 172.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -86.25 108.44 18.38 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -110.31 101.39 10.13 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.76 0.79 . . . . 0.0 113.013 -176.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 46.2 tttm -99.48 75.58 1.97 Allowed 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.76 -108.35 2.08 Favored Glycine 0 C--O 1.228 -0.238 0 C-N-CA 119.529 -1.319 . . . . 0.0 112.568 176.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 52.0 p -72.4 9.84 0.94 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.535 1.134 . . . . 0.0 112.965 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 99.3 t -129.49 144.82 36.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 C-N-CA 122.796 0.438 . . . . 0.0 110.471 -177.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 35.0 t -136.34 118.32 15.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 172.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -118.79 126.39 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.471 -2.075 0 CA-C-O 122.74 1.257 . . . . 0.0 110.379 179.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -99.42 104.53 27.63 Favored Pre-proline 0 N--CA 1.419 -2.001 0 CA-C-N 111.4 -2.636 . . . . 0.0 109.474 -176.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -80.27 149.47 19.45 Favored 'Trans proline' 0 CA--C 1.531 0.353 0 C-N-CA 117.843 -0.971 . . . . 0.0 113.973 -179.679 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.32 149.84 31.55 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 175.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.0 tt -142.72 123.35 10.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.1 t -102.57 107.84 22.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 105.374 -2.084 . . . . 0.0 105.374 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.85 136.16 33.36 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -60.7 -33.58 83.08 Favored Glycine 0 CA--C 1.511 -0.182 0 N-CA-C 114.908 0.723 . . . . 0.0 114.908 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.5 t -56.05 -23.88 36.19 Favored 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -179.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.5 ptm -140.97 35.83 1.75 Allowed 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 122.586 1.184 . . . . 0.0 109.44 178.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.81 -41.94 34.39 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 -171.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 65.1 ttt180 -61.52 -51.36 68.93 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 121.16 1.8 . . . . 0.0 111.387 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -73.69 -32.94 64.2 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.828 -175.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -72.73 -39.92 66.52 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.889 0.852 . . . . 0.0 111.309 179.121 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.4 HD11 HD11 ' A' ' 11' ' ' ILE . 3.5 tm? -68.22 -43.47 77.93 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.751 -0.593 . . . . 0.0 110.491 -179.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -70.62 -13.39 62.07 Favored 'General case' 0 C--N 1.326 -0.435 0 C-N-CA 120.937 -0.305 . . . . 0.0 111.424 -177.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.41 -32.03 62.54 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 175.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 38.4 t -91.21 -43.64 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.367 0.603 . . . . 0.0 110.157 179.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -127.39 79.61 73.0 Favored Pre-proline 0 CA--C 1.536 0.427 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.036 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.6 -13.85 38.19 Favored 'Trans proline' 0 C--N 1.347 0.456 0 N-CA-C 114.535 0.937 . . . . 0.0 114.535 -178.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.6 m -84.47 -2.46 57.28 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.349 0.5 . . . . 0.0 112.349 179.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -76.83 137.29 39.11 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.447 0.641 . . . . 0.0 111.183 -179.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -73.18 103.0 3.76 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.874 -0.603 . . . . 0.0 109.76 178.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 58.8 p -68.51 -18.63 64.42 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.063 0.459 . . . . 0.0 110.042 178.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.454 ' CD ' ' H ' ' A' ' 135' ' ' GLU . 1.9 mp0 -72.43 -15.74 61.83 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 123.503 0.721 . . . . 0.0 111.514 178.135 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -77.05 7.2 5.2 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 122.034 0.921 . . . . 0.0 110.593 -178.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 44.0 t -140.49 131.14 25.62 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 105.315 -2.105 . . . . 0.0 105.315 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.8 t -150.34 161.15 43.03 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 -178.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -62.21 -36.79 83.0 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.238 0.542 . . . . 0.0 110.825 -178.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -60.2 -22.16 62.62 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 122.02 0.914 . . . . 0.0 111.254 178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 17.1 m170 -119.04 19.11 13.05 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.641 -175.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -78.72 13.89 1.51 Allowed 'General case' 0 CA--C 1.546 0.81 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -177.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 89.2 p -69.03 149.18 49.05 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 121.506 -0.746 . . . . 0.0 111.398 -178.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -64.25 -28.85 70.01 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.476 0.655 . . . . 0.0 110.449 178.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -64.14 -38.03 89.57 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.264 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -63.19 -29.11 70.52 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.98 -0.45 . . . . 0.0 110.866 -179.214 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -70.92 -38.06 72.93 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 122.286 -0.259 . . . . 0.0 110.705 177.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 23.3 tm0? -64.03 -45.73 87.6 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtt -62.69 -28.95 70.3 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.675 179.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.08 -34.49 73.53 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 121.63 -0.669 . . . . 0.0 111.115 -178.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -66.37 -45.64 79.42 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 178.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -67.1 -38.03 84.96 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.259 0.552 . . . . 0.0 110.375 -178.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 60.3 mtt85 -61.86 -43.49 98.73 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 109.345 -0.613 . . . . 0.0 109.345 176.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -63.88 -42.17 97.56 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 118.515 0.598 . . . . 0.0 111.887 178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 54.5 mt -64.5 -36.36 83.95 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 122.092 -0.38 . . . . 0.0 111.648 -178.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 10.6 p -76.14 -35.66 59.14 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 120.187 -0.605 . . . . 0.0 110.321 174.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -60.83 -41.24 95.38 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 123.69 0.796 . . . . 0.0 112.837 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -63.13 -38.25 81.56 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 CA-C-N 118.753 0.706 . . . . 0.0 111.349 -178.019 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -73.81 -40.52 63.31 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 176.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 21.9 ttpp -57.78 -25.46 60.54 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.132 177.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . 0.423 ' HA ' ' HB2' ' A' ' 164' ' ' GLN . 2.1 tp-100 -54.97 -28.41 51.47 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 111.873 0.323 . . . . 0.0 111.873 178.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 -65.8 -34.31 77.87 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.498 0.666 . . . . 0.0 110.739 177.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -76.79 -40.9 46.57 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . 0.423 ' HB2' ' HA ' ' A' ' 161' ' ' GLN . 20.9 mm100 -59.79 -46.38 89.39 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 113.718 1.007 . . . . 0.0 113.718 -178.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 6.9 ptm180 -59.6 -24.5 63.85 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 118.19 0.45 . . . . 0.0 111.605 -177.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -77.62 -49.04 15.4 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.706 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 55.2 p -72.4 -23.44 61.1 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.07 -19.49 7.39 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.253 1.575 . . . . 0.0 115.253 -177.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -52.85 -18.41 1.89 Allowed 'General case' 0 CA--C 1.555 1.14 0 N-CA-C 111.843 0.312 . . . . 0.0 111.843 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 51.38 67.02 1.02 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 171.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 33.6 m -63.61 -15.45 16.5 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.755 178.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 15.4 p90 -151.81 150.97 30.74 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 173.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -162.71 142.56 9.32 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 106.524 -1.658 . . . . 0.0 106.524 178.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -165.66 151.09 9.0 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 117.744 0.247 . . . . 0.0 110.947 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 83.19 173.79 49.93 Favored Glycine 0 CA--C 1.521 0.424 0 N-CA-C 117.77 1.868 . . . . 0.0 117.77 174.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 41.2 tttp -153.31 149.95 28.42 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 104.727 -2.323 . . . . 0.0 104.727 177.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 48.3 tp -112.83 161.16 17.26 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 175.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -144.54 163.93 32.41 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 106.661 -1.607 . . . . 0.0 106.661 175.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 39.1 ttm180 -83.78 -34.04 24.85 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 106.808 -1.553 . . . . 0.0 106.808 174.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 44.65 42.36 5.72 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 115.63 1.715 . . . . 0.0 115.63 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 56.6 t30 -138.59 151.95 47.72 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 121.887 -0.508 . . . . 0.0 110.167 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.518 ' HG ' ' H ' ' A' ' 184' ' ' PHE . 27.7 tp -87.94 149.81 23.84 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 123.307 0.643 . . . . 0.0 109.557 -178.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -71.71 -15.22 62.2 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . 0.518 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 0.2 OUTLIER 52.6 35.15 17.34 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 118.407 2.743 . . . . 0.0 118.407 171.664 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 . . . . . 0 C--O 1.25 1.111 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 175.311 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.5 mtp . . . . . 0 N--CA 1.499 2.0 0 CA-C-O 119.484 -0.294 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 36.9 m-85 -67.36 -15.22 63.56 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -178.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 27.2 tp -55.05 -32.22 61.73 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 122.722 0.409 . . . . 0.0 111.166 176.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 22.4 tp -60.65 -48.11 83.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.821 0.343 . . . . 0.0 110.491 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 65.8 tt0 -73.75 -30.63 62.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.443 0.64 . . . . 0.0 110.804 -178.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -61.62 -43.0 99.67 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 175.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 47.9 m -66.34 -44.31 83.66 Favored 'General case' 0 C--O 1.217 -0.646 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.778 177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -53.05 -55.43 23.82 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -68.59 -35.66 77.66 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.527 -0.733 . . . . 0.0 112.858 -178.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -74.88 -25.24 58.81 Favored 'General case' 0 N--CA 1.47 0.56 0 O-C-N 121.113 -0.992 . . . . 0.0 112.515 179.219 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.567 HD11 HD11 ' A' ' 125' ' ' LEU . 7.4 mm -67.76 -40.78 84.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 N-CA-C 108.125 -1.065 . . . . 0.0 108.125 175.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.96 -40.29 80.21 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.35 -41.95 96.49 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.392 177.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -63.54 -42.33 98.4 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.585 0.231 . . . . 0.0 110.539 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.4 mt -65.2 -45.74 83.56 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.4 t -60.48 -40.11 83.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.101 179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -62.16 -30.63 71.19 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.664 -0.647 . . . . 0.0 110.623 177.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 18.8 m -80.39 11.41 3.65 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.926 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.14 3.19 63.71 Favored Glycine 0 C--O 1.229 -0.194 0 N-CA-C 115.296 0.879 . . . . 0.0 115.296 175.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.454 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 16.5 m-85 -68.8 126.4 29.63 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.024 0.912 . . . . 0.0 110.361 179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.09 134.89 13.75 Favored Glycine 0 C--O 1.225 -0.445 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.57 119.18 24.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 O-C-N 122.013 -0.698 . . . . 0.0 110.142 -179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 77.2 mt -89.41 -46.03 15.28 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 174.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -149.76 120.37 7.49 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.472 -0.786 . . . . 0.0 110.285 -177.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 126.08 19.52 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 151.05 -30.89 0.98 Allowed Glycine 0 CA--C 1.506 -0.526 0 N-CA-C 111.356 -0.697 . . . . 0.0 111.356 176.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -64.73 141.82 58.64 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 106.015 -1.846 . . . . 0.0 106.015 176.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.5 m -67.26 -27.03 66.87 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 58.1 m-20 -114.94 -5.02 12.53 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -173.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -144.73 142.97 30.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.36 0.982 . . . . 0.0 113.445 177.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 22.8 mt -136.5 125.98 38.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 177.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 70.9 m95 -107.77 123.87 49.19 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.454 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.3 mm? -124.15 128.58 49.46 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -83.0 132.22 35.15 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 179.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.56 123.52 89.64 Favored Pre-proline 0 C--N 1.324 -0.52 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 179.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -72.67 -19.51 24.21 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 116.955 -1.563 . . . . 0.0 112.943 -176.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -66.07 -33.87 76.78 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 113.501 0.926 . . . . 0.0 113.501 -177.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 56.75 27.38 12.66 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.65 1.214 . . . . 0.0 110.638 -177.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 21.9 t -79.46 -172.85 3.43 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 112.217 -2.265 . . . . 0.0 106.347 176.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.7 m -41.75 -25.45 0.06 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.021 1.86 . . . . 0.0 116.021 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.9 m80 -110.38 127.27 55.0 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 169.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -91.01 -32.42 15.93 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 113.134 0.79 . . . . 0.0 113.134 -176.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -152.62 166.42 32.15 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.5 p -130.36 136.67 58.05 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.2 ttt180 -112.64 111.28 21.98 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 176.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -81.47 128.53 33.98 Favored 'General case' 0 C--N 1.315 -0.909 0 N-CA-C 101.917 -3.364 . . . . 0.0 101.917 173.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -136.13 114.89 12.05 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.451 0.643 . . . . 0.0 111.732 -176.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tttm -87.38 94.66 9.75 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -178.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -151.7 136.41 17.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.784 0.326 . . . . 0.0 110.264 178.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -97.26 147.24 24.33 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 175.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.97 134.61 47.56 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 -178.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 45.0 t0 -92.25 -39.93 11.25 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.956 -1.127 . . . . 0.0 107.956 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -120.39 147.84 44.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.634 0.73 . . . . 0.0 112.418 -178.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.4 ptt180 -61.3 -21.26 63.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -67.48 -33.25 74.73 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 121.961 -0.462 . . . . 0.0 109.8 178.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -68.24 -37.59 80.95 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 179.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 54.1 ttm -61.94 -46.5 89.03 Favored 'General case' 0 C--O 1.219 -0.517 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.67 178.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.1 m -68.02 -36.62 76.16 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 119.768 -0.773 . . . . 0.0 111.745 -177.036 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.3 -26.43 62.86 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 120.137 -0.625 . . . . 0.0 111.862 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.0 m-20 -65.15 -34.5 78.54 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 178.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -72.08 -30.87 37.94 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 C-N-CA 120.331 -0.548 . . . . 0.0 111.495 179.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -61.63 -40.17 93.91 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -67.91 -44.85 75.97 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.864 178.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -61.02 -38.76 87.21 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.465 -179.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.06 -33.71 76.03 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 -179.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -68.87 -37.04 78.79 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.244 0.545 . . . . 0.0 109.917 177.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.0 mmt85 -64.21 -42.3 96.67 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 176.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.511 HG11 HG13 ' A' ' 109' ' ' VAL . 44.9 t -62.29 -40.41 87.69 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.066 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.521 -179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -57.53 -36.1 71.15 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 119.108 0.867 . . . . 0.0 111.333 179.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -64.33 -45.95 85.59 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 120.532 -0.467 . . . . 0.0 110.531 177.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 49.4 t -69.72 -40.8 79.66 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 CA-C-O 121.663 0.744 . . . . 0.0 110.248 -178.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.82 -39.83 78.56 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 123.348 0.659 . . . . 0.0 110.201 179.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.8 t-80 -63.35 -47.57 81.59 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.487 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -73.36 -23.01 60.15 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 120.7 -0.4 . . . . 0.0 111.989 -178.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 4.9 mp -83.3 -11.88 57.25 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.668 0.271 . . . . 0.0 111.353 177.258 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.21 17.6 68.32 Favored Glycine 0 CA--C 1.52 0.401 0 CA-C-O 121.55 0.528 . . . . 0.0 112.482 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 37.0 mmt-85 -69.62 136.95 51.85 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.113 -0.64 . . . . 0.0 111.503 -176.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 72.3 ttp85 -72.09 -32.04 66.63 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 176.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 8.5 ttt180 -152.32 145.34 24.51 Favored 'General case' 0 CA--C 1.503 -0.861 0 N-CA-C 102.536 -3.135 . . . . 0.0 102.536 173.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.1 ttp -125.36 143.04 51.16 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.503 -1.295 . . . . 0.0 107.503 -178.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -120.58 129.79 53.92 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -117.64 134.06 55.29 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.021 -176.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 64.3 tp -93.87 124.9 38.18 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 106.518 -1.66 . . . . 0.0 106.518 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -112.06 128.27 56.14 Favored 'General case' 0 C--N 1.318 -0.794 0 O-C-N 121.905 -0.497 . . . . 0.0 109.793 178.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.65 105.85 17.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 178.504 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -75.14 136.58 41.07 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 176.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -111.99 108.36 17.66 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 105.093 -2.188 . . . . 0.0 105.093 173.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 94.9 p -126.39 158.52 35.71 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.71 -174.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.9 t -80.01 -28.9 39.36 Favored 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 119.882 -0.727 . . . . 0.0 109.632 179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -155.41 167.11 31.44 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 105.351 -2.092 . . . . 0.0 105.351 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.85 158.83 41.54 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 122.669 0.388 . . . . 0.0 111.174 -175.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.41 153.17 42.47 Favored 'Trans proline' 0 C--N 1.355 0.898 0 O-C-N 122.178 0.567 . . . . 0.0 112.871 175.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -62.72 -29.69 47.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 N-CA-C 117.035 2.235 . . . . 0.0 117.035 -174.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -157.41 151.61 24.76 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 115.633 1.716 . . . . 0.0 115.633 -177.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.8 t0 49.8 15.89 0.18 Allowed 'General case' 0 N--CA 1.48 1.074 0 N-CA-C 117.736 2.495 . . . . 0.0 117.736 173.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 27.7 p-90 -76.81 -25.21 53.01 Favored 'General case' 0 C--O 1.216 -0.669 0 O-C-N 121.118 -0.989 . . . . 0.0 110.741 179.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -62.05 -31.93 72.39 Favored 'General case' 0 C--N 1.322 -0.599 0 O-C-N 121.989 -0.444 . . . . 0.0 111.783 -175.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.59 -17.71 62.9 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.128 0.49 . . . . 0.0 110.823 178.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 10.8 mm -75.87 -36.12 31.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 178.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -70.22 -17.51 63.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.074 0.464 . . . . 0.0 111.341 178.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 49.5 mttp -96.34 2.71 52.99 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -178.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -121.48 138.42 54.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.434 0.635 . . . . 0.0 111.013 -179.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 62.4 m -80.59 125.88 30.55 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -82.66 130.49 35.13 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 105.084 -2.191 . . . . 0.0 105.084 176.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -129.6 137.11 50.52 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.557 0.694 . . . . 0.0 112.448 -178.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -132.6 75.59 1.64 Allowed 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.15 -112.66 5.18 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 119.966 -1.111 . . . . 0.0 111.989 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 11.8 t -77.5 16.49 0.63 Allowed 'General case' 0 CA--C 1.555 1.14 0 CA-C-O 121.68 0.752 . . . . 0.0 111.935 -179.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.511 HG13 HG11 ' A' ' 68' ' ' VAL . 76.6 t -130.07 141.3 46.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 121.47 -0.769 . . . . 0.0 111.677 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 70.9 m -132.49 140.21 48.27 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 105.629 -1.989 . . . . 0.0 105.629 171.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.8 t -138.24 138.17 43.45 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.291 0 CA-C-O 121.566 0.698 . . . . 0.0 110.564 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -106.98 108.77 62.52 Favored Pre-proline 0 N--CA 1.435 -1.2 0 CA-C-N 114.185 -1.371 . . . . 0.0 110.101 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.41 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 51.8 Cg_endo -78.83 155.33 26.83 Favored 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 115.363 -2.625 . . . . 0.0 112.132 176.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -153.13 153.42 32.75 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 102.269 -3.234 . . . . 0.0 102.269 175.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.4 tt -146.88 130.08 8.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 -176.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 15.0 m -105.92 133.53 50.06 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 N-CA-C 104.473 -2.417 . . . . 0.0 104.473 172.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.82 136.18 53.14 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 107.174 -1.417 . . . . 0.0 107.174 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -55.21 -34.13 58.57 Favored Glycine 0 C--O 1.227 -0.332 0 N-CA-C 115.65 1.02 . . . . 0.0 115.65 -174.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.4 t -61.7 -17.08 54.2 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 115.027 1.491 . . . . 0.0 115.027 -178.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.1 ptm -141.49 25.44 2.02 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.665 0.745 . . . . 0.0 109.815 179.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -48.0 -39.78 20.61 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -170.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -58.72 -51.33 70.41 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 119.456 1.026 . . . . 0.0 111.729 -177.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 41.3 m-20 -73.76 -34.71 64.82 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.333 0.587 . . . . 0.0 111.585 -179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -65.91 -40.59 91.64 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 122.065 0.936 . . . . 0.0 111.789 -178.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.567 HD11 HD11 ' A' ' 11' ' ' ILE . 2.7 tm? -67.54 -44.76 77.53 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.433 -176.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 22.6 pt20 -70.97 -13.75 62.12 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.11 -0.636 . . . . 0.0 111.164 -176.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.82 -35.5 62.44 Favored 'General case' 0 CA--C 1.538 0.51 0 N-CA-C 110.035 -0.358 . . . . 0.0 110.035 176.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.1 p -93.62 -36.8 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.742 0 CA-C-O 120.632 0.253 . . . . 0.0 111.327 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -126.39 75.85 73.46 Favored Pre-proline 0 C--N 1.326 -0.422 0 O-C-N 122.079 -0.388 . . . . 0.0 110.755 177.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -68.95 -14.99 39.69 Favored 'Trans proline' 0 C--N 1.348 0.532 0 C-N-CA 118.53 -0.513 . . . . 0.0 112.766 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 m -76.03 0.78 17.42 Favored 'General case' 0 C--N 1.327 -0.397 0 C-N-CA 122.821 0.449 . . . . 0.0 112.008 178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -117.27 139.07 51.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 -179.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -73.04 96.82 2.22 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 176.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 14.8 t -61.57 -20.65 63.52 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.627 0.727 . . . . 0.0 110.148 178.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -72.96 -16.3 61.53 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 179.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -72.27 -12.6 61.23 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 177.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 78.8 m -92.84 48.91 1.39 Allowed 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 176.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.38 154.12 29.1 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.264 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -63.44 -23.0 67.21 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.655 0.983 . . . . 0.0 113.655 -174.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 60.5 mp0 -61.35 -24.69 66.64 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.421 0.629 . . . . 0.0 110.16 176.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -95.0 10.98 33.56 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -75.73 2.42 12.15 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 40.4 t -72.25 147.26 46.62 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.039 0.447 . . . . 0.0 110.813 178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -65.52 -28.71 69.38 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 178.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -64.3 -44.57 91.21 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 179.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -65.58 -37.33 86.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.916 -178.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.03 -45.48 92.1 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 120.96 0.409 . . . . 0.0 110.727 178.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 53.9 tp60 -63.7 -46.08 87.11 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.218 178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 84.1 mtp -64.33 -29.46 70.54 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 122.089 -0.382 . . . . 0.0 110.947 179.534 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -34.9 79.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.716 -0.615 . . . . 0.0 110.672 178.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -66.45 -47.18 73.96 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -67.09 -38.88 86.46 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.541 0.686 . . . . 0.0 110.401 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 72.4 ttt-85 -60.64 -44.19 96.69 Favored 'General case' 0 C--O 1.209 -1.049 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 177.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 20.5 t80 -61.87 -43.35 99.02 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.886 0.374 . . . . 0.0 111.995 179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 36.6 mt -64.2 -33.77 76.55 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.856 0.36 . . . . 0.0 110.472 -179.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -75.97 -35.26 59.71 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.751 0.786 . . . . 0.0 111.523 175.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -62.13 -43.57 98.55 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 124.041 0.936 . . . . 0.0 113.341 -176.487 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 4.3 p -57.4 -43.43 82.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.86 -176.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -73.91 -39.87 63.55 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 121.657 -0.652 . . . . 0.0 110.117 178.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -62.81 -30.02 71.16 Favored 'General case' 0 C--O 1.219 -0.546 0 O-C-N 121.633 -0.667 . . . . 0.0 111.871 -179.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -58.63 -28.64 65.84 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 118.767 0.712 . . . . 0.0 111.203 178.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 65.2 mm-40 -63.36 -35.98 82.2 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 118.265 0.484 . . . . 0.0 110.19 179.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -76.97 -51.01 11.9 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -56.26 -38.43 71.14 Favored 'General case' 0 C--O 1.217 -0.614 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 -175.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 55.6 mtp180 -57.11 -26.62 60.78 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.8 0.667 . . . . 0.0 112.8 179.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 8.2 mptt -77.7 -44.67 27.17 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 121.453 -0.779 . . . . 0.0 110.214 173.78 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.34 -25.42 61.54 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 117.055 2.242 . . . . 0.0 117.055 -174.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -55.73 -24.33 34.28 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 114.658 1.355 . . . . 0.0 114.658 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.68 -20.71 65.92 Favored 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 177.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -86.61 58.04 4.84 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.493 0.664 . . . . 0.0 111.285 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.424 HG23 ' H ' ' A' ' 171' ' ' VAL . 0.1 OUTLIER -64.97 133.76 30.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.86 -178.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -155.47 155.18 33.04 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 113.407 0.891 . . . . 0.0 113.407 179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -155.55 161.35 40.89 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -159.42 90.17 0.94 Allowed 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 152.41 -178.01 29.84 Favored Glycine 0 C--O 1.229 -0.19 0 C-N-CA 120.951 -0.642 . . . . 0.0 112.106 177.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 13.2 tttt -147.02 140.99 25.94 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 178.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -88.66 -165.12 1.25 Allowed 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 105.404 -2.073 . . . . 0.0 105.404 175.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 54.28 66.6 1.19 Allowed 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 173.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 49.4 ttt85 -77.31 -41.78 39.33 Favored 'General case' 0 C--O 1.214 -0.771 0 O-C-N 121.416 -0.802 . . . . 0.0 110.628 177.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 40.84 91.17 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.947 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -173.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -144.1 39.11 1.32 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.42 -175.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 33.1 tp -104.22 145.85 29.62 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.21 0.529 . . . . 0.0 111.523 -178.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 8.6 p90 -161.85 166.12 26.78 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 105.341 -2.096 . . . . 0.0 105.341 -177.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -144.22 159.01 43.4 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 178.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.252 1.191 0 N-CA-C 103.986 -2.598 . . . . 0.0 103.986 178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 42.4 ttm . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 55.86 40.86 30.57 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 119.335 0.971 . . . . 0.0 113.597 176.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.1 tt -55.98 -41.58 75.01 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 113.065 0.765 . . . . 0.0 113.065 -176.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 53.6 tp -54.32 -35.25 62.47 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-O 121.609 0.718 . . . . 0.0 112.299 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 61.9 mt-10 -57.12 -25.03 58.15 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -178.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.8 t80 -51.81 -50.46 60.77 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 118.602 0.637 . . . . 0.0 110.714 177.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.0 m -68.56 -39.61 80.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.2 -178.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 79.8 t80 -58.76 -57.29 13.66 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.808 -0.633 . . . . 0.0 112.113 179.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.401 ' CZ3' HD11 ' A' ' 31' ' ' ILE . 98.3 m95 -70.34 -31.55 68.88 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -70.09 -35.12 73.94 Favored 'General case' 0 C--O 1.217 -0.637 0 C-N-CA 118.644 -1.222 . . . . 0.0 109.183 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 125' ' ' LEU . 1.2 mm -65.0 -44.78 95.98 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 176.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.16 -42.04 80.31 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.33 -41.28 98.89 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.1 m-70 -62.73 -45.75 91.29 Favored 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -66.84 -51.89 50.17 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.194 -176.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 75.7 t -56.28 -43.09 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.927 0.394 . . . . 0.0 110.306 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -71.28 -18.24 62.43 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.109 -0.994 . . . . 0.0 112.362 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.9 t -88.08 9.51 22.32 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 122.967 0.507 . . . . 0.0 110.734 177.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.28 0.24 57.03 Favored Glycine 0 CA--C 1.517 0.205 0 N-CA-C 116.135 1.214 . . . . 0.0 116.135 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.408 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 22.8 m-85 -69.93 107.43 3.57 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 177.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.73 133.26 34.88 Favored Glycine 0 CA--C 1.511 -0.211 0 C-N-CA 120.672 -0.775 . . . . 0.0 111.212 -177.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.5 t -75.95 125.02 35.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.518 HD11 HD22 ' A' ' 43' ' ' LEU . 52.4 mt -93.91 -46.05 13.69 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 178.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -147.79 133.37 18.78 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 114.968 -1.015 . . . . 0.0 109.409 -178.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 149.41 42.92 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 101.203 -3.629 . . . . 0.0 101.203 173.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.25 20.23 33.41 Favored Glycine 0 C--O 1.225 -0.426 0 C-N-CA 120.416 -0.897 . . . . 0.0 110.957 -178.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -76.0 -174.07 2.55 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 105.037 -2.209 . . . . 0.0 105.037 174.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -54.28 41.79 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-O 121.198 0.523 . . . . 0.0 110.231 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -139.22 -11.12 1.25 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.263 173.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -90.19 164.71 14.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 116.934 2.198 . . . . 0.0 116.934 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.401 HD11 ' CZ3' ' A' ' 9' ' ' TRP . 52.1 mt -135.58 126.29 43.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 106.635 -1.617 . . . . 0.0 106.635 175.729 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 76.8 m95 -105.9 132.87 51.48 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 178.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.408 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 4.2 mp -133.72 145.16 49.62 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 -177.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -98.66 150.14 22.08 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 173.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.86 125.64 88.02 Favored Pre-proline 0 CA--C 1.544 0.75 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 -179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -72.63 -29.06 13.47 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 116.939 -1.574 . . . . 0.0 113.242 -179.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -73.52 -19.42 60.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.847 0.356 . . . . 0.0 110.744 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 47.1 mttm 53.89 43.34 31.04 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 123.103 1.43 . . . . 0.0 110.045 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 65.2 p -69.73 -177.71 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 112.237 -2.256 . . . . 0.0 108.737 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 74.8 m -46.82 -33.07 4.14 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 175.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.09 113.47 21.06 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 106.651 -1.611 . . . . 0.0 106.651 172.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -78.48 -44.86 23.48 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.359 -179.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.518 HD22 HD11 ' A' ' 23' ' ' ILE . 24.4 mt -137.35 166.17 24.46 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.502 0.556 . . . . 0.0 112.502 -173.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.2 t -134.55 139.74 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.791 0.837 . . . . 0.0 109.497 179.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.0 ttp180 -120.34 124.27 45.14 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 tp -91.77 130.17 37.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 104.264 -2.495 . . . . 0.0 104.264 174.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -136.49 139.79 42.56 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.3 pttp -125.72 103.12 7.65 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 118.775 0.716 . . . . 0.0 111.906 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -149.05 138.81 21.91 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -178.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -88.31 145.78 25.66 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 178.425 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.498 HD13 ' HG2' ' A' ' 57' ' ' MET . 7.2 mt -129.02 126.24 39.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 120.46 0.171 . . . . 0.0 111.085 -173.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.4 t0 -90.17 -38.15 13.69 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.674 0.749 . . . . 0.0 110.637 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -133.42 151.27 51.79 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.787 -179.071 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HD2' HD11 ' A' ' 99' ' ' ILE . 21.4 ptt-85 -65.34 -18.14 65.08 Favored 'General case' 0 N--CA 1.47 0.547 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -64.53 -33.33 75.65 Favored 'General case' 0 C--O 1.215 -0.72 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.787 -178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -69.29 -40.37 77.77 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.498 ' HG2' HD13 ' A' ' 51' ' ' LEU . 91.8 mtp -55.92 -47.95 76.57 Favored 'General case' 0 C--O 1.218 -0.576 0 CA-C-N 116.626 -0.261 . . . . 0.0 111.149 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.7 m -64.15 -31.21 52.44 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 120.617 -0.433 . . . . 0.0 111.682 -178.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 3.9 mmp_? -71.13 -41.37 70.6 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 -178.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 75.8 m-20 -57.46 -43.65 84.15 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.164 0.507 . . . . 0.0 110.629 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -68.03 -30.65 48.84 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 C-N-CA 120.134 -0.626 . . . . 0.0 111.423 -176.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.36 -33.94 73.82 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.024 -0.67 . . . . 0.0 109.92 -179.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -73.71 -43.75 58.36 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -54.38 -39.1 66.89 Favored 'General case' 0 C--O 1.207 -1.146 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 175.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.99 -39.29 93.79 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-N 119.042 0.837 . . . . 0.0 110.791 178.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 10.2 tm-20 -67.97 -42.39 80.95 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.516 0.674 . . . . 0.0 109.379 177.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.6 tpt180 -59.18 -42.38 90.68 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 177.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.0 t -67.6 -36.9 77.65 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.975 0 CA-C-O 118.833 -0.603 . . . . 0.0 110.558 179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -58.0 -42.59 85.5 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 119.951 1.25 . . . . 0.0 109.391 177.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.7 mtp180 -65.91 -48.41 71.51 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.328 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.0 t -66.17 -35.8 75.89 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 121.264 0.554 . . . . 0.0 110.346 -179.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.61 -43.91 96.9 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 121.558 -0.714 . . . . 0.0 110.037 178.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -67.61 -39.3 84.75 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.031 -0.268 . . . . 0.0 110.396 178.352 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -59.91 -40.36 88.56 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.825 0.345 . . . . 0.0 111.477 178.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -91.83 0.54 57.48 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 112.26 0.467 . . . . 0.0 112.26 -179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.85 19.71 65.72 Favored Glycine 0 CA--C 1.523 0.563 0 N-CA-C 115.746 1.058 . . . . 0.0 115.746 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 94.9 mtt-85 -77.93 142.58 38.3 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.684 -0.892 . . . . 0.0 110.698 -176.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -63.65 -40.48 96.96 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 122.13 -0.356 . . . . 0.0 111.182 -178.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 6.3 ptt-85 -144.91 160.37 41.41 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 102.09 -3.3 . . . . 0.0 102.09 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -135.09 145.9 48.37 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-N 119.568 1.076 . . . . 0.0 110.895 175.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 110' ' ' SER . 40.2 tttp -123.62 127.82 48.8 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 123.666 0.604 . . . . 0.0 109.671 174.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -122.5 132.64 54.43 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.814 -175.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 61.9 tp -92.79 123.66 36.22 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.587 -1.634 . . . . 0.0 106.587 174.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 12.8 t30 -115.6 108.5 16.49 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.3 t -105.08 112.92 40.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 123.107 0.254 . . . . 0.0 111.46 -176.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.41 135.16 35.64 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 175.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -110.92 117.84 34.47 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 105.5 -2.037 . . . . 0.0 105.5 172.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 67.9 p -132.87 168.39 18.5 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 -176.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 4.4 t -92.55 -28.95 16.44 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -146.64 161.73 39.94 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.36 149.88 39.13 Favored Pre-proline 0 C--N 1.32 -0.708 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 -177.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -64.35 151.14 86.67 Favored 'Trans proline' 0 C--N 1.346 0.418 0 O-C-N 122.34 0.652 . . . . 0.0 112.562 177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.0 m -77.76 -12.7 13.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 119.096 2.998 . . . . 0.0 119.096 -169.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -119.82 101.66 8.04 Favored 'General case' 0 C--O 1.216 -0.684 0 N-CA-C 117.404 2.372 . . . . 0.0 117.404 -173.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 44.52 28.66 0.33 Allowed 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 117.703 2.483 . . . . 0.0 117.703 172.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.3 p-90 -63.11 -21.75 66.39 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -176.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -61.72 -31.27 71.42 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 121.746 -0.596 . . . . 0.0 110.774 -177.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -63.5 -28.09 69.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.082 176.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.474 HD11 ' HD2' ' A' ' 54' ' ' ARG . 7.4 mm -73.59 -35.81 45.7 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.519 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -178.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.56 -30.75 71.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.444 0.64 . . . . 0.0 111.114 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.3 mtpt -73.65 -24.42 59.99 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.293 0.568 . . . . 0.0 111.358 178.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 75.5 mttt -85.16 99.36 11.02 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 115.467 1.654 . . . . 0.0 115.467 -171.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 59.6 m -68.26 122.58 18.64 Favored 'General case' 0 CA--C 1.508 -0.66 0 N-CA-C 103.109 -2.923 . . . . 0.0 103.109 171.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 32.8 t80 -82.88 120.66 25.96 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -118.76 128.18 54.24 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 122.079 0.943 . . . . 0.0 110.474 -179.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -130.75 75.57 1.67 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.246 -1.343 . . . . 0.0 107.773 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 67.02 -112.63 5.0 Favored Glycine 0 C--O 1.219 -0.831 0 C-N-CA 120.198 -1.001 . . . . 0.0 110.703 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 32.1 p -84.49 16.99 2.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -179.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 78.7 t -121.64 140.73 44.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.447 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 7.9 p -134.88 137.71 43.47 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 171.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 58.4 t -134.01 130.05 54.82 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.724 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -99.09 110.76 59.05 Favored Pre-proline 0 N--CA 1.432 -1.361 0 CA-C-N 114.424 -1.262 . . . . 0.0 107.979 -179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -79.64 149.95 21.32 Favored 'Trans proline' 0 C--N 1.347 0.486 0 C-N-CA 117.417 -1.255 . . . . 0.0 111.597 179.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.84 150.69 29.59 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 106.031 -1.84 . . . . 0.0 106.031 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 17.9 tt -145.89 137.36 19.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 107.918 -1.142 . . . . 0.0 107.918 -178.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.0 m -119.83 133.79 65.48 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.788 0 N-CA-C 103.559 -2.756 . . . . 0.0 103.559 175.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.38 136.21 53.9 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.851 -0.426 . . . . 0.0 109.851 -176.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -45.58 -43.35 10.95 Favored Glycine 0 N--CA 1.461 0.318 0 N-CA-C 116.915 1.526 . . . . 0.0 116.915 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.405 HG22 ' H ' ' A' ' 119' ' ' THR . 0.2 OUTLIER -53.25 -29.93 35.48 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -178.565 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.9 ptm -140.6 30.84 1.88 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 122.664 1.221 . . . . 0.0 109.624 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 25.6 tp -51.06 -37.81 47.81 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -174.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 35.5 ptt180 -58.39 -40.83 83.43 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.621 -178.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -78.44 -43.37 27.42 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.808 0.813 . . . . 0.0 111.105 179.189 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -59.66 -43.37 93.96 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-O 121.991 0.901 . . . . 0.0 112.196 -177.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.479 HD12 ' CD2' ' A' ' 132' ' ' PHE . 1.2 tm? -65.01 -42.06 94.79 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.46 -0.791 . . . . 0.0 111.27 -175.186 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -74.78 -18.39 60.48 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.72 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.72 -36.26 65.18 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 177.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 59.5 t -85.59 -40.19 14.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 CA-C-O 121.427 0.632 . . . . 0.0 110.117 179.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -124.91 82.26 61.17 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.122 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_endo -68.92 -4.54 13.65 Favored 'Trans proline' 0 C--N 1.347 0.462 0 N-CA-C 114.919 1.084 . . . . 0.0 114.919 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 35.4 p -80.53 -8.18 59.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.367 0.603 . . . . 0.0 109.628 175.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . 0.479 ' CD2' HD12 ' A' ' 125' ' ' LEU . 71.2 t80 -86.15 124.93 33.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.697 -179.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 50.6 mtp180 -78.61 97.24 5.73 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 176.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.8 t -67.23 -19.53 65.55 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 176.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 33.1 mt-10 -62.01 -36.4 81.45 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.485 176.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -82.93 -23.36 33.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 122.34 1.067 . . . . 0.0 110.51 -176.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 8.1 t -93.68 68.16 3.96 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.076 -0.966 . . . . 0.0 112.121 -175.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 85.3 p -66.06 158.15 29.16 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 175.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -62.41 -33.35 74.61 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.381 0.61 . . . . 0.0 110.67 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 54.0 mm-40 -63.93 -24.9 67.91 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.549 0.69 . . . . 0.0 112.065 178.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.1 t-160 -79.4 -11.83 59.91 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.212 0.53 . . . . 0.0 110.392 -176.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -102.62 40.96 1.28 Allowed 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.553 0.945 . . . . 0.0 113.553 -175.397 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 24.2 p -68.3 160.11 30.02 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 119.654 -0.818 . . . . 0.0 110.116 178.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 29.9 p90 -64.81 -28.86 69.86 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 121.631 -0.668 . . . . 0.0 111.324 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -69.33 -41.23 76.93 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 178.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -62.97 -33.7 75.94 Favored 'General case' 0 C--O 1.219 -0.55 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 177.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.68 -44.68 95.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.19 0.519 . . . . 0.0 111.117 177.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.36 -44.23 92.07 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.675 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 48.7 mtp -69.03 -28.89 66.97 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.62 -39.02 92.49 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.901 -0.499 . . . . 0.0 110.222 179.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 53.9 ttt180 -64.99 -46.73 80.21 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -60.33 -45.6 92.86 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 122.241 1.019 . . . . 0.0 110.373 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 22.2 ttm180 -65.48 -33.86 76.92 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.135 -179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.3 -42.75 92.74 Favored 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 121.224 -0.19 . . . . 0.0 110.905 177.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -60.18 -41.0 91.96 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 28.0 m -67.09 -35.36 79.64 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.562 0.696 . . . . 0.0 111.019 178.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.5 tt -70.18 -33.76 72.13 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.235 0.457 . . . . 0.0 112.235 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 39.9 t -58.36 -44.44 88.49 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 178.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -68.81 -37.84 79.49 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.475 -0.49 . . . . 0.0 109.928 178.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 73.2 tttt -58.09 -29.96 65.87 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 119.168 -0.444 . . . . 0.0 111.381 176.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -54.86 -31.82 60.08 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 118.394 0.543 . . . . 0.0 111.005 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -59.73 -45.21 92.88 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.745 -0.597 . . . . 0.0 111.919 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 27.8 tp10 -79.13 -32.65 44.51 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.625 0.726 . . . . 0.0 111.439 176.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.4 tm0? -61.38 -39.18 89.73 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 121.964 -0.46 . . . . 0.0 110.859 -179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -62.53 -17.75 60.5 Favored 'General case' 0 C--O 1.217 -0.641 0 N-CA-C 113.901 1.075 . . . . 0.0 113.901 -178.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -62.71 -17.84 61.44 Favored 'General case' 0 N--CA 1.478 0.931 0 CA-C-O 120.973 0.416 . . . . 0.0 111.331 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 36.4 p -63.04 -13.68 38.67 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.231 0.826 . . . . 0.0 113.231 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 1.2 pp20? -53.2 -24.48 11.09 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 114.435 1.272 . . . . 0.0 114.435 179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -67.14 -14.15 62.63 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -78.73 139.61 38.42 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.28 121.41 17.49 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -148.11 -174.79 4.67 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.489 -176.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -146.73 160.83 41.74 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.459 -0.941 . . . . 0.0 108.459 -179.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -133.66 169.64 16.72 Favored 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 123.065 0.546 . . . . 0.0 109.975 -176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 158.93 165.58 16.28 Favored Glycine 0 C--O 1.224 -0.492 0 C-N-CA 121.072 -0.585 . . . . 0.0 113.007 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.99 132.34 28.4 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 179.301 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 94.3 mt -85.39 153.48 22.49 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 103.617 -2.735 . . . . 0.0 103.617 174.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 70.2 148.57 0.08 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 124.385 1.053 . . . . 0.0 111.629 -178.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 26.9 ttm180 -145.02 87.64 1.84 Allowed 'General case' 0 CA--C 1.534 0.348 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -176.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 65.71 169.08 0.21 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 114.074 1.139 . . . . 0.0 114.074 174.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -135.4 162.44 32.6 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -177.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 53.8 tp -142.01 141.55 32.85 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 178.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -68.56 -27.88 66.46 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -176.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER 65.3 150.97 0.05 OUTLIER 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 114.347 1.239 . . . . 0.0 114.347 -178.808 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 . . . . . 0 C--O 1.246 0.878 0 N-CA-C 105.616 -1.994 . . . . 0.0 105.616 -179.453 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.8 tpt . . . . . 0 N--CA 1.488 1.456 0 CA-C-O 119.044 -0.503 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -72.78 36.88 0.08 Allowed 'General case' 0 CA--C 1.548 0.883 0 N-CA-C 117.344 2.35 . . . . 0.0 117.344 -175.082 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.47 -41.39 80.25 Favored 'General case' 0 N--CA 1.471 0.62 0 O-C-N 121.107 -0.996 . . . . 0.0 110.276 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 76.3 mt -66.35 -39.74 89.38 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 -179.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -64.24 -38.15 90.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.712 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 90.3 t80 -62.24 -46.18 90.01 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 23.5 m -65.16 -43.23 92.45 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.047 0.451 . . . . 0.0 110.519 -179.389 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.63 -53.94 51.76 Favored 'General case' 0 C--N 1.323 -0.571 0 C-N-CA 123.384 0.673 . . . . 0.0 111.156 179.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -69.8 -27.41 64.87 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.956 -0.465 . . . . 0.0 111.679 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -71.13 -36.85 72.26 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 121.745 -0.597 . . . . 0.0 111.881 176.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 19.4 mm -67.84 -45.9 83.29 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 176.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.86 -45.86 74.61 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 178.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.42 -45.9 91.96 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -68.39 -34.74 76.58 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.037 -0.665 . . . . 0.0 110.684 -176.493 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -71.07 -52.18 20.92 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.016 -0.274 . . . . 0.0 111.531 178.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 25.0 m -60.1 -32.84 51.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.828 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.0 t30 -67.99 -23.96 65.08 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.977 0.417 . . . . 0.0 110.723 179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.7 t -89.17 9.82 24.21 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.809 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.73 2.68 59.73 Favored Glycine 0 C--O 1.227 -0.293 0 N-CA-C 115.612 1.005 . . . . 0.0 115.612 176.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.46 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 15.5 m-85 -72.31 99.76 2.48 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 118.064 0.932 . . . . 0.0 109.402 178.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -63.76 134.36 40.99 Favored Glycine 0 CA--C 1.512 -0.125 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.819 -177.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 95.2 t -77.23 124.26 35.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 79.3 mt -90.09 -43.58 14.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 107.553 -1.277 . . . . 0.0 107.553 178.586 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 59.5 tt0 -150.13 127.33 11.31 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-N 115.393 -0.821 . . . . 0.0 110.402 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.37 131.68 26.68 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 102.993 -2.966 . . . . 0.0 102.993 170.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -152.7 -88.54 0.07 OUTLIER Glycine 0 CA--C 1.507 -0.454 0 N-CA-C 110.067 -1.213 . . . . 0.0 110.067 178.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -68.61 157.44 36.12 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 176.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 14.1 t -75.2 -3.48 33.27 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 120.81 0.338 . . . . 0.0 111.724 -176.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -80.1 -36.48 35.34 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -177.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -140.45 144.51 36.13 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 116.236 1.939 . . . . 0.0 116.236 -176.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 87.7 mt -139.31 132.24 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 108.116 -1.068 . . . . 0.0 108.116 176.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 84.7 m95 -105.22 134.33 48.51 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 176.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -129.72 139.75 51.26 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 122.927 0.491 . . . . 0.0 110.294 178.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -86.93 140.47 29.58 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -92.44 105.61 14.96 Favored Pre-proline 0 CA--C 1.553 1.068 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 91.9 Cg_endo -72.76 -17.29 25.99 Favored 'Trans proline' 0 C--N 1.352 0.729 0 CA-C-N 118.431 0.475 . . . . 0.0 112.991 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -67.47 -16.41 64.2 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.751 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 73.9 mttt 54.49 42.37 31.38 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 122.67 1.224 . . . . 0.0 108.823 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 51.4 p -72.78 -175.04 1.59 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 112.884 -1.962 . . . . 0.0 109.637 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 18.5 m -52.35 -31.71 34.83 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.769 175.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 3.9 m-70 -98.66 136.25 38.99 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 123.043 0.537 . . . . 0.0 109.62 179.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -83.34 -33.75 25.8 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 79.9 mt -135.01 158.03 45.39 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.619 -176.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 98.9 t -133.21 141.7 43.96 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 106.39 -1.707 . . . . 0.0 106.39 177.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -138.5 150.71 46.68 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.247 0.546 . . . . 0.0 111.079 175.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.1 mt -113.98 135.96 53.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 106.115 -1.809 . . . . 0.0 106.115 179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.1 t80 -136.47 129.92 31.81 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 123.261 0.35 . . . . 0.0 110.214 179.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -106.11 114.84 29.21 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -179.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -151.76 150.4 30.14 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 177.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -118.85 139.56 51.41 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 103.601 -2.74 . . . . 0.0 103.601 176.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -152.22 144.45 23.94 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 112.395 0.517 . . . . 0.0 112.395 -173.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -82.03 -35.15 29.1 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 114.597 1.332 . . . . 0.0 114.597 -176.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -133.3 154.52 50.63 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -174.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.461 ' HD2' HD11 ' A' ' 99' ' ' ILE . 28.5 ptt-85 -62.9 -17.87 62.28 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 114.055 1.131 . . . . 0.0 114.055 -177.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.4 pt20 -61.77 -33.34 73.92 Favored 'General case' 0 C--O 1.217 -0.606 0 C-N-CA 120.635 -0.426 . . . . 0.0 110.622 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -72.53 -39.1 67.8 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 177.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 2.0 ttp -61.84 -45.81 92.17 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.586 -179.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 22.6 m -67.41 -33.35 61.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 120.281 -0.567 . . . . 0.0 110.22 179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 10.0 mmm180 -65.05 -39.87 93.95 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.758 -178.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -57.87 -43.49 86.01 Favored 'General case' 0 C--N 1.322 -0.588 0 O-C-N 123.172 0.295 . . . . 0.0 110.421 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mt -74.07 -35.59 41.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 O-C-N 121.761 -0.587 . . . . 0.0 111.341 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -58.3 -39.0 78.19 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.353 -0.98 . . . . 0.0 108.353 178.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -76.61 -40.76 48.44 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.069 -0.968 . . . . 0.0 110.571 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -59.51 -43.56 93.34 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.61 178.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.21 -33.93 76.56 Favored 'General case' 0 C--O 1.209 -1.036 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.66 -178.157 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 21.6 tp10 -64.19 -41.73 96.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.584 0.707 . . . . 0.0 109.75 178.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -63.61 -46.21 86.78 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.304 0.574 . . . . 0.0 109.697 177.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 77.4 t -65.24 -38.23 82.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.908 -177.745 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -58.6 -43.03 89.41 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.3 tpt180 -64.47 -42.05 96.15 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.803 -0.359 . . . . 0.0 111.177 -179.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 89.9 t -65.7 -39.47 84.98 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 178.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.619 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.3 OUTLIER -61.93 -44.95 95.7 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.561 -0.712 . . . . 0.0 111.95 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 56.3 m80 -64.44 -31.54 72.79 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.484 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -66.73 -24.21 66.2 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 120.914 0.387 . . . . 0.0 111.325 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.7 mp -100.68 -17.64 16.9 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 -178.202 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.52 6.94 59.89 Favored Glycine 0 CA--C 1.523 0.594 0 CA-C-O 121.574 0.541 . . . . 0.0 113.93 -178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 -71.37 140.8 50.31 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 106.447 -1.686 . . . . 0.0 106.447 -179.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -59.14 -47.01 86.84 Favored 'General case' 0 N--CA 1.479 0.996 0 N-CA-C 116.861 2.171 . . . . 0.0 116.861 -170.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -153.97 153.72 32.49 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 118.675 0.671 . . . . 0.0 110.609 178.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.469 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -102.19 164.13 11.86 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.654 0.782 . . . . 0.0 112.716 -178.349 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.6 mptt -148.2 129.01 14.28 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 101.389 -3.56 . . . . 0.0 101.389 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -139.57 128.11 22.99 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 -174.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 63.6 tp -91.43 121.16 32.9 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 176.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -115.16 108.62 16.86 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 179.184 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 12.4 t -101.69 113.06 36.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 112.484 0.55 . . . . 0.0 112.484 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -82.14 143.51 31.4 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 175.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -123.25 117.35 25.09 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 173.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 12.1 m -135.59 158.31 44.7 Favored 'General case' 0 C--N 1.327 -0.372 0 O-C-N 123.447 0.467 . . . . 0.0 111.522 -174.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 52.3 m -68.16 -49.16 62.77 Favored 'General case' 0 CA--C 1.508 -0.665 0 CA-C-O 121.885 0.85 . . . . 0.0 108.844 176.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -144.31 158.77 43.56 Favored 'General case' 0 N--CA 1.438 -1.062 0 N-CA-C 103.142 -2.91 . . . . 0.0 103.142 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.76 155.94 53.0 Favored Pre-proline 0 C--N 1.312 -1.06 0 CA-C-N 115.437 -0.802 . . . . 0.0 109.959 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -63.61 154.11 70.96 Favored 'Trans proline' 0 C--N 1.346 0.404 0 O-C-N 122.208 0.583 . . . . 0.0 112.789 177.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 32.6 m -88.26 10.52 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 N-CA-C 114.943 1.46 . . . . 0.0 114.943 -173.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -121.83 83.49 2.1 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 114.449 1.278 . . . . 0.0 114.449 -172.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 37.3 m-20 31.09 45.0 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 118.005 2.594 . . . . 0.0 118.005 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 53.8 p-90 -70.01 -15.37 63.01 Favored 'General case' 0 C--N 1.32 -0.682 0 O-C-N 121.43 -0.794 . . . . 0.0 111.48 179.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 88.0 mt-10 -64.38 -29.67 70.74 Favored 'General case' 0 C--N 1.323 -0.563 0 O-C-N 121.664 -0.648 . . . . 0.0 109.687 -178.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.444 ' HA ' ' HE2' ' A' ' 101' ' ' LYS . 78.0 mm-40 -67.29 -18.32 65.14 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.635 175.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.461 HD11 ' HD2' ' A' ' 54' ' ' ARG . 10.1 mm -87.16 -38.4 12.11 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.667 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -179.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -59.04 -39.57 82.39 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.419 0.628 . . . . 0.0 112.477 -177.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.444 ' HE2' ' HA ' ' A' ' 98' ' ' GLU . 48.0 pttt -89.63 3.79 51.49 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.763 -178.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -102.22 107.19 18.17 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.805 -177.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.5 m -68.31 123.19 20.07 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 105.502 -2.036 . . . . 0.0 105.502 175.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -85.65 125.35 33.09 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 178.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -125.89 127.32 45.82 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-O 121.688 0.756 . . . . 0.0 109.496 -179.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -143.72 113.12 6.92 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.745 -1.116 . . . . 0.0 108.249 -178.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 55.39 -126.28 38.8 Favored Glycine 0 C--O 1.24 0.502 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.294 178.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.2 p -84.55 15.2 3.9 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.22 -0.49 . . . . 0.0 111.527 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 4.4 t -119.29 148.77 22.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.309 0.576 . . . . 0.0 112.216 -178.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 23.7 t -139.31 140.07 37.48 Favored 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 100.598 -3.853 . . . . 0.0 100.598 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 75.8 t -136.29 133.94 49.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -101.07 111.68 63.82 Favored Pre-proline 0 C--O 1.244 0.781 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 174.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -78.2 153.37 28.09 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 117.058 -1.495 . . . . 0.0 111.376 176.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.61 151.63 34.1 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 105.528 -2.027 . . . . 0.0 105.528 176.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 14.2 tt -147.61 137.56 16.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 98.1 t -116.87 107.9 23.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 106.499 -1.667 . . . . 0.0 106.499 177.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.21 141.17 28.86 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 107.521 -1.288 . . . . 0.0 107.521 177.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.65 -19.9 61.04 Favored Glycine 0 C--O 1.228 -0.28 0 N-CA-C 114.435 0.534 . . . . 0.0 114.435 -177.265 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 38.8 p -62.69 -29.47 70.67 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.631 0.975 . . . . 0.0 113.631 -178.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 22.8 ptm -144.42 40.55 1.33 Allowed 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -48.05 -43.63 30.57 Favored 'General case' 0 C--O 1.208 -1.087 0 N-CA-C 115.828 1.788 . . . . 0.0 115.828 -173.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.43 -43.8 97.96 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 119.069 0.849 . . . . 0.0 111.844 -176.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -73.68 -39.13 64.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 120.911 0.386 . . . . 0.0 111.232 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -65.47 -39.76 92.34 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.492 0.663 . . . . 0.0 110.445 178.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -63.71 -49.41 73.21 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.019 -176.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -70.49 -15.45 62.8 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 120.622 -0.431 . . . . 0.0 111.881 -177.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.36 -32.61 64.61 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 176.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 31.7 t -91.86 -44.64 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 CA-C-O 121.458 0.647 . . . . 0.0 110.689 179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -124.97 77.98 66.21 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.123 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -70.2 -6.64 19.3 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 118.611 -0.459 . . . . 0.0 112.476 178.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 49.2 p -88.11 -5.72 58.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.677 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -79.2 124.15 28.08 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 179.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -85.23 99.94 11.44 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.649 -179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 23.2 p -68.41 -23.82 64.68 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 176.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -68.27 -38.19 81.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.415 178.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -69.32 -31.53 70.06 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 5.8 p -169.1 127.2 0.99 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.962 -0.563 . . . . 0.0 112.501 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 90.8 p -126.48 163.04 24.23 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 177.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.09 -25.17 62.5 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -63.6 -32.21 73.61 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.083 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -98.67 24.52 7.42 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.494 0.664 . . . . 0.0 109.979 179.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -127.27 -163.51 1.26 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.795 0.807 . . . . 0.0 110.477 -178.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 99.4 p -154.16 168.07 27.76 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 104.163 -2.532 . . . . 0.0 104.163 179.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -66.71 -28.96 68.85 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 120.203 -0.599 . . . . 0.0 110.475 178.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -67.78 -33.5 74.95 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.985 0.898 . . . . 0.0 109.89 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -60.77 -24.39 65.74 Favored 'General case' 0 C--O 1.22 -0.5 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.488 179.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.84 95.29 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 117.731 0.241 . . . . 0.0 110.629 178.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 4.6 tp-100 -64.25 -44.82 90.6 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 179.108 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 41.7 mtm -62.76 -29.97 71.09 Favored 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.862 179.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -67.69 -41.3 83.84 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 177.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -64.8 -45.72 85.08 Favored 'General case' 0 CA--C 1.513 -0.449 0 CA-C-O 120.623 0.249 . . . . 0.0 110.426 177.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -60.03 -44.32 94.7 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.317 0.579 . . . . 0.0 110.556 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 80.3 mtm180 -69.78 -28.53 65.82 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 122.083 -0.385 . . . . 0.0 111.071 178.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -66.45 -37.48 85.24 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 110.039 -0.356 . . . . 0.0 110.039 177.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.13 -34.68 78.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.83 0.347 . . . . 0.0 110.127 178.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 12.5 m -74.23 -38.02 63.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.678 0.751 . . . . 0.0 110.551 175.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 57.5 tp -66.65 -39.92 88.46 Favored 'General case' 0 C--O 1.216 -0.695 0 N-CA-C 113.531 0.937 . . . . 0.0 113.531 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.6 p -60.61 -34.84 60.07 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.5 0 CA-C-N 118.934 0.788 . . . . 0.0 110.278 -178.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -71.49 -41.09 69.73 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.175 -0.953 . . . . 0.0 108.914 176.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -64.17 -26.04 68.35 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.628 -0.67 . . . . 0.0 110.948 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.88 -28.61 51.58 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 121.848 -0.532 . . . . 0.0 111.368 178.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -62.81 -34.31 77.03 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.252 0.549 . . . . 0.0 110.294 178.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -76.06 -43.44 43.73 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -60.83 -32.76 72.14 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.021 0.748 . . . . 0.0 113.021 -176.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 67.1 mtp180 -57.36 -17.73 13.98 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 114.217 1.191 . . . . 0.0 114.217 -178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 41.4 pttt -58.75 -16.82 18.47 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.423 0.527 . . . . 0.0 112.423 177.427 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 21.5 p -62.66 -17.76 61.09 Favored 'General case' 0 C--O 1.22 -0.494 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 177.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.48 -22.76 63.88 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 118.231 0.468 . . . . 0.0 111.68 178.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -72.87 -14.21 61.44 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -104.85 137.68 42.26 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 -178.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 21.9 t -88.67 93.3 4.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.059 0.457 . . . . 0.0 112.056 -176.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 41.2 p90 -156.95 162.12 39.62 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 174.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -164.02 -62.59 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 105.771 -1.937 . . . . 0.0 105.771 177.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 3.4 m120 58.66 19.26 6.59 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 174.12 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -94.67 166.81 26.66 Favored Glycine 0 N--CA 1.454 -0.161 0 N-CA-C 111.427 -0.669 . . . . 0.0 111.427 178.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 14.6 tmtt? -141.38 134.05 28.61 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.571 -1.27 . . . . 0.0 107.571 178.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.5 mp -130.84 161.27 32.16 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -152.93 157.56 40.8 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 103.837 -2.653 . . . . 0.0 103.837 177.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 43.0 ttt-85 -155.9 146.24 21.7 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 -177.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -70.88 160.05 33.51 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -154.74 153.57 31.46 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.509 ' HG ' ' H ' ' A' ' 184' ' ' PHE . 28.5 tp -151.29 146.36 25.98 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 -178.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 50.6 p90 -72.19 -18.71 61.83 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . 0.509 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 1.3 t80 66.22 167.15 0.21 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 125.061 1.344 . . . . 0.0 114.217 178.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.9 0 CA-C-O 116.141 -1.885 . . . . 0.0 106.402 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 mtt . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.87 0.366 . . . . 25.0 110.866 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -150.04 150.66 32.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.882 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.54 -42.85 71.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 25.0 110.979 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.4 mt -61.38 -35.91 78.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.21 -0.45 . . . . 25.0 110.884 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -51.96 -39.9 60.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.799 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 58.5 t80 -52.08 -39.54 59.9 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.87 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.928 HG21 HD21 ' A' ' 121' ' ' LEU . 0.2 OUTLIER -70.44 -54.31 12.89 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.092 -0.503 . . . . 25.0 111.118 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -51.9 -43.98 63.59 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.249 -0.432 . . . . 25.0 110.914 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 77.3 m95 -71.98 -34.65 69.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.93 179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -55.34 28.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.908 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.452 HG22 HD23 ' A' ' 15' ' ' LEU . 42.1 mm -59.72 -37.4 70.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.251 -0.431 . . . . 25.0 111.093 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.26 -53.74 32.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.193 -0.458 . . . . 25.0 111.107 179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.444 ' HB1' HD22 ' A' ' 157' ' ' LEU . . . -60.01 -35.63 75.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.41 . . . . 25.0 111.089 179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.8 t60 -61.27 -54.97 37.32 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.865 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.62 ' HB3' HD22 ' A' ' 33' ' ' LEU . 4.3 mm? -56.07 -55.31 34.48 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.932 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.549 HG12 ' HG2' ' A' ' 161' ' ' GLN . 95.1 t -53.27 -51.88 36.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.229 -0.441 . . . . 25.0 111.117 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.522 HD22 HD11 ' A' ' 157' ' ' LEU . 28.0 t-20 -58.47 -33.72 70.08 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.923 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -67.69 -16.57 64.21 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.821 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 117.95 -24.91 8.65 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.756 -0.735 . . . . 25.0 112.445 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -51.2 103.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 25.0 110.833 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -58.34 149.79 34.94 Favored Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.705 -0.76 . . . . 25.0 112.516 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.577 HG11 ' HB2' ' A' ' 25' ' ' ALA . 21.8 t -90.29 106.71 17.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-O 120.814 0.34 . . . . 25.0 111.099 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.9 mt -69.53 -35.69 67.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 25.0 111.137 179.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -161.03 118.98 2.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.949 179.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.577 ' HB2' HG11 ' A' ' 22' ' ' VAL . . . -140.31 110.77 6.71 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.223 -0.444 . . . . 25.0 111.086 179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 133.2 49.9 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.843 -0.694 . . . . 25.0 112.573 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -117.31 -57.64 2.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.887 0.375 . . . . 25.0 110.873 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -179.35 -73.47 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.237 -0.438 . . . . 25.0 110.913 -179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -139.25 35.19 2.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 25.0 110.801 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.13 128.83 18.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.871 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 78.1 mt -141.49 131.93 26.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.101 -0.5 . . . . 25.0 111.185 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.7 m95 -101.33 149.66 23.81 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.215 -0.448 . . . . 25.0 110.864 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.62 HD22 ' HB3' ' A' ' 15' ' ' LEU . 1.8 mt -140.74 116.74 10.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.446 . . . . 25.0 110.913 179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.553 ' HA ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -74.48 146.35 42.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 25.0 110.894 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.434 ' HA ' ' HD2' ' A' ' 36' ' ' PRO . . . -103.42 104.11 39.49 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.677 0.751 . . . . 25.0 111.085 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.434 ' HD2' ' HA ' ' A' ' 35' ' ' ALA . 54.0 Cg_endo -69.84 -32.22 18.65 Favored 'Trans proline' 0 C--O 1.232 0.213 0 C-N-CA 122.636 2.224 . . . . 25.0 112.279 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -57.57 -27.02 62.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.306 -0.407 . . . . 25.0 110.858 179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.9 mttt 66.07 44.65 2.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.907 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.1 p -83.91 -176.71 6.4 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.253 -0.43 . . . . 25.0 110.806 -179.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.42 -35.0 17.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.088 -0.505 . . . . 25.0 110.851 -179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -82.55 132.13 35.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.934 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.682 ' O ' HD23 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.36 -65.26 0.95 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.172 -0.467 . . . . 25.0 110.937 179.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.682 HD23 ' O ' ' A' ' 42' ' ' ASP . 18.8 mt -138.37 166.66 23.68 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.949 179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -125.37 129.23 73.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 25.0 111.093 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.431 ' HB2' HD11 ' A' ' 82' ' ' LEU . 42.4 ttt180 -115.95 146.67 41.9 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.217 -0.447 . . . . 25.0 110.859 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.3 tp -123.83 110.33 14.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 25.0 110.974 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 8.9 t80 -116.72 140.61 49.22 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.287 -0.415 . . . . 25.0 110.966 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.7 tttt -125.65 101.52 6.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.055 -0.52 . . . . 25.0 110.889 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -144.08 148.76 35.59 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 25.0 110.898 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -78.82 146.05 33.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.218 -0.446 . . . . 25.0 110.867 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -134.0 129.62 36.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.927 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -107.63 -52.2 2.8 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.108 -0.496 . . . . 25.0 110.804 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -99.83 168.41 9.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.278 -0.419 . . . . 25.0 110.956 -179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.29 -34.48 36.85 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.828 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -54.68 -34.92 62.98 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.213 -0.448 . . . . 25.0 110.957 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -65.78 -33.38 75.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.119 -0.491 . . . . 25.0 110.84 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.498 ' HG2' HG21 ' A' ' 99' ' ' ILE . 1.5 tpp -58.15 -52.91 63.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.157 -0.474 . . . . 25.0 110.839 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.593 HG13 HG12 ' A' ' 99' ' ' ILE . 24.8 m -68.86 -33.04 57.19 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.234 -0.439 . . . . 25.0 111.12 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -26.22 68.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.21 -0.45 . . . . 25.0 110.805 -179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -77.26 -29.98 54.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.209 -0.45 . . . . 25.0 110.884 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.457 HG21 ' HB2' ' A' ' 104' ' ' PHE . 8.1 mm -73.62 -43.26 54.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 25.0 111.142 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -29.12 16.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.271 -0.422 . . . . 25.0 110.887 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -76.76 -35.95 57.39 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.14 -0.482 . . . . 25.0 110.895 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.744 ' O ' HG23 ' A' ' 68' ' ' VAL . 1.1 mp0 -58.4 -51.43 69.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.169 -0.468 . . . . 25.0 110.916 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.06 -35.9 48.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.154 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -61.74 -43.43 98.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.22 -0.446 . . . . 25.0 110.871 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.52 -35.52 58.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.277 -0.42 . . . . 25.0 110.866 -179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.948 HG11 HG13 ' A' ' 109' ' ' VAL . 81.1 t -52.79 -36.6 23.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 25.0 111.189 179.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -61.19 -36.1 78.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.188 -0.46 . . . . 25.0 110.913 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.71 -48.41 81.77 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 25.0 110.898 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . 0.573 HG11 HD11 ' A' ' 43' ' ' LEU . 21.7 t -74.82 -41.49 46.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.216 -0.447 . . . . 25.0 111.188 179.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.83 -36.31 47.61 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.846 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -72.32 -35.94 68.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.825 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.98 -47.28 53.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.255 -0.43 . . . . 25.0 110.887 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.6 HD23 ' HD2' ' A' ' 77' ' ' ARG . 4.4 mp -70.88 -19.61 62.6 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.274 -0.421 . . . . 25.0 110.956 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 63.74 33.37 87.07 Favored Glycine 0 N--CA 1.45 -0.392 0 C-N-CA 120.845 -0.693 . . . . 25.0 112.497 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.6 ' HD2' HD23 ' A' ' 75' ' ' LEU . 71.9 mtt-85 -103.63 176.17 5.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.854 0.359 . . . . 25.0 110.847 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.444 ' O ' HG22 ' A' ' 108' ' ' THR . 0.1 OUTLIER -85.29 -52.96 5.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.935 -179.909 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.2 mtt180 -127.03 144.77 50.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.116 -0.493 . . . . 25.0 110.805 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.561 ' HB3' HG13 ' A' ' 68' ' ' VAL . 0.0 OUTLIER -116.83 111.57 19.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.854 179.864 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.6 mttt -82.08 119.18 23.7 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.914 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.431 HD11 ' HB2' ' A' ' 45' ' ' ARG . 5.7 tt -130.7 135.18 47.56 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.211 -0.45 . . . . 25.0 110.904 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.4 tp -99.43 107.44 19.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 25.0 110.896 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.408 ' O ' ' HB3' ' A' ' 114' ' ' ALA . 1.7 t30 -105.36 108.89 20.64 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.112 -0.495 . . . . 25.0 110.87 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.569 ' CG1' HG23 ' A' ' 116' ' ' VAL . 21.8 t -106.41 146.43 12.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.158 -0.474 . . . . 25.0 111.174 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 53.5 m-85 -108.16 137.59 45.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.872 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 17.1 m-85 -114.12 103.66 11.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.174 -0.466 . . . . 25.0 110.875 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 p -131.06 169.25 16.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.862 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 9.8 t -67.09 -35.29 79.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.103 -0.499 . . . . 25.0 111.126 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -162.78 176.03 10.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.244 -0.434 . . . . 25.0 110.853 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.603 ' HB1' ' HD2' ' A' ' 92' ' ' PRO . . . -73.68 161.34 79.24 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.533 0.683 . . . . 25.0 111.099 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.603 ' HD2' ' HB1' ' A' ' 91' ' ' ALA . 53.1 Cg_endo -69.92 176.86 6.32 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.651 2.234 . . . . 25.0 112.324 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.441 HG23 ' N ' ' A' ' 94' ' ' ASP . 10.6 m -51.46 -47.36 35.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.109 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.441 ' N ' HG23 ' A' ' 93' ' ' VAL . 0.2 OUTLIER 171.92 -172.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.118 -0.492 . . . . 25.0 110.868 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 26.9 m-20 57.48 38.79 28.24 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.942 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.43 ' HZ3' ' HB2' ' A' ' 100' ' ' ALA . 18.2 p-90 -120.57 -32.2 4.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.193 -0.458 . . . . 25.0 110.907 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -51.83 -35.28 43.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.254 -0.43 . . . . 25.0 110.861 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -63.87 -40.24 96.08 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.24 -0.436 . . . . 25.0 110.858 -179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.593 HG12 HG13 ' A' ' 58' ' ' VAL . 2.4 mp -65.02 -47.77 86.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.173 -0.467 . . . . 25.0 111.181 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.43 ' HB2' ' HZ3' ' A' ' 96' ' ' TRP . . . -50.9 -30.35 14.42 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 25.0 111.087 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -92.55 -38.19 12.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.944 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.28 139.88 58.81 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.449 . . . . 25.0 110.921 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.9 m -101.89 143.66 31.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.44 . . . . 25.0 111.183 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.457 ' HB2' HG21 ' A' ' 61' ' ' ILE . 7.9 t80 -97.14 104.28 16.29 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.858 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 15.2 mt-10 -112.92 100.97 9.05 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.125 -0.489 . . . . 25.0 110.844 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -101.74 86.81 3.0 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.835 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.43 -112.43 4.97 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.726 -0.749 . . . . 25.0 112.458 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . 0.444 HG22 ' O ' ' A' ' 78' ' ' ARG . 0.2 OUTLIER -95.0 30.01 2.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.355 . . . . 25.0 111.252 -179.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.948 HG13 HG11 ' A' ' 68' ' ' VAL . 18.3 t -119.39 151.82 21.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 25.0 111.043 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 36.2 p -137.05 112.55 9.32 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.044 -0.526 . . . . 25.0 110.794 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 88.1 t -142.81 139.1 28.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 CA-C-N 116.041 -0.527 . . . . 25.0 111.101 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -116.32 136.0 22.97 Favored Pre-proline 0 C--N 1.33 -0.252 0 CA-C-O 121.691 0.758 . . . . 25.0 110.865 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 149.16 66.24 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.669 2.246 . . . . 25.0 112.317 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.535 ' HB3' ' HA ' ' A' ' 85' ' ' VAL . . . -152.72 136.56 16.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.279 -0.418 . . . . 25.0 111.119 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 13.1 tt -138.83 144.21 30.25 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.159 -0.473 . . . . 25.0 111.093 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.744 HG13 ' CB ' ' A' ' 124' ' ' ASP . 90.8 t -124.57 124.91 69.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.178 -0.465 . . . . 25.0 111.196 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.567 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -70.65 140.06 51.47 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 25.0 110.834 -179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -75.04 -33.12 55.52 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.706 -0.759 . . . . 25.0 112.489 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.766 HG23 ' HG2' ' A' ' 120' ' ' MET . 5.1 t -84.63 -34.05 23.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.816 0.341 . . . . 25.0 111.149 -179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . 0.766 ' HG2' HG23 ' A' ' 119' ' ' THR . 0.0 OUTLIER -111.08 33.04 4.85 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 25.0 110.835 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.928 HD21 HG21 ' A' ' 7' ' ' THR . 3.2 tt -52.68 -36.2 56.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.286 -0.416 . . . . 25.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 10.1 ptp180 -58.55 -37.46 75.75 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 25.0 110.855 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -74.03 -35.82 64.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.202 -0.454 . . . . 25.0 110.927 -179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.744 ' CB ' HG13 ' A' ' 116' ' ' VAL . 3.4 m-20 -72.61 -38.13 67.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.113 -0.494 . . . . 25.0 110.857 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 125' ' ' LEU . 0.2 OUTLIER -52.22 -42.79 63.85 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.925 -179.939 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -79.83 -34.97 38.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.155 -0.475 . . . . 25.0 110.886 179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -63.12 -33.81 76.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.18 -0.463 . . . . 25.0 111.112 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.55 -60.13 2.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.192 -0.458 . . . . 25.0 111.108 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 52.6 m-85 -113.09 76.18 2.3 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.762 0.792 . . . . 25.0 110.944 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -30.71 22.04 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.727 2.285 . . . . 25.0 112.311 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 6.3 t -69.6 -16.32 63.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.265 -0.425 . . . . 25.0 110.863 -179.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -70.45 139.69 51.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.067 -0.515 . . . . 25.0 110.828 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 10.3 mmt180 -67.54 91.72 0.29 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.125 -0.489 . . . . 25.0 110.934 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.76 16.14 24.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.211 -0.449 . . . . 25.0 111.148 -179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -79.76 -53.22 7.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.861 -179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -58.68 -35.79 73.16 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.123 -0.489 . . . . 25.0 110.889 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -53.71 121.05 7.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.476 . . . . 25.0 110.885 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -148.66 137.03 21.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.258 -0.428 . . . . 25.0 110.861 -179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -54.98 -37.95 67.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 25.0 110.915 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -60.45 -40.04 89.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 25.0 110.874 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -97.68 25.81 5.54 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.905 179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -114.81 132.72 56.39 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.225 -0.443 . . . . 25.0 111.074 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 4.1 t -164.5 164.13 21.89 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 25.0 110.776 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 54.1 p90 -61.4 -36.2 79.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.112 -0.495 . . . . 25.0 110.873 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -67.52 -36.13 80.44 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.085 -0.507 . . . . 25.0 110.896 -179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.43 -37.91 70.88 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.189 -0.459 . . . . 25.0 110.861 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -57.57 -49.72 75.47 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.176 -0.465 . . . . 25.0 111.064 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.41 -36.63 66.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 25.0 110.878 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.0 mtt -68.93 -41.44 78.09 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.932 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -56.64 -38.62 72.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.484 . . . . 25.0 111.088 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -63.72 -53.68 47.28 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 25.0 110.871 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -52.08 -43.74 64.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.275 -0.42 . . . . 25.0 110.839 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -66.54 -38.96 88.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.189 -0.46 . . . . 25.0 110.881 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.32 -46.47 88.52 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.238 -0.437 . . . . 25.0 110.855 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -52.51 -36.32 55.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.853 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -75.93 -36.73 59.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.155 -0.475 . . . . 25.0 110.878 -179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.522 HD11 HD22 ' A' ' 17' ' ' ASN . 0.7 OUTLIER -62.73 -54.6 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 25.0 110.925 -179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.2 p -53.0 -35.95 23.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.197 -0.456 . . . . 25.0 111.13 179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -63.94 -60.56 3.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 25.0 110.999 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -56.39 -35.37 67.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.892 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . 0.549 ' HG2' HG12 ' A' ' 16' ' ' VAL . 7.9 tp-100 -54.79 -35.06 63.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 25.0 110.857 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.92 -51.45 69.23 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.251 -0.431 . . . . 25.0 110.91 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -68.41 -36.04 78.52 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.919 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -67.83 -36.14 79.83 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.453 . . . . 25.0 110.907 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.16 -37.58 55.06 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.127 -0.488 . . . . 25.0 110.862 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.94 -38.89 58.1 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.159 -0.473 . . . . 25.0 110.891 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . 0.564 ' O ' HG22 ' A' ' 171' ' ' VAL . 0.3 OUTLIER -72.42 -41.5 66.15 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.281 -0.418 . . . . 25.0 111.079 -179.925 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -51.56 -34.51 37.03 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.222 -0.445 . . . . 25.0 110.913 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -69.08 -35.03 76.05 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.079 -0.51 . . . . 25.0 111.122 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -70.29 -66.21 0.63 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 25.0 111.097 179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 167' ' ' THR . 0.0 OUTLIER -40.97 -78.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.25 -0.432 . . . . 25.0 111.154 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . 0.45 ' H ' HG23 ' A' ' 171' ' ' VAL . 0.1 OUTLIER 175.08 -67.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.14 -0.482 . . . . 25.0 110.898 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -148.28 177.89 9.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.959 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -168.02 142.01 3.41 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 25.0 110.906 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 106.89 163.01 22.19 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.691 -0.766 . . . . 25.0 112.435 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 15.2 tttt -156.87 176.39 12.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 25.0 110.884 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -171.16 169.23 6.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.917 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -171.9 -179.54 2.45 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.483 . . . . 25.0 110.939 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 62.18 98.38 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 25.0 110.847 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -178.27 92.42 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.271 -0.422 . . . . 25.0 110.939 -179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -179.08 -171.45 0.21 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 25.0 110.911 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 62.86 163.18 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.13 -0.486 . . . . 25.0 110.883 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 31.5 p90 -174.61 137.57 0.48 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.809 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -125.25 110.17 13.71 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.066 -0.516 . . . . 25.0 110.823 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 2.8 pp0? . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.073 -0.512 . . . . 25.0 110.924 -180.0 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.3 mtp . . . . . 0 N--CA 1.498 1.935 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.1 m-85 -67.12 30.85 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 117.808 2.522 . . . . 0.0 117.808 -175.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.9 tt -67.48 -48.64 66.57 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 120.786 -1.196 . . . . 0.0 108.965 -179.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.12 -35.06 79.03 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.335 0.588 . . . . 0.0 110.887 177.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -59.62 -27.17 66.08 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.515 -0.766 . . . . 0.0 112.107 -178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -61.49 -48.98 78.63 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 108.323 -0.991 . . . . 0.0 108.323 176.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.6 m -67.44 -38.76 85.02 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.968 179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -55.17 -53.43 56.01 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -65.95 -30.87 71.51 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.953 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 26.1 mtpp -72.68 -33.38 66.48 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.088 -0.382 . . . . 0.0 111.85 179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.423 HD11 HD11 ' A' ' 125' ' ' LEU . 7.4 mm -68.04 -43.66 85.24 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.502 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.348 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.36 -43.61 88.48 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.6 -44.32 96.6 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.36 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -59.03 -46.02 89.25 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.143 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.2 mt -66.28 -53.2 39.59 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 121.29 -0.164 . . . . 0.0 111.025 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 73.1 t -53.99 -44.47 62.11 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 O-C-N 121.944 -0.473 . . . . 0.0 111.883 178.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.83 -16.28 64.02 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.462 -0.774 . . . . 0.0 112.722 -178.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 41.2 m -89.79 1.24 56.38 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 122.423 0.289 . . . . 0.0 110.924 178.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 111.06 -1.0 28.45 Favored Glycine 0 C--O 1.228 -0.278 0 N-CA-C 115.887 1.115 . . . . 0.0 115.887 176.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.464 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 37.7 m-85 -68.63 118.51 11.74 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 117.974 0.887 . . . . 0.0 109.39 178.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.86 130.82 11.93 Favored Glycine 0 CA--C 1.508 -0.386 0 N-CA-C 111.051 -0.819 . . . . 0.0 111.051 -177.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 76.6 t -75.47 130.31 36.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 CA-C-O 121.14 0.495 . . . . 0.0 110.164 -179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.9 mt -102.46 -44.54 10.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 N-CA-C 106.71 -1.589 . . . . 0.0 106.71 175.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -150.62 138.63 20.08 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 105.003 -2.221 . . . . 0.0 105.003 -179.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.21 105.41 5.03 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 -177.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.09 42.73 50.53 Favored Glycine 0 CA--C 1.503 -0.668 0 N-CA-C 116.655 1.422 . . . . 0.0 116.655 167.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -59.18 -44.26 92.16 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 176.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.2 p -156.75 -71.94 0.1 Allowed 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.648 176.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -121.85 8.08 9.92 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.305 -0.862 . . . . 0.0 113.218 -176.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -131.48 138.61 49.06 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 114.862 1.431 . . . . 0.0 114.862 -171.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.9 mt -138.96 137.26 42.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 178.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.2 m95 -120.79 133.55 55.32 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 123.151 0.58 . . . . 0.0 109.967 177.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.4 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 2.6 mp -131.07 137.28 49.06 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.908 0.883 . . . . 0.0 110.272 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -86.17 137.04 32.95 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 173.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.78 118.25 70.9 Favored Pre-proline 0 CA--C 1.539 0.536 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 -179.034 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 84.8 Cg_endo -76.26 -25.45 9.95 Favored 'Trans proline' 0 C--N 1.348 0.541 0 C-N-CA 117.192 -1.405 . . . . 0.0 112.035 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -72.94 -30.52 63.93 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 124.393 1.077 . . . . 0.0 112.012 -178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 48.2 mttp 55.99 39.24 30.54 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 122.722 1.249 . . . . 0.0 111.554 177.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.2 t -77.66 -172.99 2.81 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 104.48 -2.415 . . . . 0.0 104.48 170.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -41.4 -1.78 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.071 1 N-CA-C 121.945 4.054 . . . . 0.0 121.945 -178.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -132.95 125.37 29.66 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 174.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -74.58 -33.63 62.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.589 0.709 . . . . 0.0 109.54 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.06 161.03 37.81 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.711 -175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 57.7 t -130.79 139.06 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 55.3 ttt-85 -123.87 136.38 54.32 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.3 tp -113.21 124.97 53.78 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 176.29 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -136.45 135.56 38.76 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 110.125 -0.324 . . . . 0.0 110.125 -177.228 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.7 pttp -118.5 100.09 7.23 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.063 0.459 . . . . 0.0 112.177 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -151.41 150.23 30.21 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 179.536 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -87.82 151.41 22.88 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 179.172 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.6 mt -138.22 120.28 15.59 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -178.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 78.2 m-20 -88.14 -33.41 18.22 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 121.098 0.475 . . . . 0.0 110.755 -178.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 93.5 m-85 -129.87 149.9 51.4 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 112.567 0.58 . . . . 0.0 112.567 -177.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.494 ' HD2' HD11 ' A' ' 99' ' ' ILE . 15.0 ptt180 -66.93 -22.42 65.95 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.673 -0.642 . . . . 0.0 111.147 -179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -62.64 -32.69 73.77 Favored 'General case' 0 C--O 1.21 -0.983 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -74.37 -39.5 62.7 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 177.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 46.3 ttm -58.54 -48.59 80.38 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.279 178.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 20.8 m -63.2 -31.9 54.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 122.037 -0.414 . . . . 0.0 111.59 -178.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 37.0 mmt180 -70.07 -34.13 72.8 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.834 -177.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -59.22 -42.56 91.3 Favored 'General case' 0 C--O 1.218 -0.557 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 175.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.9 mm -66.17 -31.28 52.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 -177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 89.8 mt-10 -63.82 -39.54 94.47 Favored 'General case' 0 C--O 1.244 0.772 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -76.64 -41.98 43.85 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 25.9 mm100 -57.48 -36.58 71.67 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 113.034 0.754 . . . . 0.0 113.034 178.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.488 ' HA ' HG11 ' A' ' 109' ' ' VAL . . . -61.89 -37.28 84.0 Favored 'General case' 0 C--O 1.208 -1.124 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 176.28 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.41 -37.28 77.39 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.815 0.341 . . . . 0.0 110.471 177.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.0 mmt85 -61.16 -47.69 85.04 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 177.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.481 HG11 HG13 ' A' ' 109' ' ' VAL . 75.4 t -65.12 -40.72 89.78 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.095 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.408 -179.355 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -58.31 -40.83 83.05 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 66.5 mtp180 -65.23 -44.74 87.25 Favored 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.733 -0.605 . . . . 0.0 110.884 178.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 97.7 t -67.01 -36.97 78.43 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 CA-C-O 121.231 0.538 . . . . 0.0 110.176 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 65.3 ttp85 -60.07 -44.52 94.68 Favored 'General case' 0 C--N 1.323 -0.571 0 O-C-N 121.812 -0.555 . . . . 0.0 110.749 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -65.59 -41.08 93.22 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -61.2 -40.0 92.31 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.2 mp -94.57 -0.07 54.83 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -177.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.07 15.38 65.07 Favored Glycine 0 CA--C 1.524 0.618 0 N-CA-C 116.241 1.256 . . . . 0.0 116.241 177.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 53.8 mtt-85 -72.47 142.86 48.59 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 107.855 -1.165 . . . . 0.0 107.855 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -72.25 -32.99 67.17 Favored 'General case' 0 N--CA 1.477 0.888 0 O-C-N 121.35 -0.843 . . . . 0.0 112.979 -177.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.45 160.82 43.12 Favored 'General case' 0 CA--C 1.512 -0.508 0 N-CA-C 102.31 -3.218 . . . . 0.0 102.31 178.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.6 mtp -141.86 148.23 38.44 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 119.858 1.208 . . . . 0.0 113.004 178.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 10.9 mmtt -117.6 141.27 48.57 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 174.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 31.2 tp -128.26 135.44 49.66 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 68.0 tp -94.14 119.5 33.06 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 104.717 -2.327 . . . . 0.0 104.717 170.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -115.04 108.73 17.06 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 110.33 -0.248 . . . . 0.0 110.33 -177.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.4 t -107.68 118.44 55.39 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -176.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -88.01 146.21 25.6 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.613 -0.722 . . . . 0.0 110.226 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -121.47 116.86 25.5 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 172.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 78.2 p -136.45 160.32 39.11 Favored 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.226 0.329 . . . . 0.0 110.722 -174.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 6.2 t -76.87 -29.24 55.73 Favored 'General case' 0 C--N 1.323 -0.584 0 O-C-N 121.583 -0.698 . . . . 0.0 111.381 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -150.7 164.08 37.01 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 106.26 -1.755 . . . . 0.0 106.26 -178.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -92.88 152.78 41.87 Favored Pre-proline 0 C--N 1.321 -0.634 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -177.321 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_exo -59.4 149.21 82.83 Favored 'Trans proline' 0 C--N 1.349 0.579 0 O-C-N 122.367 0.667 . . . . 0.0 113.42 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.8 m -77.79 -16.14 14.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 117.317 2.34 . . . . 0.0 117.317 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.3 p-10 -120.73 100.26 7.01 Favored 'General case' 0 C--O 1.21 -0.991 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -175.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 44.6 31.46 0.63 Allowed 'General case' 0 N--CA 1.485 1.323 0 N-CA-C 117.29 2.33 . . . . 0.0 117.29 172.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.7 p-90 -61.94 -22.23 65.44 Favored 'General case' 0 C--N 1.323 -0.575 0 O-C-N 121.461 -0.775 . . . . 0.0 112.642 -178.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -59.88 -31.28 69.65 Favored 'General case' 0 C--N 1.323 -0.567 0 O-C-N 122.04 -0.413 . . . . 0.0 111.664 -179.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -58.75 -39.85 82.14 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.768 -0.826 . . . . 0.0 108.768 177.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.494 HD11 ' HD2' ' A' ' 54' ' ' ARG . 8.8 mm -63.89 -39.35 85.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.04 -177.12 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.28 -10.33 57.33 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -178.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.3 mppt? -112.0 3.81 17.69 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 178.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -109.88 105.85 15.19 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.852 -175.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.0 m -68.36 122.42 18.35 Favored 'General case' 0 CA--C 1.512 -0.514 0 N-CA-C 105.626 -1.99 . . . . 0.0 105.626 174.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -84.05 122.55 28.94 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 178.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -123.01 132.87 54.32 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.783 0.802 . . . . 0.0 109.643 177.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 25.3 tttt -147.61 125.48 11.97 Favored 'General case' 0 C--O 1.214 -0.8 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.23 -119.42 13.0 Favored Glycine 0 C--O 1.227 -0.343 0 N-CA-C 107.367 -2.293 . . . . 0.0 107.367 -176.797 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.2 p -119.23 19.34 12.86 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 122.167 0.984 . . . . 0.0 108.576 175.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 65' ' ' ALA . 84.6 t -97.14 138.45 22.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.734 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.618 179.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -126.12 139.98 52.94 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 172.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.2 t -132.72 136.76 55.31 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.262 0 CA-C-O 121.813 0.816 . . . . 0.0 110.347 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -107.2 103.37 47.9 Favored Pre-proline 0 N--CA 1.433 -1.279 0 CA-C-N 113.422 -1.717 . . . . 0.0 109.347 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -78.18 152.61 27.62 Favored 'Trans proline' 0 C--N 1.346 0.409 0 C-N-CA 115.636 -2.443 . . . . 0.0 112.483 177.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.69 154.69 38.96 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 103.63 -2.73 . . . . 0.0 103.63 175.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.8 tt -150.76 135.89 10.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 30.5 m -111.99 138.03 42.4 Favored 'Isoleucine or valine' 0 C--O 1.243 0.737 0 N-CA-C 104.562 -2.385 . . . . 0.0 104.562 172.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.44 142.57 47.43 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 -178.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.76 -27.68 59.36 Favored Glycine 0 C--O 1.227 -0.283 0 CA-C-N 115.956 -0.565 . . . . 0.0 114.169 -176.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 52.8 p -55.45 -30.03 59.78 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -178.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.84 26.27 2.08 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.352 0.596 . . . . 0.0 110.527 -178.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 27.6 tp -43.51 -44.04 5.79 Favored 'General case' 0 C--O 1.214 -0.767 0 N-CA-C 118.325 2.713 . . . . 0.0 118.325 -170.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 28.9 ptt180 -60.91 -43.27 98.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 119.118 0.872 . . . . 0.0 112.068 -177.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -74.95 -38.7 61.66 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 122.282 1.039 . . . . 0.0 110.564 177.465 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -62.82 -38.97 92.83 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 122.035 0.921 . . . . 0.0 111.686 -177.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.423 HD11 HD11 ' A' ' 11' ' ' ILE . 2.5 tm? -61.78 -50.04 73.94 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.102 -178.62 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -72.06 -15.7 62.02 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.404 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.21 -34.67 63.77 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 177.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 56.2 t -91.18 -41.51 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 CA-C-O 121.113 0.482 . . . . 0.0 109.979 179.308 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -124.24 76.33 60.65 Favored Pre-proline 0 C--N 1.325 -0.475 0 C-N-CA 122.882 0.473 . . . . 0.0 111.532 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.13 -11.64 32.15 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 117.726 -1.049 . . . . 0.0 112.181 177.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 24.7 p -76.27 -8.74 57.73 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.556 177.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -93.21 131.41 38.33 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.195 0.521 . . . . 0.0 109.598 -179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 43.7 mtm-85 -75.12 113.9 12.99 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 22.9 p -62.19 -27.34 68.9 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 112.852 0.686 . . . . 0.0 112.852 -177.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.93 -23.76 66.01 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 178.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -65.35 -29.27 69.98 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 177.459 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 22.9 t -114.23 52.73 0.82 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.385 -179.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.8 t -56.17 145.44 26.23 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 108.82 -0.808 . . . . 0.0 108.82 177.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -60.33 -29.56 68.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.444 0.64 . . . . 0.0 110.394 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 24.7 mt-10 -66.03 -29.78 70.2 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.654 0.74 . . . . 0.0 111.622 178.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -95.74 -14.69 23.15 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.435 -174.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -78.12 71.94 4.62 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -175.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 59.6 p -114.39 153.67 29.45 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.343 0.592 . . . . 0.0 111.005 178.049 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 35.3 p90 -63.8 -28.75 70.08 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.243 0.544 . . . . 0.0 110.471 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -66.57 -48.13 70.57 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.485 0.66 . . . . 0.0 109.397 178.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -68.45 -24.39 64.72 Favored 'General case' 0 C--O 1.217 -0.625 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.847 -177.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.89 -36.79 70.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.161 0.505 . . . . 0.0 111.61 177.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -64.83 -41.27 95.89 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.467 0.651 . . . . 0.0 109.382 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 45.9 mtt -68.36 -35.44 77.73 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.517 178.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.2 -30.73 71.82 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.315 -179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.97 -48.27 74.62 Favored 'General case' 0 CA--C 1.508 -0.635 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.01 -40.58 91.23 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.568 0.699 . . . . 0.0 110.007 -178.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -60.26 -38.92 84.99 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.394 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -68.18 -45.42 73.49 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.706 -0.224 . . . . 0.0 110.905 177.044 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.4 mt -62.19 -39.02 91.32 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.307 0.575 . . . . 0.0 110.028 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 42.0 m -66.32 -34.59 78.33 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.04 0.448 . . . . 0.0 110.577 177.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.3 tt -67.33 -39.9 85.86 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.519 -0.309 . . . . 0.0 110.762 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 66.9 t -58.49 -50.02 80.28 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.355 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.29 -40.4 93.81 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.142 -0.623 . . . . 0.0 110.968 -178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 12.5 ttpp -56.38 -40.15 74.11 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.864 -0.523 . . . . 0.0 110.571 176.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 29.4 tp60 -56.46 -31.38 63.93 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -175.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -65.11 -39.54 93.25 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.067 0.461 . . . . 0.0 110.426 -179.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 85.6 tt0 -76.91 -44.34 32.14 Favored 'General case' 0 C--N 1.322 -0.589 0 O-C-N 121.757 -0.589 . . . . 0.0 109.463 174.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 30.1 tt0 -55.26 -38.54 68.68 Favored 'General case' 0 C--O 1.24 0.59 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -174.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 4.5 ptm180 -62.08 -17.48 57.71 Favored 'General case' 0 C--O 1.219 -0.544 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -178.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 50.2 pttt -55.59 -17.83 6.39 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 179.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 18.9 p -62.52 -17.62 60.16 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 122.616 0.367 . . . . 0.0 111.703 176.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.35 -33.19 65.43 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 123.408 0.683 . . . . 0.0 110.282 176.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -65.06 -14.03 59.45 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -84.92 -1.01 56.13 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.8 t 44.94 70.29 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 114.571 1.323 . . . . 0.0 114.571 173.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -143.86 168.09 20.78 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -179.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -126.15 145.38 50.38 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 178.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -162.12 174.51 12.86 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 106.804 -1.554 . . . . 0.0 106.804 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 104.27 177.74 25.26 Favored Glycine 0 C--O 1.23 -0.122 0 CA-C-O 121.189 0.327 . . . . 0.0 113.577 179.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 59.0 tttp -151.75 137.41 17.88 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 104.659 -2.348 . . . . 0.0 104.659 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.5 tt -158.24 124.05 4.56 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 118.061 0.391 . . . . 0.0 109.976 -179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 -132.65 151.27 52.0 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 104.327 -2.471 . . . . 0.0 104.327 175.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -78.37 -34.73 48.11 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 119.931 -0.708 . . . . 0.0 109.768 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 37.64 55.0 1.5 Allowed 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 178.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -143.93 156.42 44.42 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.218 -178.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 26.9 tp -129.06 169.34 14.84 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.513 -1.292 . . . . 0.0 107.513 -179.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 44.0 p90 -148.75 164.83 33.22 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -134.32 166.4 22.89 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -179.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.246 0.902 0 N-CA-C 103.915 -2.624 . . . . 0.0 103.915 179.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.3 ptp . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 24.0 m-85 -97.93 36.38 1.56 Allowed 'General case' 0 C--O 1.22 -0.484 0 CA-C-O 121.278 0.561 . . . . 0.0 112.062 -176.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.3 tt -61.16 -38.18 85.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.114 0.483 . . . . 0.0 109.905 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 69.7 mt -64.1 -42.71 96.8 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.402 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -67.17 -38.48 85.5 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.667 -178.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 77.6 t80 -60.9 -50.7 72.37 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 177.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.6 m -59.77 -40.1 87.11 Favored 'General case' 0 C--O 1.221 -0.408 0 CA-C-O 121.075 0.464 . . . . 0.0 111.008 -178.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -59.7 -45.13 93.07 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 179.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -75.6 -34.23 60.6 Favored 'General case' 0 CA--C 1.502 -0.901 0 CA-C-O 122.791 1.281 . . . . 0.0 108.776 -175.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 44.1 tptt -64.63 -39.65 94.09 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.834 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 6.5 mm -72.1 -40.47 66.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 175.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.86 -42.31 84.24 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.41 -42.26 98.76 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.137 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -62.07 -46.91 87.04 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.352 178.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.9 mt -63.48 -48.04 79.29 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.051 -0.406 . . . . 0.0 110.718 -179.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 85.5 t -64.6 -37.19 79.45 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 C-N-CA 120.238 -0.585 . . . . 0.0 111.014 -177.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -74.2 -10.5 59.67 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 121.077 -1.014 . . . . 0.0 111.765 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.0 m -94.77 12.69 27.06 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 175.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.0 2.63 66.33 Favored Glycine 0 CA--C 1.517 0.204 0 N-CA-C 116.496 1.359 . . . . 0.0 116.496 175.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -70.36 115.09 9.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 118.444 1.122 . . . . 0.0 109.237 178.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.34 133.86 20.44 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -177.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 63.0 t -78.6 118.69 26.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.519 HD11 HD22 ' A' ' 43' ' ' LEU . 40.6 mt -90.27 -44.92 14.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.657 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 177.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -149.65 124.65 9.99 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.092 -0.958 . . . . 0.0 109.451 -177.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.12 135.57 32.65 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 104.689 -2.337 . . . . 0.0 104.689 173.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.25 -82.75 0.05 OUTLIER Glycine 0 CA--C 1.507 -0.435 0 C-N-CA 120.257 -0.973 . . . . 0.0 112.539 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -70.56 158.2 36.55 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -65.94 -13.08 59.1 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -178.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.4 m-20 -84.15 -41.69 16.79 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 115.667 1.728 . . . . 0.0 115.667 -174.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -136.93 147.09 46.18 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 116.511 2.041 . . . . 0.0 116.511 -177.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.1 mt -136.36 130.05 47.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 106.401 -1.703 . . . . 0.0 106.401 174.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 31.9 m95 -103.23 127.25 50.6 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 177.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -123.02 142.37 50.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.039 -178.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -92.26 133.84 35.45 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 107.681 -1.229 . . . . 0.0 107.681 175.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.22 114.0 29.07 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -72.22 -29.13 14.65 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 116.667 -1.756 . . . . 0.0 113.245 -176.813 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -74.15 -11.76 60.39 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 123.006 0.523 . . . . 0.0 111.279 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 mttm 59.4 41.6 19.28 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 123.355 1.55 . . . . 0.0 107.896 -178.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.74 -177.57 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 110.898 -2.864 . . . . 0.0 117.952 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 p -50.4 -26.78 5.35 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 114.264 -1.335 . . . . 0.0 110.537 174.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 -117.12 139.09 51.16 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 106.217 -1.772 . . . . 0.0 106.217 174.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -81.98 -35.04 29.4 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.519 HD22 HD11 ' A' ' 23' ' ' ILE . 73.4 mt -133.62 158.84 42.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.831 -177.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.7 t -125.58 134.38 66.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 177.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.1 tmm_? -116.39 102.86 9.9 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 177.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 9.5 tp -80.18 129.17 34.3 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 105.167 -2.16 . . . . 0.0 105.167 178.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.8 t80 -136.37 138.32 41.49 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -176.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -105.22 95.22 5.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -151.73 122.78 7.63 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.203 0.525 . . . . 0.0 111.065 -178.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -91.54 134.56 34.55 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 107.602 -1.258 . . . . 0.0 107.602 175.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -124.36 126.61 46.27 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -171.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -72.9 -41.18 64.9 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.726 0.639 . . . . 0.0 112.726 177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 40.9 m-85 -129.18 152.07 49.17 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -173.657 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.2 ptt180 -63.41 -19.72 64.92 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 178.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -73.22 -33.01 65.1 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 121.982 -0.449 . . . . 0.0 109.938 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -67.25 -28.41 68.02 Favored 'General case' 0 C--N 1.322 -0.618 0 O-C-N 121.755 -0.591 . . . . 0.0 109.484 178.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 77.4 mtp -63.86 -51.73 63.26 Favored 'General case' 0 C--O 1.219 -0.551 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 176.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 9.1 m -65.8 -31.79 55.3 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.467 0 C-N-CA 120.185 -0.606 . . . . 0.0 110.541 -177.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -61.46 -43.91 98.03 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.99 0.424 . . . . 0.0 110.543 179.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 13.2 t0 -64.52 -46.61 82.19 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.278 0.561 . . . . 0.0 110.187 -178.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.4 mp -68.22 -33.25 59.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 O-C-N 121.272 -0.892 . . . . 0.0 110.618 -178.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -63.55 -31.91 73.21 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.188 -0.945 . . . . 0.0 110.08 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -76.56 -43.64 38.16 Favored 'General case' 0 C--O 1.243 0.729 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 175.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.404 ' O ' HG23 ' A' ' 68' ' ' VAL . 55.4 mt-30 -56.93 -40.08 75.68 Favored 'General case' 0 C--O 1.206 -1.19 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.628 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -35.88 75.54 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 118.045 0.384 . . . . 0.0 111.276 -178.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -72.46 -40.05 67.28 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-O 121.502 0.667 . . . . 0.0 109.308 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.4 -38.57 84.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 176.554 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 64' ' ' GLN . 89.3 t -70.43 -38.4 73.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.704 0 CA-C-O 118.628 -0.701 . . . . 0.0 110.802 179.031 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -62.84 -34.32 77.1 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 120.414 1.461 . . . . 0.0 110.123 178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 42.3 ttt-85 -62.56 -44.8 95.43 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 120.611 -0.436 . . . . 0.0 109.926 175.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 84.4 t -66.62 -41.39 88.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 179.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.19 -42.87 77.82 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 123.271 0.628 . . . . 0.0 109.411 179.31 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.4 t-160 -67.7 -40.9 84.31 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.623 179.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -58.53 -41.51 85.68 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 113.316 0.858 . . . . 0.0 113.316 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -100.44 6.65 44.43 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 178.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 67.11 12.38 60.3 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 117.213 1.645 . . . . 0.0 117.213 175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 4.8 ttt85 -62.07 145.1 54.18 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 117.854 0.827 . . . . 0.0 109.825 -178.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -68.2 -34.91 77.14 Favored 'General case' 0 N--CA 1.476 0.858 0 O-C-N 122.039 -0.413 . . . . 0.0 110.755 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 9.8 mtp180 -149.05 160.66 43.13 Favored 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 104.975 -2.232 . . . . 0.0 104.975 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.0 mmm -127.92 136.08 50.86 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.48 138.06 50.66 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 4.4 tt -138.55 140.98 39.27 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 118.356 0.525 . . . . 0.0 112.251 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -104.44 118.43 36.58 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 173.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -107.99 127.38 53.72 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.3 t -121.79 111.91 32.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 C-N-CA 121.363 -0.135 . . . . 0.0 111.171 -178.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -81.59 147.57 29.54 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -120.76 115.95 24.29 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 104.474 -2.417 . . . . 0.0 104.474 171.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 39.1 t -131.25 160.5 34.72 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 123.568 0.543 . . . . 0.0 111.128 -173.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 30.1 m -67.1 -46.75 73.25 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -149.29 170.87 17.51 Favored 'General case' 0 N--CA 1.44 -0.945 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 -177.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -81.45 152.95 70.87 Favored Pre-proline 0 C--N 1.314 -0.971 0 CA-C-N 115.385 -0.825 . . . . 0.0 108.92 -176.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.75 151.42 47.92 Favored 'Trans proline' 0 C--N 1.35 0.618 0 O-C-N 122.358 0.662 . . . . 0.0 112.008 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -61.18 -20.03 21.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 N-CA-C 117.761 2.504 . . . . 0.0 117.761 -171.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -155.51 145.63 21.66 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -178.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.6 t0 39.9 30.15 0.06 Allowed 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 118.83 2.9 . . . . 0.0 118.83 174.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 28.7 p-90 -73.47 -22.4 60.18 Favored 'General case' 0 N--CA 1.445 -0.711 0 O-C-N 121.339 -0.85 . . . . 0.0 110.705 178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.7 mt-10 -64.85 -32.02 73.53 Favored 'General case' 0 C--N 1.326 -0.427 0 O-C-N 121.922 -0.486 . . . . 0.0 111.525 -176.368 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.0 mm-40 -64.18 -25.11 67.93 Favored 'General case' 0 C--N 1.325 -0.473 0 C-N-CA 120.713 -0.395 . . . . 0.0 109.996 175.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.6 mm -73.96 -43.43 52.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -178.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -68.83 -16.95 63.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.665 0.745 . . . . 0.0 110.105 179.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 21.1 ttpp -95.1 4.03 54.13 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.61 -177.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -126.64 118.76 25.46 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 95.7 m -68.28 126.83 30.82 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 173.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.8 t80 -85.72 111.77 20.43 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 108.72 -0.845 . . . . 0.0 108.72 178.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -110.67 125.23 53.24 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.933 0.397 . . . . 0.0 110.951 -179.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.4 ttpp -138.58 101.9 4.46 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 62.01 -112.72 5.08 Favored Glycine 0 C--N 1.322 -0.231 0 C-N-CA 120.164 -1.017 . . . . 0.0 111.806 178.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 73.9 p -89.66 9.15 28.06 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 113.171 0.804 . . . . 0.0 113.171 -179.077 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 44.7 t -115.46 143.48 25.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 114.723 1.379 . . . . 0.0 114.723 -175.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.6 m -127.76 118.18 23.29 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 171.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.5 t -120.49 130.88 73.97 Favored 'Isoleucine or valine' 0 CA--C 1.491 -1.304 0 CA-C-O 121.624 0.726 . . . . 0.0 111.21 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.49 110.9 61.66 Favored Pre-proline 0 N--CA 1.433 -1.322 0 CA-C-N 113.989 -1.459 . . . . 0.0 109.587 177.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -80.14 150.56 20.37 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 117.758 -1.028 . . . . 0.0 112.169 174.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.92 154.14 37.8 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 176.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 11.0 tt -147.4 125.8 3.83 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 -177.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.7 t -102.37 120.96 52.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 105.126 -2.176 . . . . 0.0 105.126 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.05 136.24 47.24 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.986 -1.116 . . . . 0.0 107.986 -179.387 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.67 -22.53 53.32 Favored Glycine 0 C--O 1.228 -0.257 0 N-CA-C 114.694 0.637 . . . . 0.0 114.694 -177.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 54.3 p -59.47 -32.08 69.91 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 21.1 ptm -139.89 29.5 2.09 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 122.051 0.929 . . . . 0.0 108.845 -177.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.5 tt -46.1 -41.25 12.06 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -172.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -62.35 -45.0 95.14 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 119.006 0.821 . . . . 0.0 111.126 -176.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -74.44 -39.75 62.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.783 0.801 . . . . 0.0 111.287 179.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 26.4 t0 -66.58 -37.84 85.78 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.762 -1.108 . . . . 0.0 113.007 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 14.4 tp -62.1 -36.37 81.51 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.928 -177.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -72.33 -15.93 61.88 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 111.761 0.282 . . . . 0.0 111.761 -177.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.71 -31.37 59.63 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.01 -40.28 10.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.258 -179.03 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -125.83 77.05 70.63 Favored Pre-proline 0 CA--C 1.54 0.595 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.441 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -67.49 -19.82 48.42 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.427 0.895 . . . . 0.0 114.427 -177.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.2 m -80.06 -9.46 59.7 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 178.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 88.9 t80 -64.82 140.01 58.82 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.286 0.565 . . . . 0.0 111.346 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 6.0 mmp_? -92.93 105.91 17.95 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.576 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 33.7 p -73.86 -20.62 60.37 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 176.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -62.81 -20.11 64.71 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 123.848 0.859 . . . . 0.0 111.838 178.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -77.23 6.64 6.3 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 116.609 -0.269 . . . . 0.0 111.455 -179.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -157.46 -179.15 7.9 Favored 'General case' 0 C--O 1.221 -0.428 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -177.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 25.1 t -150.92 155.32 38.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 103.078 -2.934 . . . . 0.0 103.078 175.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -68.38 -22.73 64.63 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 118.396 0.543 . . . . 0.0 109.985 178.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -65.9 -24.72 66.9 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.955 0.883 . . . . 0.0 110.662 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 38.3 t60 -82.66 -4.31 57.59 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.268 -0.878 . . . . 0.0 112.774 -175.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -74.44 43.55 0.18 Allowed 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.806 1.78 . . . . 0.0 115.806 -175.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 73.3 m -66.04 147.21 53.7 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 177.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 40.3 p90 -64.04 -36.35 83.7 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -176.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -69.34 -27.88 65.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.858 0.837 . . . . 0.0 110.027 -178.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -61.86 -26.09 67.93 Favored 'General case' 0 C--O 1.215 -0.729 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.46 -178.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.27 -40.66 96.45 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.435 0.636 . . . . 0.0 110.054 177.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -68.92 -39.56 79.58 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 90.5 mtp -65.82 -36.7 84.22 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.98 178.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.25 -34.95 78.78 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 122.28 -0.263 . . . . 0.0 110.524 178.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 57.4 ttt180 -65.44 -44.85 85.99 Favored 'General case' 0 CA--C 1.505 -0.758 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 177.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -63.02 -44.23 96.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.521 0.677 . . . . 0.0 109.73 -179.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 23.5 mmm180 -61.11 -41.12 96.11 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.041 -0.527 . . . . 0.0 109.645 179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -62.32 -41.38 98.51 Favored 'General case' 0 C--O 1.217 -0.647 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.6 mt -63.66 -38.28 90.5 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.349 -0.844 . . . . 0.0 110.142 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 59.9 p -69.94 -30.02 67.31 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.854 175.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.49 -43.97 92.46 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 123.357 0.663 . . . . 0.0 109.898 179.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 76.7 t -57.95 -46.54 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.659 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -71.43 -37.56 71.43 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 119.933 -0.707 . . . . 0.0 110.107 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -59.68 -29.88 68.38 Favored 'General case' 0 C--O 1.216 -0.708 0 O-C-N 122.02 -0.425 . . . . 0.0 111.495 178.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -54.89 -31.1 59.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.378 0.535 . . . . 0.0 111.096 178.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 75.8 mm-40 -63.13 -36.53 83.92 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-O 121.955 0.883 . . . . 0.0 110.95 178.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -76.84 -41.95 42.1 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.16 175.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 17.5 tm0? -63.78 -40.87 97.72 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -174.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -56.72 -17.76 10.12 Favored 'General case' 0 N--CA 1.477 0.88 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 2.4 ttmm -61.98 -47.49 84.58 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 122.22 -0.3 . . . . 0.0 110.414 177.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 33.9 p -74.51 -35.35 63.19 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.105 0.479 . . . . 0.0 110.579 178.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -60.99 -19.59 61.45 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 -178.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -50.74 -13.95 0.17 Allowed 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 113.978 1.103 . . . . 0.0 113.978 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 63.72 61.65 0.97 Allowed 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 174.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 32.6 m -76.13 -0.49 2.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 114.99 -1.005 . . . . 0.0 110.087 175.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -143.01 159.11 42.85 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.063 -2.94 . . . . 0.0 103.063 178.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -160.27 177.72 10.35 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 -176.244 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 16.9 m-20 64.12 21.53 12.6 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.624 1.169 . . . . 0.0 113.388 177.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -95.8 10.8 68.39 Favored Glycine 0 C--O 1.224 -0.491 0 N-CA-C 114.376 0.51 . . . . 0.0 114.376 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -150.34 163.87 37.24 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.472 0.636 . . . . 0.0 109.75 -178.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 60.3 tp -140.73 -51.97 0.47 Allowed 'General case' 0 N--CA 1.468 0.469 0 O-C-N 123.753 0.658 . . . . 0.0 109.41 178.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 53.36 -105.61 0.26 Allowed 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.653 0.983 . . . . 0.0 113.653 175.311 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 62.96 74.78 0.42 Allowed 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.482 1.113 . . . . 0.0 113.164 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -58.19 152.23 17.49 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.777 177.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -133.48 68.13 1.5 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.211 0.529 . . . . 0.0 111.272 -177.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 62.2 tp -79.47 84.66 5.33 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -153.99 104.29 2.64 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.655 -0.498 . . . . 0.0 109.655 -178.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 87.4 m-85 -126.18 1.38 7.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.528 179.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.916 0 CA-C-O 116.366 -1.778 . . . . 0.0 110.217 -177.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.8 mtm . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 110.348 -0.242 . . . . 0.0 110.348 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 56.0 t80 -151.69 155.27 37.97 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 9.7 tt -54.53 -46.11 73.5 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 113.253 0.834 . . . . 0.0 113.253 -176.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -61.75 -30.56 70.87 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.862 0.69 . . . . 0.0 112.862 -178.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.418 ' HB2' ' HB1' ' A' ' 147' ' ' ALA . 95.7 mt-10 -62.84 -35.46 80.02 Favored 'General case' 0 C--O 1.219 -0.514 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 -179.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.1 m -61.93 -42.78 99.49 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.53 0.681 . . . . 0.0 111.845 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 75.5 t80 -59.92 -51.03 71.45 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.511 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 88.9 m95 -69.75 -27.34 64.87 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 121.867 -0.521 . . . . 0.0 111.357 -179.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.5 mmtt -66.21 -43.56 86.36 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.811 -0.555 . . . . 0.0 110.886 176.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 30.7 mm -70.62 -37.5 69.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.612 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 178.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.0 -45.35 79.06 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.49 -44.52 90.75 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.377 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -57.58 -46.74 83.62 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.37 -178.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.6 mt -67.12 -50.91 59.79 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.65 0.611 . . . . 0.0 112.65 -178.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -66.0 -31.04 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.54 -176.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -68.16 -14.34 62.9 Favored 'General case' 0 C--O 1.221 -0.425 0 O-C-N 121.855 -0.528 . . . . 0.0 110.719 179.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.7 m -95.91 8.9 42.35 Favored 'General case' 0 C--O 1.22 -0.448 0 C-N-CA 122.767 0.427 . . . . 0.0 109.998 177.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 98.64 -2.88 58.94 Favored Glycine 0 C--O 1.227 -0.294 0 N-CA-C 115.435 0.934 . . . . 0.0 115.435 177.099 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -65.44 115.23 5.47 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.669 0.747 . . . . 0.0 109.905 -179.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -71.3 138.57 27.96 Favored Glycine 0 CA--C 1.503 -0.704 0 CA-C-N 115.038 -0.983 . . . . 0.0 111.374 -176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.2 t -83.11 107.35 14.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 178.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.428 HD11 HD22 ' A' ' 43' ' ' LEU . 84.0 mt -71.91 -47.23 56.69 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 106.033 -1.84 . . . . 0.0 106.033 177.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -153.92 130.56 10.73 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.232 178.063 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.36 136.32 33.04 Favored 'General case' 0 C--N 1.322 -0.587 0 N-CA-C 101.146 -3.65 . . . . 0.0 101.146 170.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.02 -59.96 0.06 OUTLIER Glycine 0 CA--C 1.5 -0.88 0 N-CA-C 106.504 -2.638 . . . . 0.0 106.504 179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 74.0 mm-40 -65.85 145.28 56.14 Favored 'General case' 0 N--CA 1.447 -0.621 0 N-CA-C 104.941 -2.244 . . . . 0.0 104.941 172.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.9 m -77.81 -16.96 57.96 Favored 'General case' 0 C--N 1.319 -0.75 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.911 -176.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -92.37 -19.57 21.96 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 116.529 2.048 . . . . 0.0 116.529 -173.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -142.32 149.72 39.84 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 114.929 1.455 . . . . 0.0 114.929 178.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 61.1 mt -141.25 133.1 28.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 54.9 m95 -103.5 130.02 50.8 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 175.551 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -124.39 141.18 52.28 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -99.29 145.79 26.92 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 175.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -93.47 105.65 17.02 Favored Pre-proline 0 CA--C 1.547 0.845 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.02 -16.47 32.28 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 118.012 -0.858 . . . . 0.0 111.49 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -61.62 -28.7 69.56 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.017 -179.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 58.79 37.79 24.87 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -173.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.2 p -76.75 -176.28 3.78 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 112.495 -2.139 . . . . 0.0 109.593 -179.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.3 p -54.87 -8.91 0.29 Allowed 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -179.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 33.7 m-70 -132.9 136.12 45.98 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 177.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -80.27 -35.94 35.2 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.105 0.479 . . . . 0.0 110.305 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.428 HD22 HD11 ' A' ' 23' ' ' ILE . 40.4 mt -138.6 163.34 32.3 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.116 -177.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 7.2 p -138.63 139.41 41.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 173.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 -119.34 132.87 55.94 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 178.732 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mp -106.24 122.46 46.27 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 104.923 -2.251 . . . . 0.0 104.923 177.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.53 121.28 18.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 118.118 0.417 . . . . 0.0 110.659 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -100.8 114.93 29.17 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.677 0.751 . . . . 0.0 109.188 177.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 25.4 t60 -151.64 150.37 30.19 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.706 -0.679 . . . . 0.0 112.456 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -73.0 147.72 44.87 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 174.402 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 73.6 mt -139.83 107.64 5.66 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -83.0 -40.55 19.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.64 0.734 . . . . 0.0 110.892 -179.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -132.44 156.72 46.22 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.927 -0.578 . . . . 0.0 112.145 -178.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.429 ' CZ ' ' HB3' ' A' ' 95' ' ' ASP . 15.9 ptt180 -64.97 -15.33 62.1 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 121.098 0.475 . . . . 0.0 111.093 175.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 55.9 mt-30 -63.35 -37.44 87.27 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 178.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -75.46 -30.86 60.08 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.952 0.406 . . . . 0.0 110.057 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 97.1 mtp -63.58 -47.35 81.87 Favored 'General case' 0 C--O 1.211 -0.972 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.5 m -70.92 -30.74 42.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.682 -178.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.8 mtm-85 -61.49 -43.41 98.91 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -59.13 -42.18 89.99 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.17 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.3 mm -64.51 -30.79 51.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -176.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -61.03 -40.18 92.62 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 177.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -72.96 -37.22 67.16 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.44 -0.345 . . . . 0.0 110.207 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 68.2 mm-40 -56.2 -50.54 70.95 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 178.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.25 -36.57 82.42 Favored 'General case' 0 N--CA 1.448 -0.565 0 O-C-N 122.161 -0.337 . . . . 0.0 111.841 -179.289 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.47 -43.49 97.18 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.991 0.424 . . . . 0.0 109.871 178.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -67.33 -42.42 83.61 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.419 HG11 HG13 ' A' ' 109' ' ' VAL . 57.0 t -62.94 -37.55 79.59 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.77 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.168 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -58.42 -41.0 84.02 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.008 0.822 . . . . 0.0 110.137 178.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 87.4 mtt-85 -63.87 -41.66 97.7 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 -179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.3 t -69.81 -43.42 79.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-O 121.118 0.485 . . . . 0.0 110.167 179.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 68.8 ttp85 -57.53 -41.14 80.29 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 53.6 m80 -65.85 -37.67 86.81 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 120.793 -0.363 . . . . 0.0 111.357 179.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 59.2 mt-30 -68.94 -40.26 79.09 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.076 0.465 . . . . 0.0 110.463 178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.2 mp -75.42 -13.21 60.38 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.019 -0.537 . . . . 0.0 112.136 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.69 6.41 55.19 Favored Glycine 0 CA--C 1.52 0.357 0 N-CA-C 114.084 0.394 . . . . 0.0 114.084 179.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.7 mtt-85 -73.57 140.78 46.51 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.838 -0.801 . . . . 0.0 110.352 -177.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.9 ttt180 -66.45 -38.03 86.47 Favored 'General case' 0 C--O 1.218 -0.557 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.634 179.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.6 mtm-85 -131.16 161.3 32.46 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 107.191 -1.411 . . . . 0.0 107.191 179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mtp -144.87 148.63 34.16 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 118.708 0.685 . . . . 0.0 109.824 174.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 24.1 mttt -121.47 143.49 49.22 Favored 'General case' 0 CA--C 1.514 -0.41 0 O-C-N 123.594 0.559 . . . . 0.0 110.97 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -139.76 125.66 19.64 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 -177.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.0 tp -93.53 121.75 35.25 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 106.526 -1.657 . . . . 0.0 106.526 175.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -111.98 112.61 24.38 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.126 -0.359 . . . . 0.0 110.224 179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.3 t -105.98 110.94 33.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.483 0 CA-C-O 121.201 0.524 . . . . 0.0 111.834 -176.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -80.1 136.64 36.59 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.706 -0.85 . . . . 0.0 108.706 175.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -114.18 112.31 22.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 173.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 20.6 m -132.13 158.23 42.2 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.846 0.355 . . . . 0.0 111.108 -175.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.5 t -74.86 -28.93 60.86 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 121.826 -0.546 . . . . 0.0 110.393 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 51.9 tt0 -154.99 166.12 34.6 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 104.281 -2.488 . . . . 0.0 104.281 -178.489 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.4 155.09 54.33 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 -179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -65.15 154.34 73.98 Favored 'Trans proline' 0 C--N 1.348 0.528 0 C-N-CA 117.328 -1.315 . . . . 0.0 111.994 176.392 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.0 m -65.57 -12.54 13.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 120.402 3.482 . . . . 0.0 120.402 -168.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.9 t0 -151.54 140.45 21.0 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 116.286 1.958 . . . . 0.0 116.286 -175.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 54' ' ' ARG . 7.3 m-20 42.69 15.3 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.387 0 N-CA-C 120.153 3.39 . . . . 0.0 120.153 173.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 25.3 p-90 -63.68 -21.41 66.37 Favored 'General case' 0 C--N 1.319 -0.722 0 O-C-N 120.837 -1.164 . . . . 0.0 113.598 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -62.66 -29.46 70.65 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -178.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -62.39 -33.5 74.88 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.616 0.722 . . . . 0.0 109.615 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 8.9 mm -69.19 -40.49 80.52 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.825 -174.069 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.73 -15.19 63.1 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.866 0.365 . . . . 0.0 111.793 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 56.1 mttp -102.2 3.27 38.17 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -177.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 56.4 pttt -117.42 130.32 56.4 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.483 0.659 . . . . 0.0 112.155 -179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 90.1 m -80.71 125.27 29.83 Favored 'General case' 0 CA--C 1.51 -0.589 0 N-CA-C 104.661 -2.348 . . . . 0.0 104.661 173.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -84.02 126.08 32.7 Favored 'General case' 0 C--N 1.315 -0.896 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 178.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -123.85 135.61 53.86 Favored 'General case' 0 CA--C 1.509 -0.612 0 CA-C-O 121.84 0.829 . . . . 0.0 110.502 179.455 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.0 tmtt? -135.49 91.73 2.76 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 -178.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 72.75 -109.54 2.85 Favored Glycine 0 C--O 1.22 -0.76 0 N-CA-C 107.336 -2.305 . . . . 0.0 107.336 -177.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 56.0 p -110.85 7.26 21.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.777 0.323 . . . . 0.0 111.558 178.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.419 HG13 HG11 ' A' ' 68' ' ' VAL . 78.7 t -87.68 139.36 17.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 N-CA-C 107.03 -1.47 . . . . 0.0 107.03 175.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 24.7 m -126.86 136.99 53.09 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 171.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 95.9 t -132.09 135.35 58.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -111.14 115.83 52.14 Favored Pre-proline 0 C--N 1.321 -0.661 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 176.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -79.69 151.08 21.87 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 117.373 -1.284 . . . . 0.0 112.331 176.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.15 152.72 42.1 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 105.131 -2.174 . . . . 0.0 105.131 175.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.7 tt -146.81 131.31 10.76 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 23.2 m -113.68 128.45 70.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 103.598 -2.742 . . . . 0.0 103.598 175.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.33 136.32 54.88 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 -175.016 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -47.16 -39.9 13.27 Favored Glycine 0 C--O 1.226 -0.382 0 N-CA-C 117.173 1.629 . . . . 0.0 117.173 -174.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 119' ' ' THR . 0.2 OUTLIER -55.58 -29.31 58.81 Favored 'General case' 0 CA--C 1.541 0.616 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -178.764 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -142.46 32.7 1.48 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 123.099 1.428 . . . . 0.0 108.934 -178.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.0 tp -52.04 -36.4 50.18 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 116.586 2.069 . . . . 0.0 116.586 -173.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -60.17 -49.86 75.96 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.168 0.509 . . . . 0.0 110.562 -178.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -73.68 -32.98 64.23 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.735 -177.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 91.3 m-20 -63.45 -45.33 91.35 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.829 0.347 . . . . 0.0 110.719 177.08 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.0 mt -60.68 -44.08 96.94 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.0 pt20 -75.37 -14.08 60.45 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 120.807 -0.357 . . . . 0.0 111.819 -176.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.52 -41.82 37.83 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.945 0.402 . . . . 0.0 110.03 178.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.451 HG13 ' CD2' ' A' ' 129' ' ' PHE . 5.2 p -88.91 -33.98 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 CA-C-O 121.244 0.545 . . . . 0.0 110.577 -179.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . 0.451 ' CD2' HG13 ' A' ' 128' ' ' VAL . 61.1 m-85 -126.78 75.62 75.38 Favored Pre-proline 0 C--N 1.326 -0.436 0 O-C-N 122.0 -0.438 . . . . 0.0 110.233 178.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -67.29 -10.75 29.71 Favored 'Trans proline' 0 C--N 1.349 0.593 0 CA-C-O 121.415 0.506 . . . . 0.0 113.006 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.4 p -80.26 -9.97 59.74 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.459 177.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -92.84 135.64 33.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.424 0.63 . . . . 0.0 110.5 -178.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 85.9 mtt-85 -86.37 116.11 24.32 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 33.3 p -64.21 -17.32 63.44 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.775 -179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.33 -36.01 76.97 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 121.306 0.574 . . . . 0.0 110.78 176.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -75.1 -9.47 58.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.665 0.745 . . . . 0.0 110.58 -177.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.7 t -118.35 34.46 5.18 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.426 178.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 64.8 m -59.8 145.79 44.08 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.232 0.539 . . . . 0.0 109.816 178.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -56.55 -39.07 72.81 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 -174.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -60.27 -39.59 87.37 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 122.005 0.907 . . . . 0.0 110.545 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.9 m-70 -83.7 -9.59 58.74 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.682 -175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -82.06 22.21 0.81 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-O 121.418 0.627 . . . . 0.0 111.612 -179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -60.28 148.08 38.03 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.658 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -60.34 -32.71 71.51 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 -175.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -72.68 -44.3 61.97 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.602 0.715 . . . . 0.0 109.869 176.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -61.15 -27.12 68.17 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.295 -178.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.418 ' HB1' ' HB2' ' A' ' 5' ' ' GLU . . . -57.1 -39.98 76.13 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.839 177.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 93.9 mm-40 -78.7 -31.12 46.38 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 120.655 -0.418 . . . . 0.0 110.969 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 94.0 mmm -63.26 -34.48 77.77 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 176.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.07 -33.6 76.41 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.319 176.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -67.86 -44.61 76.73 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 77.4 mt-10 -64.5 -40.88 96.47 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.669 0.747 . . . . 0.0 109.34 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 75.2 ttt180 -61.57 -42.26 98.59 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.647 177.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.3 t80 -63.42 -42.31 98.73 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 177.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 47.7 mt -64.27 -31.8 73.15 Favored 'General case' 0 C--N 1.323 -0.583 0 O-C-N 122.235 -0.291 . . . . 0.0 110.334 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.4 m -76.18 -36.36 58.71 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.771 0.796 . . . . 0.0 110.543 175.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.36 -34.72 77.89 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.377 -0.829 . . . . 0.0 112.813 -177.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 2.1 p -52.97 -28.09 13.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.479 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 -179.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -59.34 -41.43 89.17 Favored 'General case' 0 C--O 1.218 -0.59 0 O-C-N 121.066 -1.021 . . . . 0.0 109.26 178.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -62.54 -29.91 70.92 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.252 0.549 . . . . 0.0 111.774 -179.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . 0.435 HE21 ' HB3' ' A' ' 161' ' ' GLN . 0.0 OUTLIER -57.05 -27.85 62.05 Favored 'General case' 0 C--O 1.213 -0.863 0 O-C-N 121.788 -0.57 . . . . 0.0 110.747 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 2.1 pp20? -65.2 -40.84 94.74 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.533 1.061 . . . . 0.0 111.632 -177.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.6 pp20? -76.9 -28.88 55.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.032 0.444 . . . . 0.0 110.222 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 89.0 mm-40 -70.95 -41.17 71.46 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-O 121.426 0.631 . . . . 0.0 111.402 175.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 75.3 ttt-85 -67.62 -17.83 64.75 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.64 0.776 . . . . 0.0 111.609 179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 6.2 tttt -56.97 -17.76 10.97 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 178.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 17.9 p -59.12 -23.96 62.57 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 111.739 0.274 . . . . 0.0 111.739 176.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 18.9 tp10 -61.07 -36.54 79.88 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 121.361 0.6 . . . . 0.0 110.291 176.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -70.12 -15.03 62.91 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 122.019 -0.426 . . . . 0.0 111.472 -179.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -89.21 4.59 48.12 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.066 -0.346 . . . . 0.0 110.066 178.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 2.2 t 54.63 42.78 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-O 122.164 0.983 . . . . 0.0 110.897 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -106.78 168.39 9.22 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.558 -0.747 . . . . 0.0 112.883 -177.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -154.02 161.63 41.8 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -179.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 18.0 p30 -156.62 -175.38 5.4 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -149.35 163.85 29.27 Favored Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 107.942 -2.063 . . . . 0.0 107.942 177.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -126.27 157.17 39.01 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 117.452 0.626 . . . . 0.0 110.366 -177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 66.3 tp -108.58 121.31 44.73 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 177.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -90.75 -53.02 4.58 Favored 'General case' 0 C--N 1.322 -0.616 0 O-C-N 123.324 0.39 . . . . 0.0 110.723 -178.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 13.3 ttp180 55.1 -151.19 0.4 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.39 0.676 . . . . 0.0 110.977 178.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 50.84 21.78 1.02 Allowed 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 118.341 2.719 . . . . 0.0 118.341 176.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -74.99 91.93 2.55 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 108.394 -0.965 . . . . 0.0 108.394 174.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 33.4 tp -146.42 156.51 43.35 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 -178.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -109.71 146.85 34.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 -178.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -127.16 40.72 3.66 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 -177.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 . . . . . 0 C--O 1.243 0.756 0 N-CA-C 103.651 -2.722 . . . . 0.0 103.651 -178.839 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.922 0.392 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -141.92 162.11 36.3 Favored 'General case' 0 C--O 1.218 -0.585 0 O-C-N 121.935 -0.478 . . . . 0.0 111.546 -179.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 98.0 mt -62.49 -46.26 89.25 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.604 0.964 . . . . 0.0 113.604 -176.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -65.66 -35.32 80.46 Favored 'General case' 0 CA--C 1.509 -0.608 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -63.02 -31.76 72.97 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.021 -179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -63.02 -51.64 65.98 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -64.64 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.294 0.568 . . . . 0.0 111.271 179.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 37.2 t80 -56.58 -50.77 70.97 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 123.264 0.626 . . . . 0.0 111.04 178.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.0 m95 -69.42 -29.12 66.77 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 121.385 -0.822 . . . . 0.0 111.71 179.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 43.7 mmtt -66.3 -42.88 87.69 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 122.073 -0.392 . . . . 0.0 110.064 177.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.426 HD11 HD11 ' A' ' 125' ' ' LEU . 14.8 mm -69.2 -39.54 79.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.35 -44.21 79.86 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 178.164 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.66 -42.53 99.67 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.093 179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -46.47 90.41 Favored 'General case' 0 C--O 1.221 -0.441 0 CA-C-N 116.491 -0.322 . . . . 0.0 110.913 179.507 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 62.2 mt -65.01 -46.24 82.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.156 0.503 . . . . 0.0 110.889 -179.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.8 -38.34 82.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.702 -178.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -78.93 -3.5 45.18 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 121.242 -0.911 . . . . 0.0 112.374 178.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.9 t -96.46 17.44 16.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.058 0.456 . . . . 0.0 110.008 177.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 94.89 -0.77 64.87 Favored Glycine 0 CA--C 1.518 0.246 0 N-CA-C 116.257 1.263 . . . . 0.0 116.257 175.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 58.1 m-85 -75.96 135.47 40.05 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.109 0.955 . . . . 0.0 110.043 178.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -86.77 146.48 20.64 Favored Glycine 0 CA--C 1.505 -0.589 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.1 t -90.19 121.25 40.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 117.794 0.797 . . . . 0.0 109.22 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.6 mt -87.98 -45.66 15.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 106.8 -1.556 . . . . 0.0 106.8 177.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -161.07 147.49 14.79 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 104.73 -2.322 . . . . 0.0 104.73 175.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 115.27 9.75 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -177.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 73.52 40.54 46.99 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.288 -1.125 . . . . 0.0 110.288 178.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 28.3 tp10 -62.57 -41.81 99.16 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 106.795 -1.557 . . . . 0.0 106.795 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 75.0 m -146.08 -65.62 0.3 Allowed 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.178 -1.415 . . . . 0.0 107.178 171.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -139.13 10.44 2.57 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.513 0.673 . . . . 0.0 112.581 178.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -130.66 158.99 38.54 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -176.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 63.6 mt -131.2 131.43 63.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 N-CA-C 105.642 -1.984 . . . . 0.0 105.642 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.8 m95 -110.3 129.65 55.7 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 177.393 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -117.1 133.8 55.55 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.804 -1.089 . . . . 0.0 110.859 -176.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -85.26 124.32 31.76 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 107.531 -1.285 . . . . 0.0 107.531 176.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.35 120.93 83.53 Favored Pre-proline 0 CA--C 1.538 0.496 0 N-CA-C 106.752 -1.573 . . . . 0.0 106.752 177.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -68.55 -22.87 37.75 Favored 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 117.164 -1.424 . . . . 0.0 113.599 -175.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -77.98 -18.49 55.9 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 114.3 1.222 . . . . 0.0 114.3 -176.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 22.7 mtmm 59.76 29.0 18.56 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-O 121.961 0.886 . . . . 0.0 109.509 -175.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 12.9 t -65.91 -177.56 0.49 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 113.872 -1.513 . . . . 0.0 110.243 -179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 51.1 m -45.53 -44.64 12.82 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 177.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -81.68 106.14 13.38 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 170.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -84.86 -24.74 28.42 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 176.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.8 mt -138.38 156.13 47.88 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.345 -178.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 69.9 t -136.74 144.56 32.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 104.81 -2.293 . . . . 0.0 104.81 176.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.02 149.95 46.52 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 119.047 0.84 . . . . 0.0 111.755 174.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -115.4 132.54 56.59 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.663 -1.977 . . . . 0.0 105.663 179.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -136.5 126.81 26.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.206 0.457 . . . . 0.0 112.135 -178.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -95.15 115.13 27.03 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 176.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -150.58 125.26 9.68 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -87.35 111.4 21.04 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 107.399 -1.334 . . . . 0.0 107.399 -179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.507 HD13 ' HG2' ' A' ' 57' ' ' MET . 4.6 mt -106.5 121.05 43.51 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -171.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -91.03 -36.03 14.29 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-O 121.578 0.704 . . . . 0.0 111.773 178.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.0 m-85 -128.14 147.38 50.55 Favored 'General case' 0 N--CA 1.467 0.375 0 O-C-N 121.869 -0.52 . . . . 0.0 111.391 -177.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 11.4 ptt180 -65.29 -20.37 66.38 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -63.54 -33.33 75.35 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 178.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -73.05 -30.57 63.82 Favored 'General case' 0 C--N 1.323 -0.586 0 O-C-N 121.659 -0.651 . . . . 0.0 109.263 179.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.507 ' HG2' HD13 ' A' ' 51' ' ' LEU . 84.5 mtp -66.32 -51.85 53.19 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 178.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.8 m -60.94 -36.42 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 C-N-CA 120.3 -0.56 . . . . 0.0 111.186 -177.016 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -66.12 -36.82 84.16 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -62.04 -40.21 94.97 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.977 0.418 . . . . 0.0 110.022 178.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.406 HD12 ' O ' ' A' ' 57' ' ' MET . 2.5 mp -73.25 -34.2 43.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 121.42 -0.8 . . . . 0.0 111.058 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -58.74 -37.94 77.32 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 177.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 19.8 tp10 -74.87 -43.43 54.5 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.603 0.716 . . . . 0.0 109.881 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.41 HE22 ' ND2' ' A' ' 84' ' ' ASN . 44.9 mt-30 -58.79 -39.38 80.91 Favored 'General case' 0 C--O 1.212 -0.872 0 O-C-N 121.765 -0.584 . . . . 0.0 111.409 178.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.83 -34.41 74.51 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 118.114 0.416 . . . . 0.0 110.505 -178.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 39.3 tp10 -71.62 -42.58 67.48 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 176.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -60.15 -42.86 95.8 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.276 0.56 . . . . 0.0 109.508 176.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 72.4 t -67.46 -39.17 82.03 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 C-N-CA 123.111 0.564 . . . . 0.0 110.336 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -57.55 -41.87 81.83 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.107 0.479 . . . . 0.0 110.736 179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 94.3 mtt180 -65.12 -41.18 95.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.827 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.7 t -68.88 -39.69 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 177.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.4 ttp85 -60.09 -40.74 90.66 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 121.819 -0.55 . . . . 0.0 109.846 178.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 m-70 -63.39 -41.11 98.75 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.906 -0.134 . . . . 0.0 110.845 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -62.55 -41.38 98.86 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.061 0.458 . . . . 0.0 110.899 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.5 mp -80.82 -15.87 55.24 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 -178.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.82 15.58 71.51 Favored Glycine 0 CA--C 1.522 0.486 0 CA-C-O 121.546 0.526 . . . . 0.0 112.227 -177.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 16.5 ttt85 -70.2 140.08 52.43 Favored 'General case' 0 C--N 1.327 -0.413 0 O-C-N 122.153 -0.616 . . . . 0.0 110.617 -175.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.5 mtp180 -64.45 -39.41 93.78 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.798 1.407 . . . . 0.0 114.798 -176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.446 HH22 ' CD ' ' A' ' 105' ' ' GLU . 11.2 mtp180 -148.35 156.37 42.42 Favored 'General case' 0 CA--C 1.506 -0.732 0 N-CA-C 104.798 -2.297 . . . . 0.0 104.798 177.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.0 mmm -131.97 124.34 29.18 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 119.02 -0.514 . . . . 0.0 111.145 -179.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -105.35 135.73 46.19 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 106.392 -1.707 . . . . 0.0 106.392 175.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -130.61 132.84 45.72 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 49.9 tp -94.74 123.51 38.24 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 176.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.41 ' ND2' HE22 ' A' ' 64' ' ' GLN . 36.6 t30 -120.06 114.47 22.03 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 122.159 0.184 . . . . 0.0 111.389 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -111.06 116.86 53.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.989 0.424 . . . . 0.0 111.671 179.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -80.92 152.81 27.88 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.794 -0.639 . . . . 0.0 109.514 176.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -128.09 115.87 19.11 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 104.508 -2.404 . . . . 0.0 104.508 171.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 44.2 t -136.88 151.87 49.58 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 123.474 0.484 . . . . 0.0 110.621 -173.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 87.7 m -67.22 -49.85 63.0 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -120.15 168.53 11.12 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 -176.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -97.32 140.61 22.13 Favored Pre-proline 0 C--N 1.313 -0.991 0 N-CA-C 104.818 -2.29 . . . . 0.0 104.818 176.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -57.1 145.88 83.92 Favored 'Trans proline' 0 C--N 1.345 0.386 0 N-CA-C 114.706 1.002 . . . . 0.0 114.706 -179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.2 m -76.63 -4.24 6.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 N-CA-C 115.091 1.515 . . . . 0.0 115.091 -175.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -120.86 100.46 7.1 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 119.461 -0.304 . . . . 0.0 111.513 -176.377 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 22.53 50.83 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 117.822 2.527 . . . . 0.0 117.822 178.056 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 32.7 p-90 -66.84 -22.84 65.98 Favored 'General case' 0 C--N 1.321 -0.66 0 O-C-N 121.488 -0.758 . . . . 0.0 112.276 -178.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 89.0 mt-10 -63.06 -31.25 72.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 121.914 -0.491 . . . . 0.0 110.742 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -63.78 -34.82 78.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 177.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.2 mm -63.99 -38.53 82.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.636 0 C-N-CA 122.486 0.314 . . . . 0.0 110.283 -177.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.13 -25.78 68.52 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.035 0.445 . . . . 0.0 111.181 -179.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -90.81 -2.33 57.78 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 -179.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 62.8 mttm -96.0 102.34 14.12 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.957 -0.465 . . . . 0.0 111.749 -179.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 93.1 m -68.4 118.76 11.88 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 103.039 -2.948 . . . . 0.0 103.039 169.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -82.93 110.77 18.21 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . 0.446 ' CD ' HH22 ' A' ' 79' ' ' ARG . 5.1 mt-10 -107.81 121.12 44.08 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 122.094 0.949 . . . . 0.0 110.257 -179.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 13.4 tttt -119.62 78.52 1.33 Allowed 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 66.53 -112.62 5.04 Favored Glycine 0 C--O 1.221 -0.694 0 C-N-CA 119.684 -1.246 . . . . 0.0 110.448 -179.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.7 p -76.81 -19.93 56.98 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 122.248 -0.56 . . . . 0.0 112.342 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.5 t -89.12 146.66 5.9 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 O-C-N 122.091 -0.38 . . . . 0.0 110.997 -177.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 57.8 p -137.88 139.91 40.11 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 106.312 -1.736 . . . . 0.0 106.312 171.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 69.8 t -132.48 136.85 55.47 Favored 'Isoleucine or valine' 0 CA--C 1.482 -1.638 0 CA-C-O 122.021 0.915 . . . . 0.0 109.799 179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -106.13 103.09 43.42 Favored Pre-proline 0 N--CA 1.428 -1.56 0 CA-C-N 113.178 -1.828 . . . . 0.0 109.434 -177.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -82.25 152.73 16.11 Favored 'Trans proline' 0 C--N 1.347 0.47 0 N-CA-C 114.129 0.78 . . . . 0.0 114.129 -179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -154.57 158.05 39.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 104.677 -2.342 . . . . 0.0 104.677 175.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.4 tt -149.66 128.48 3.21 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 118.369 0.531 . . . . 0.0 109.873 -178.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 81.3 t -100.08 116.97 44.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 N-CA-C 105.552 -2.018 . . . . 0.0 105.552 175.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.82 139.96 38.82 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 179.454 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.54 -27.8 68.62 Favored Glycine 0 C--N 1.322 -0.2 0 CA-C-N 116.056 -0.52 . . . . 0.0 114.153 -177.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 27.0 p -54.01 -33.82 58.22 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 114.47 1.285 . . . . 0.0 114.47 -177.278 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -140.59 30.89 1.88 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.529 0.68 . . . . 0.0 110.107 -179.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 6.9 tt -44.85 -36.96 3.54 Favored 'General case' 0 C--O 1.215 -0.727 0 N-CA-C 115.568 1.692 . . . . 0.0 115.568 -175.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 18.3 ptp180 -55.61 -51.38 67.37 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -78.78 -38.56 38.2 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.976 0.893 . . . . 0.0 111.114 178.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.58 -38.09 86.28 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.319 -0.855 . . . . 0.0 111.975 -175.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.426 HD11 HD11 ' A' ' 11' ' ' ILE . 2.7 tm? -63.24 -49.43 74.15 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.673 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -72.72 -16.12 61.67 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 120.985 -0.286 . . . . 0.0 111.391 -177.301 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.05 -34.97 64.25 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 177.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 46.6 t -91.35 -42.19 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 CA-C-O 121.245 0.545 . . . . 0.0 110.285 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.9 76.53 66.2 Favored Pre-proline 0 C--N 1.324 -0.512 0 C-N-CA 122.93 0.492 . . . . 0.0 111.734 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.67 -11.92 33.23 Favored 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 118.325 -0.65 . . . . 0.0 113.123 179.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -75.84 -12.82 60.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.905 177.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -90.85 131.19 36.64 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 20.5 ttm180 -79.04 105.18 10.2 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 177.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 5.9 t -58.12 -17.22 16.81 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 113.332 0.864 . . . . 0.0 113.332 -176.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -57.76 -35.17 70.39 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 123.906 0.882 . . . . 0.0 110.722 174.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -71.74 -5.61 35.24 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.415 0.626 . . . . 0.0 111.022 -179.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 12.8 t -130.23 34.83 4.16 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 177.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 40.8 t -56.94 151.34 14.91 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.116 -179.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -60.15 -26.77 66.55 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.958 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -62.16 -23.92 66.87 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.781 -0.645 . . . . 0.0 111.238 178.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 70.3 m80 -119.17 14.99 13.15 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.88 -177.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.41 67.92 5.28 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.283 0.563 . . . . 0.0 111.301 179.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 31.2 t -109.42 143.06 39.51 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 176.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -66.69 -28.93 68.84 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.992 0.425 . . . . 0.0 110.364 179.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -70.49 -35.36 73.21 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.663 0.744 . . . . 0.0 110.532 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 44.8 m-20 -59.34 -24.38 63.31 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 111.433 -178.3 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -56.16 -37.26 69.3 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -64.97 -43.49 92.46 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 37.3 mtt -64.09 -36.59 84.51 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.815 -0.63 . . . . 0.0 109.369 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.27 -38.28 89.82 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.271 178.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 66.9 ttt-85 -65.47 -43.04 91.52 Favored 'General case' 0 CA--C 1.507 -0.675 0 CA-C-O 121.007 0.432 . . . . 0.0 109.921 177.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -64.43 -41.98 96.27 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 121.472 0.653 . . . . 0.0 109.772 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -42.39 99.5 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.111 -0.495 . . . . 0.0 109.714 177.562 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -62.74 -43.02 99.88 Favored 'General case' 0 C--O 1.213 -0.818 0 C-N-CA 122.82 0.448 . . . . 0.0 112.15 178.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.35 -37.31 86.79 Favored 'General case' 0 C--N 1.321 -0.672 0 O-C-N 121.585 -0.697 . . . . 0.0 109.948 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 21.5 m -67.64 -33.39 74.86 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.688 0.756 . . . . 0.0 110.673 176.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.81 -38.56 73.31 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.669 179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 25.2 t -56.14 -42.48 72.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.93 -38.54 88.83 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.518 -0.473 . . . . 0.0 111.317 -179.22 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 48.7 tttt -63.81 -37.5 87.62 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 121.733 -0.604 . . . . 0.0 110.405 177.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.18 -31.95 61.8 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 -176.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -57.5 -46.0 84.26 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 122.043 0.925 . . . . 0.0 110.81 177.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -76.94 -40.18 48.03 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.758 0.789 . . . . 0.0 110.359 178.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -61.41 -51.47 68.63 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -174.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 39.2 mtp180 -60.41 -37.32 80.48 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.371 0.987 . . . . 0.0 110.374 -177.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -61.75 -50.09 73.79 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 114.984 -1.007 . . . . 0.0 110.561 -178.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 14.5 m -72.35 -43.66 63.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.632 -179.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -63.07 -42.44 99.68 Favored 'General case' 0 C--N 1.323 -0.555 0 C-N-CA 123.847 0.859 . . . . 0.0 112.74 -176.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.3 -44.22 84.09 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.356 178.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 50.86 25.37 2.14 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 123.986 0.803 . . . . 0.0 110.014 -174.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 16.6 t 67.42 -59.2 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 126.402 1.881 . . . . 0.0 113.036 -176.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . 0.41 ' HB3' ' H ' ' A' ' 173' ' ' GLN . 0.5 OUTLIER 55.4 -143.21 0.75 Allowed 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 123.87 0.868 . . . . 0.0 109.009 176.963 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . 0.41 ' H ' ' HB3' ' A' ' 172' ' ' PHE . 76.2 mm-40 -142.78 166.55 24.34 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -58.5 139.17 56.07 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -175.15 -141.89 3.88 Favored Glycine 0 C--O 1.221 -0.683 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 -177.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 68.8 tttt 57.87 85.7 0.09 Allowed 'General case' 0 N--CA 1.479 0.991 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 66.6 tp -69.4 129.56 40.09 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 105.54 -2.022 . . . . 0.0 105.54 173.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 15.0 tt0 -129.06 172.67 11.17 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -177.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 36.1 ptt85 -146.34 166.31 26.71 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 -179.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -113.59 171.6 7.48 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 105.403 -2.073 . . . . 0.0 105.403 175.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -83.42 153.9 24.26 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.048 0.451 . . . . 0.0 110.763 -178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -84.04 167.16 17.11 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 175.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 7.0 p90 -74.63 135.85 41.97 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -99.24 4.31 46.6 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 . . . . . 0 C--O 1.246 0.891 0 CA-C-N 114.526 -1.216 . . . . 0.0 109.557 -177.726 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 ptt? . . . . . 0 N--CA 1.497 1.878 0 N-CA-C 110.213 -0.292 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.419 ' HA ' ' HB2' ' A' ' 5' ' ' GLU . 37.7 m-85 -54.57 -36.55 64.48 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 -169.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.2 -42.43 99.3 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.988 0.899 . . . . 0.0 109.516 179.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -73.68 -36.51 65.31 Favored 'General case' 0 C--O 1.207 -1.134 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.946 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.419 ' HB2' ' HA ' ' A' ' 2' ' ' PHE . 0.9 OUTLIER -59.96 -39.18 84.74 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.059 0.39 . . . . 0.0 109.961 177.683 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -60.03 -53.14 61.27 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 109.075 -0.713 . . . . 0.0 109.075 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.9 m -63.05 -42.92 99.82 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.241 0.544 . . . . 0.0 111.114 -179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -56.91 -51.28 69.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 123.496 0.718 . . . . 0.0 112.14 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -71.31 -28.75 64.32 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.165 -0.614 . . . . 0.0 111.605 -179.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -68.74 -36.48 78.45 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.664 -0.647 . . . . 0.0 109.511 176.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.537 HD11 HD11 ' A' ' 125' ' ' LEU . 22.2 mm -72.88 -36.01 50.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.72 -45.62 85.52 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 176.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.02 -41.89 97.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.887 177.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 84.8 t60 -57.51 -49.87 74.91 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.549 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.5 mp -68.24 -49.87 57.8 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 120.715 -0.394 . . . . 0.0 111.299 -178.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 69.5 t -61.39 -39.45 82.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 C-N-CA 120.541 -0.464 . . . . 0.0 111.722 -175.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -11.67 61.09 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.263 -0.898 . . . . 0.0 111.855 178.838 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 39.0 m -95.92 11.53 33.51 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 122.559 0.344 . . . . 0.0 110.32 178.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.25 -3.57 56.78 Favored Glycine 0 C--O 1.228 -0.26 0 N-CA-C 116.176 1.23 . . . . 0.0 116.176 175.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -66.79 126.14 28.1 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.065 0.932 . . . . 0.0 108.886 178.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -83.89 135.71 14.06 Favored Glycine 0 C--O 1.227 -0.318 0 N-CA-C 110.524 -1.031 . . . . 0.0 110.524 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 88.1 t -79.45 124.08 37.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 117.496 0.648 . . . . 0.0 109.258 179.431 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.6 mt -96.08 -45.5 13.06 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -148.56 141.96 25.25 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.41 105.37 4.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 117.941 0.337 . . . . 0.0 111.088 178.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.04 45.21 6.74 Favored Glycine 0 C--O 1.226 -0.4 0 C-N-CA 120.597 -0.811 . . . . 0.0 114.937 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.25 -37.85 88.96 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 104.04 -2.578 . . . . 0.0 104.04 174.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 33.1 t -151.36 -64.49 0.18 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 113.934 -1.485 . . . . 0.0 108.777 169.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -139.36 14.33 2.58 Favored 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 114.276 1.213 . . . . 0.0 114.276 -173.608 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -131.2 159.46 37.68 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 -176.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 72.2 mt -132.59 125.89 53.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 N-CA-C 105.46 -2.052 . . . . 0.0 105.46 174.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -99.14 129.63 45.41 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 177.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.86 138.27 54.7 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.914 -178.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -81.59 129.78 34.81 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 106.951 -1.5 . . . . 0.0 106.951 174.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.23 118.07 68.68 Favored Pre-proline 0 CA--C 1.543 0.695 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -74.37 -21.13 17.74 Favored 'Trans proline' 0 C--N 1.348 0.508 0 C-N-CA 116.862 -1.625 . . . . 0.0 113.894 -175.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 30.6 p-10 -77.44 -22.14 51.89 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -177.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.6 mttp 56.54 34.36 24.25 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 123.075 1.417 . . . . 0.0 111.092 175.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 92.5 p -74.48 -172.91 1.6 Allowed 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 112.325 -2.216 . . . . 0.0 107.438 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.8 m -42.23 -28.24 0.18 Allowed 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 112.675 0.621 . . . . 0.0 112.675 172.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 95.3 m-70 -91.22 129.25 37.23 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 173.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.3 t0 -105.71 -41.46 5.44 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 179.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 31.4 mt -132.15 154.67 49.28 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.13 0.491 . . . . 0.0 111.264 -179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 74.2 t -129.93 139.23 52.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 177.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 15.6 ttp180 -125.19 120.09 30.35 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 175.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.2 mt -96.02 120.54 36.49 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 104.035 -2.58 . . . . 0.0 104.035 175.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 29.9 t80 -135.09 127.93 31.26 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 118.937 0.789 . . . . 0.0 111.403 -175.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -103.18 105.78 16.16 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 122.018 0.913 . . . . 0.0 112.208 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 60.5 t60 -151.56 131.53 13.39 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.313 178.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -82.24 151.29 26.89 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 176.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.8 mt -134.54 141.97 46.85 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.827 0.285 . . . . 0.0 110.432 -174.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 t0 -94.9 -45.64 7.2 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 177.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -128.4 154.62 45.82 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -178.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -64.3 -15.32 60.0 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.989 176.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 21.0 mm-40 -64.45 -34.93 79.35 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.26 178.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -75.81 -41.63 52.21 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 107.556 -1.275 . . . . 0.0 107.556 175.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -58.74 -47.75 83.54 Favored 'General case' 0 C--O 1.214 -0.79 0 CA-C-N 114.958 -1.019 . . . . 0.0 112.358 -176.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.4 m -65.08 -34.73 72.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.993 -179.344 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 83.5 mtt85 -71.14 -32.43 68.95 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 -177.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -58.85 -42.62 89.75 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.985 -1.117 . . . . 0.0 107.985 176.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.8 mp -71.49 -37.16 63.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 C-N-CA 120.627 -0.429 . . . . 0.0 110.975 179.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -62.07 -33.39 74.32 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 119.067 0.849 . . . . 0.0 109.688 -179.032 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.2 tp10 -74.29 -44.94 50.65 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 174.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -36.21 73.86 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 121.833 -0.542 . . . . 0.0 111.308 -179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.28 -43.93 72.88 Favored 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 35.5 tp10 -59.79 -42.68 93.9 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 178.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.6 mmt85 -63.78 -56.93 11.81 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 121.707 0.765 . . . . 0.0 113.044 178.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.9 p -64.14 -30.41 49.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-N 115.03 -0.986 . . . . 0.0 110.86 -173.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -54.17 -37.48 64.52 Favored 'General case' 0 C--O 1.238 0.474 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mpt_? -64.43 -42.82 95.81 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.069 -0.653 . . . . 0.0 109.837 -178.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 17.7 t -68.28 -37.93 78.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.419 0.628 . . . . 0.0 109.734 -178.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.46 -42.73 98.63 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.703 -178.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 51.6 m80 -67.53 -35.96 80.1 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.648 178.61 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -30.49 71.42 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.78 -9.6 58.68 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 177.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.22 18.29 71.06 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.356 -0.698 . . . . 0.0 111.356 -175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 24.4 ttt180 -76.55 121.96 23.91 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 122.011 -0.7 . . . . 0.0 110.407 -175.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 69.3 mtp180 -66.53 -35.39 80.12 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 115.032 1.493 . . . . 0.0 115.032 -176.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 11.7 ptm180 -157.58 149.72 22.45 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 172.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.4 tmm? -147.34 126.15 12.68 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 118.399 -0.81 . . . . 0.0 111.958 -173.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 32.0 mttt -88.24 117.39 27.12 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 119.502 1.047 . . . . 0.0 111.309 177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.05 121.91 34.06 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 106.029 -1.841 . . . . 0.0 106.029 176.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 59.2 tp -87.39 100.27 12.61 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 176.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -100.28 113.27 25.84 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 -178.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.2 t -114.4 111.19 34.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 N-CA-C 112.334 0.494 . . . . 0.0 112.334 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -79.73 144.66 33.44 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 175.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.39 116.76 25.39 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 102.737 -3.06 . . . . 0.0 102.737 172.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 87.7 p -136.12 152.16 50.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -172.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 23.9 m -67.18 -48.62 67.4 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -138.55 157.92 45.24 Favored 'General case' 0 N--CA 1.441 -0.914 0 N-CA-C 104.739 -2.319 . . . . 0.0 104.739 -176.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -83.59 152.64 63.96 Favored Pre-proline 0 C--N 1.312 -1.048 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.14 -179.421 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -64.53 149.74 89.41 Favored 'Trans proline' 0 CA--C 1.534 0.501 0 C-N-CA 117.632 -1.112 . . . . 0.0 112.059 177.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.02 -6.9 9.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.583 0 N-CA-C 119.021 2.971 . . . . 0.0 119.021 -169.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -126.91 112.89 15.83 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 114.479 1.288 . . . . 0.0 114.479 -173.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 21.07 45.71 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 118.977 2.954 . . . . 0.0 118.977 175.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.437 ' HA ' HG12 ' A' ' 99' ' ' ILE . 52.1 p-90 -72.11 -15.52 61.99 Favored 'General case' 0 N--CA 1.439 -0.999 0 O-C-N 121.133 -0.979 . . . . 0.0 110.796 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -64.38 -31.3 72.45 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.539 -0.726 . . . . 0.0 111.202 178.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -58.89 -37.23 76.11 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 174.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.437 HG12 ' HA ' ' A' ' 96' ' ' TRP . 7.4 mm -67.45 -40.97 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -178.654 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -62.42 -32.82 73.72 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.264 0.554 . . . . 0.0 111.881 -178.901 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.5 mptt -88.48 2.49 52.75 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.251 0.548 . . . . 0.0 110.289 -178.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 9.8 ttpp -114.51 103.06 10.66 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 123.169 0.587 . . . . 0.0 111.849 -176.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 81.9 m -68.35 126.92 31.12 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 105.584 -2.006 . . . . 0.0 105.584 174.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -83.78 117.73 23.45 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 179.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -116.74 135.62 53.62 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.703 0.763 . . . . 0.0 111.072 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -144.41 85.82 1.8 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.66 -178.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.69 5.21 Favored Glycine 0 C--O 1.225 -0.456 0 C-N-CA 120.191 -1.004 . . . . 0.0 112.436 178.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.7 p -82.75 10.21 8.09 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.7 t -122.29 144.53 31.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -176.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -136.56 144.01 43.97 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 100.826 -3.768 . . . . 0.0 100.826 169.813 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.8 t -138.54 134.44 43.3 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.953 0 CA-C-N 119.449 1.022 . . . . 0.0 109.01 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -99.45 114.56 65.67 Favored Pre-proline 0 C--N 1.32 -0.688 0 N-CA-C 106.366 -1.716 . . . . 0.0 106.366 177.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -82.16 62.85 8.16 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 121.839 1.692 . . . . 0.0 113.76 -178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -71.01 147.2 48.86 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 -179.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 7.7 tt -148.15 138.11 16.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -178.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 59.4 t -110.62 114.09 46.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 N-CA-C 106.73 -1.582 . . . . 0.0 106.73 175.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.8 137.24 35.15 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.127 -1.434 . . . . 0.0 107.127 176.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -21.14 65.03 Favored Glycine 0 C--O 1.227 -0.294 0 C-N-CA 121.343 -0.456 . . . . 0.0 114.141 -177.408 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 119' ' ' THR . 30.6 p -59.65 -31.56 69.64 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 -177.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptm -140.43 34.2 1.86 Allowed 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 -179.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 3.9 tt -42.13 -42.86 3.1 Favored 'General case' 0 C--O 1.214 -0.771 0 N-CA-C 117.187 2.292 . . . . 0.0 117.187 -172.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 44.7 ttm180 -61.04 -51.31 69.72 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 118.631 0.65 . . . . 0.0 112.255 -176.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -74.08 -35.54 64.24 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.528 0.68 . . . . 0.0 111.798 -179.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -67.84 -36.41 80.28 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.842 0.83 . . . . 0.0 111.512 -178.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.537 HD11 HD11 ' A' ' 11' ' ' ILE . 3.4 tm? -68.51 -43.38 76.96 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.994 -179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.6 pt20 -70.75 -14.73 62.55 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.133 -176.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.68 -34.04 66.92 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 176.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -94.38 -36.77 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 179.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -126.07 77.65 71.12 Favored Pre-proline 0 C--N 1.326 -0.42 0 O-C-N 122.232 -0.292 . . . . 0.0 110.924 178.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_endo -69.45 -9.33 25.93 Favored 'Trans proline' 0 C--N 1.347 0.483 0 N-CA-C 113.704 0.617 . . . . 0.0 113.704 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.0 p -83.5 -9.72 58.79 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 122.73 0.412 . . . . 0.0 111.852 178.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -80.98 141.64 34.24 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.191 0.52 . . . . 0.0 111.434 -177.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -86.47 127.2 34.83 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.276 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.55 -21.16 66.58 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.455 0.645 . . . . 0.0 110.386 177.168 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 7.4 mp0 -70.52 -21.1 62.77 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.947 179.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -92.5 7.32 43.68 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.771 0.795 . . . . 0.0 108.933 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 4.5 t -143.9 40.11 1.38 Allowed 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 176.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 33.4 m -61.5 145.22 52.59 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.491 179.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -60.93 -35.35 76.47 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.557 0.694 . . . . 0.0 112.142 -177.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 65.4 tt0 -59.1 -33.75 71.2 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.836 178.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 65.6 m80 -97.94 11.29 37.95 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.552 -0.749 . . . . 0.0 112.594 -175.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -77.58 10.29 2.75 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -178.009 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 42.6 t -60.44 151.01 29.31 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.568 0.699 . . . . 0.0 112.788 -179.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 31.8 p90 -61.68 -28.72 69.6 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.341 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -64.4 -44.79 90.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 178.136 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -70.28 -24.5 63.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.955 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -62.4 -37.02 84.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.298 0.57 . . . . 0.0 109.483 175.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 59.8 mt-30 -73.88 -40.82 62.93 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 179.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.1 mtt -65.14 -30.79 71.74 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-O 120.693 0.282 . . . . 0.0 110.742 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.46 -38.48 91.29 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.9 ttt-85 -67.63 -44.75 77.23 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 177.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -61.34 -42.85 99.36 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.648 0.737 . . . . 0.0 109.869 -178.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 65.6 ttt180 -58.86 -44.83 91.12 Favored 'General case' 0 C--O 1.215 -0.759 0 CA-C-N 115.512 -0.767 . . . . 0.0 109.15 176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -62.57 -41.06 98.69 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -64.81 -32.27 73.88 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.819 -0.55 . . . . 0.0 109.832 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.94 -35.16 59.82 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 122.155 0.979 . . . . 0.0 110.538 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -64.67 -37.55 87.98 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -176.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 11.1 p -60.03 -37.17 71.52 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-N 118.838 0.744 . . . . 0.0 110.946 -178.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -72.87 -38.71 66.9 Favored 'General case' 0 C--N 1.327 -0.395 0 O-C-N 121.196 -0.94 . . . . 0.0 108.64 177.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -59.12 -29.74 67.61 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.176 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.9 -28.58 51.65 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 122.292 -0.255 . . . . 0.0 110.947 178.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -68.45 -39.33 81.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.596 0.712 . . . . 0.0 110.48 -178.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 52.0 tp10 -67.27 -39.68 86.09 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 177.513 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -70.89 -44.22 66.72 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 115.346 1.61 . . . . 0.0 115.346 179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 9.3 ptm180 -65.78 -22.44 66.57 Favored 'General case' 0 N--CA 1.473 0.722 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -174.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.5 pttt -69.51 -17.93 63.63 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.714 -0.616 . . . . 0.0 112.226 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 81.8 p -67.1 -14.06 62.54 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 114.265 1.209 . . . . 0.0 114.265 -175.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -55.55 -24.49 32.57 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 178.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -58.4 -22.37 53.79 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 177.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -108.8 104.47 13.74 Favored 'General case' 0 C--O 1.221 -0.424 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 176.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 33.1 m -61.95 142.52 16.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 121.867 0.841 . . . . 0.0 113.203 -176.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -150.11 170.12 19.67 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 106.363 -1.717 . . . . 0.0 106.363 179.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -144.89 138.91 27.28 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 177.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 8.2 p-10 -158.33 161.1 37.61 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 149.02 -174.34 28.66 Favored Glycine 0 N--CA 1.454 -0.128 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 178.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 38.3 pttt -155.96 167.76 29.37 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 103.945 -2.613 . . . . 0.0 103.945 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -135.02 141.37 46.15 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -147.81 171.37 15.81 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 105.757 -1.942 . . . . 0.0 105.757 177.202 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -157.6 150.99 23.64 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 -178.669 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -129.99 168.58 16.47 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 106.979 -1.489 . . . . 0.0 106.979 177.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -153.49 157.26 39.57 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 175.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 33.5 tp -140.55 152.8 45.82 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 106.56 -1.645 . . . . 0.0 106.56 178.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 6.2 p90 -155.18 164.43 38.84 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 104.142 -2.54 . . . . 0.0 104.142 -178.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -129.12 -11.19 4.72 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.262 0.553 . . . . 0.0 110.127 179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 . . . . . 0 C--O 1.244 0.769 0 N-CA-C 101.256 -3.609 . . . . 0.0 101.256 177.902 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 ttp . . . . . 0 N--CA 1.487 1.388 0 CA-C-O 119.416 -0.326 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -68.69 147.35 51.97 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 107.363 -1.347 . . . . 0.0 107.363 179.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -52.48 -38.99 60.65 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.159 1.17 . . . . 0.0 114.159 -174.43 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 71.4 mt -54.94 -35.23 64.01 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 47.7 mt-10 -56.81 -26.01 57.02 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.535 0.568 . . . . 0.0 112.535 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -58.37 -49.4 77.37 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.792 -0.447 . . . . 0.0 109.792 179.2 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 m -71.82 -41.77 67.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.0 0.428 . . . . 0.0 110.934 178.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.478 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 64.1 t80 -56.05 -56.22 23.43 Favored 'General case' 0 N--CA 1.469 0.509 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -178.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -67.61 -29.73 69.13 Favored 'General case' 0 C--N 1.326 -0.422 0 O-C-N 121.853 -0.529 . . . . 0.0 110.766 -178.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 62.6 mttt -69.12 -39.42 78.92 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 120.048 -0.661 . . . . 0.0 111.352 177.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.613 HD11 HD11 ' A' ' 125' ' ' LEU . 8.2 mm -62.24 -46.22 96.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 177.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -42.18 79.48 Favored 'General case' 0 C--N 1.328 -0.37 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 179.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.51 -44.37 94.5 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 178.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 55.0 m-70 -60.83 -46.33 90.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -178.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.3 mt -66.53 -51.44 56.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.936 -176.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 46.9 t -56.04 -46.74 80.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 120.428 -0.509 . . . . 0.0 110.81 179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.455 ' HA ' ' HG2' ' A' ' 161' ' ' GLN . 0.0 OUTLIER -63.37 -22.03 66.64 Favored 'General case' 0 N--CA 1.469 0.519 0 O-C-N 121.756 -0.59 . . . . 0.0 112.431 -178.313 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 24.3 m -87.19 1.08 54.21 Favored 'General case' 0 N--CA 1.466 0.34 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.02 -0.94 27.06 Favored Glycine 0 C--O 1.228 -0.277 0 N-CA-C 115.898 1.119 . . . . 0.0 115.898 176.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -68.0 122.66 18.68 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 118.377 1.088 . . . . 0.0 108.438 178.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.79 116.3 4.25 Favored Glycine 0 CA--C 1.507 -0.424 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -178.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -71.81 111.98 6.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 178.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.1 mt -75.6 -42.9 41.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 178.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -143.01 116.45 9.09 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.139 -0.937 . . . . 0.0 108.904 -176.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -139.91 112.96 8.19 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.996 -1.113 . . . . 0.0 107.996 177.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.49 -50.85 0.06 OUTLIER Glycine 0 CA--C 1.506 -0.493 0 N-CA-C 110.367 -1.093 . . . . 0.0 110.367 179.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -67.06 161.04 25.35 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 176.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 34.1 m -100.26 -7.03 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 176.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -88.99 -44.94 10.04 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-N 113.376 -1.738 . . . . 0.0 111.004 -175.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.422 ' CD ' HH21 ' A' ' 45' ' ' ARG . 11.2 pt-20 -139.56 148.52 42.69 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 86.0 mt -140.1 132.26 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 176.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 69.1 m95 -108.3 136.02 48.64 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 118.059 0.39 . . . . 0.0 109.968 176.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 mp -131.16 129.98 42.45 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 123.346 0.658 . . . . 0.0 109.749 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -79.58 136.41 36.85 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 175.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.34 115.29 41.85 Favored Pre-proline 0 CA--C 1.546 0.795 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -76.48 -25.56 9.51 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 117.334 -1.311 . . . . 0.0 112.668 -177.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.0 -9.85 59.31 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 123.883 0.873 . . . . 0.0 111.482 -179.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 35.5 mmtt 57.34 45.49 20.0 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 -178.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 9.4 t -60.13 -177.69 0.07 Allowed 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 112.433 -2.167 . . . . 0.0 112.955 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 49.9 p -55.88 -29.02 59.31 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.239 179.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -109.36 136.96 47.95 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 105.946 -1.872 . . . . 0.0 105.946 173.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -80.18 -30.54 38.8 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.725 -175.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 91.0 mt -137.57 162.45 33.71 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.186 -176.412 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 94.3 t -129.59 135.39 61.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 105.624 -1.991 . . . . 0.0 105.624 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.422 HH21 ' CD ' ' A' ' 30' ' ' GLU . 59.1 ttt180 -125.01 134.59 52.52 Favored 'General case' 0 CA--C 1.509 -0.618 0 N-CA-C 106.396 -1.705 . . . . 0.0 106.396 175.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -106.2 129.56 54.23 Favored 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 104.427 -2.434 . . . . 0.0 104.427 177.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -136.43 132.56 35.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 117.891 0.314 . . . . 0.0 110.736 -177.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.7 tmtm? -106.76 110.8 23.07 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 121.832 -0.542 . . . . 0.0 109.673 -179.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -151.52 144.91 24.8 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 178.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 95.8 m-20 -106.77 101.22 10.67 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 106.098 -1.816 . . . . 0.0 106.098 177.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.65 135.57 35.53 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 -178.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -92.29 -37.27 12.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 175.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -126.27 150.86 48.15 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.009 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 23.8 ptt180 -65.02 -15.54 62.44 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.854 -0.529 . . . . 0.0 110.998 176.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -63.38 -36.33 83.37 Favored 'General case' 0 C--O 1.212 -0.912 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -73.47 -40.52 64.07 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.8 ttm -57.39 -48.75 78.26 Favored 'General case' 0 C--O 1.216 -0.702 0 C-N-CA 120.934 -0.306 . . . . 0.0 111.0 178.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.33 -31.84 54.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.979 0 CA-C-N 118.832 0.742 . . . . 0.0 112.108 -179.29 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 61.0 mtt180 -66.82 -41.21 87.86 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -179.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 91.1 m-20 -60.28 -36.29 77.49 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.85 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.5 mm -64.38 -30.81 51.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 121.626 -0.671 . . . . 0.0 112.243 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -63.39 -36.87 85.15 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 176.808 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 10.7 tm-20 -72.38 -38.69 68.42 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 177.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -56.58 -49.89 73.54 Favored 'General case' 0 C--O 1.222 -0.39 0 N-CA-C 107.101 -1.444 . . . . 0.0 107.101 177.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.66 -27.94 68.73 Favored 'General case' 0 N--CA 1.44 -0.942 0 N-CA-C 112.952 0.723 . . . . 0.0 112.952 -178.349 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.97 -46.06 83.09 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 175.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 mmt85 -66.48 -42.59 87.25 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 179.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 98.5 t -65.93 -40.83 88.55 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 119.034 -0.507 . . . . 0.0 112.116 -178.365 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.9 pt-20 -68.31 -33.34 74.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 120.014 1.279 . . . . 0.0 109.999 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 60.3 ttm-85 -64.05 -42.12 97.15 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 176.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 72.6 t -68.66 -41.68 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.46 -0.57 . . . . 0.0 109.46 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -57.03 -41.37 78.48 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.795 0.438 . . . . 0.0 111.35 -179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.5 t-80 -62.23 -40.54 96.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.758 0.314 . . . . 0.0 110.883 -179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -73.27 -41.86 63.14 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 120.739 0.304 . . . . 0.0 111.791 -178.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.5 mp -75.69 -17.94 59.78 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 112.608 0.595 . . . . 0.0 112.608 -178.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 71.47 7.18 63.71 Favored Glycine 0 CA--C 1.52 0.351 0 C-N-CA 121.335 -0.46 . . . . 0.0 113.444 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 66.8 mtp85 -65.42 140.45 58.63 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 122.068 -0.666 . . . . 0.0 109.356 -179.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -63.02 -32.45 73.82 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.613 -178.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.7 ttt85 -150.73 154.04 36.64 Favored 'General case' 0 N--CA 1.467 0.414 0 N-CA-C 105.559 -2.015 . . . . 0.0 105.559 177.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 29.7 mmm -124.38 150.36 45.66 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 109.022 -0.732 . . . . 0.0 109.022 177.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 15.7 mttt -127.33 142.43 51.45 Favored 'General case' 0 N--CA 1.471 0.603 0 O-C-N 123.554 0.534 . . . . 0.0 109.651 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -142.35 124.81 15.68 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.922 0.391 . . . . 0.0 111.198 -176.339 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.6 tp -90.87 108.08 19.61 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 176.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -102.09 111.52 23.82 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 10.8 t -100.98 106.87 20.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-O 121.061 0.458 . . . . 0.0 112.002 -177.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -75.69 139.68 42.08 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 175.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -118.22 113.23 21.2 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 105.881 -1.896 . . . . 0.0 105.881 172.161 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 15.2 m -128.28 155.0 45.29 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -173.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.6 m -67.16 -48.39 68.15 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.818 0.818 . . . . 0.0 108.908 178.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -144.27 170.87 15.17 Favored 'General case' 0 N--CA 1.44 -0.959 0 N-CA-C 102.878 -3.008 . . . . 0.0 102.878 -177.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.93 151.16 43.11 Favored Pre-proline 0 C--N 1.314 -0.966 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -62.16 151.51 81.56 Favored 'Trans proline' 0 C--N 1.347 0.461 0 O-C-N 122.194 0.576 . . . . 0.0 112.307 176.422 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.5 m -63.62 -18.39 22.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.474 0 N-CA-C 121.176 3.769 . . . . 0.0 121.176 -167.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -150.21 137.93 19.96 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 116.241 1.941 . . . . 0.0 116.241 -175.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.1 t0 37.87 24.1 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 119.179 3.029 . . . . 0.0 119.179 176.228 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 30.6 p-90 -67.59 -22.32 65.37 Favored 'General case' 0 C--N 1.317 -0.822 0 O-C-N 120.742 -1.224 . . . . 0.0 110.376 179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -61.25 -31.26 71.06 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.06 -0.4 . . . . 0.0 111.944 -178.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -59.77 -36.44 76.67 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 176.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 7.8 mm -66.04 -39.58 84.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.911 -175.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -75.26 -14.7 60.53 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.35 0.595 . . . . 0.0 111.658 178.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 85.3 mttt -100.16 3.28 43.69 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.789 -177.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.1 ptmm? -124.2 144.6 49.84 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.598 0.714 . . . . 0.0 110.979 179.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 75.7 m -79.89 147.16 31.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 104.468 -2.419 . . . . 0.0 104.468 172.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -107.61 123.67 48.81 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 104.571 -2.381 . . . . 0.0 104.571 173.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -125.95 130.94 52.25 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 121.455 0.645 . . . . 0.0 109.645 179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -123.05 75.52 1.3 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 178.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.36 -112.65 3.7 Favored Glycine 0 C--O 1.224 -0.528 0 C-N-CA 119.722 -1.228 . . . . 0.0 111.15 -179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 45.2 p -93.19 22.15 5.34 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.532 0.682 . . . . 0.0 110.975 -178.192 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 54.2 t -123.86 141.03 45.51 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 13.7 t -127.68 140.92 51.78 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 104.286 -2.487 . . . . 0.0 104.286 170.498 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.2 t -135.86 138.5 47.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 N-CA-C 105.939 -1.874 . . . . 0.0 105.939 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -114.33 114.44 45.45 Favored Pre-proline 0 C--N 1.319 -0.742 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 176.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -78.08 157.73 30.4 Favored 'Trans proline' 0 C--N 1.346 0.434 0 C-N-CA 115.955 -2.23 . . . . 0.0 111.122 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -149.09 149.78 31.64 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 103.023 -2.954 . . . . 0.0 103.023 175.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -147.88 137.33 16.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 118.776 0.716 . . . . 0.0 109.602 -178.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 83.1 t -114.18 117.27 55.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.623 0 N-CA-C 106.111 -1.811 . . . . 0.0 106.111 176.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.2 140.42 36.5 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 104.563 -2.384 . . . . 0.0 104.563 177.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.52 -22.68 61.78 Favored Glycine 0 C--N 1.322 -0.222 0 C-N-CA 121.06 -0.591 . . . . 0.0 113.823 -176.288 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 37.2 p -61.05 -32.06 71.69 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -177.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 18.0 ptp -142.66 40.69 1.56 Allowed 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 179.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 1.5 tt -43.29 -45.98 6.12 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-N 113.79 -1.55 . . . . 0.0 114.906 -174.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -61.16 -37.29 82.35 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 113.015 0.746 . . . . 0.0 113.015 -177.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -73.17 -43.73 61.04 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.354 0.597 . . . . 0.0 110.68 -176.119 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 80.7 m-20 -64.49 -41.16 96.63 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.919 0.866 . . . . 0.0 109.45 179.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.613 HD11 HD11 ' A' ' 11' ' ' ILE . 0.6 OUTLIER -63.49 -43.29 97.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.035 -176.55 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -73.7 -18.68 60.98 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 119.818 -0.753 . . . . 0.0 111.298 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -75.26 -34.85 61.42 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 45.2 t -90.03 -41.65 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 CA-C-O 121.319 0.581 . . . . 0.0 110.283 -179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 67.9 m-85 -126.29 79.48 70.17 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.154 -179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -66.78 -14.19 42.86 Favored 'Trans proline' 0 N--CA 1.474 0.376 0 N-CA-C 114.233 0.82 . . . . 0.0 114.233 -178.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 7.2 m -83.16 2.62 34.61 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 177.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -68.54 132.02 46.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.51 0.672 . . . . 0.0 111.101 -179.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -78.11 106.0 9.7 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 106.487 -1.672 . . . . 0.0 106.487 176.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 17.3 p -61.57 -23.8 66.22 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 111.367 0.136 . . . . 0.0 111.367 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.46 -22.45 66.89 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.781 0.66 . . . . 0.0 112.781 176.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -82.28 7.33 14.13 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.757 0.789 . . . . 0.0 110.447 -177.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 52.3 t -129.98 115.07 16.62 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 77.0 p -140.6 158.62 43.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -178.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 6.6 pt-20 -67.87 -19.85 65.07 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 121.54 0.686 . . . . 0.0 110.449 179.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -58.18 -27.43 63.84 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.292 1.037 . . . . 0.0 110.479 175.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 75.1 m80 -117.31 15.94 14.82 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.773 -0.648 . . . . 0.0 111.815 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -82.71 52.26 2.07 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -177.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 11.6 p -132.23 163.0 29.55 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 122.019 0.914 . . . . 0.0 112.801 179.336 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -66.47 -28.73 68.82 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.794 -1.094 . . . . 0.0 110.201 178.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -71.15 -41.88 69.86 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 121.893 -0.505 . . . . 0.0 110.218 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -64.55 -33.97 77.16 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 178.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.95 -30.8 71.85 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.941 178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.4 mt-30 -69.06 -45.05 71.34 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 176.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 36.3 mmt -62.75 -28.92 70.3 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.131 -179.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -61.98 -35.53 78.77 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 122.172 -0.33 . . . . 0.0 111.742 179.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 70.6 ttt180 -67.32 -44.48 79.05 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-O 121.14 0.495 . . . . 0.0 109.713 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.0 mt-10 -65.21 -38.58 90.89 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.732 0.777 . . . . 0.0 109.458 -178.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 -58.85 -46.68 87.17 Favored 'General case' 0 C--O 1.212 -0.906 0 CA-C-N 115.142 -0.935 . . . . 0.0 109.377 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -66.98 -45.31 78.05 Favored 'General case' 0 C--O 1.218 -0.578 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 178.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -61.0 -40.5 93.79 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.595 -176.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 33.9 p -71.81 -34.74 69.61 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.203 176.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -62.28 -34.64 76.96 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.726 0.41 . . . . 0.0 111.712 179.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 71.2 t -56.94 -46.94 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 118.47 0.577 . . . . 0.0 110.675 179.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -73.83 -37.51 64.82 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 178.432 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 48.2 tttp -56.71 -25.34 54.1 Favored 'General case' 0 C--O 1.21 -1.003 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.811 176.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . 0.455 ' HG2' ' HA ' ' A' ' 17' ' ' ASN . 4.0 tm0? -54.92 -32.03 60.74 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 70.6 mm-40 -62.17 -36.41 81.78 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.859 0.361 . . . . 0.0 110.282 179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -76.89 -45.43 28.19 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 123.243 0.617 . . . . 0.0 110.331 174.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.9 mm100 -55.95 -41.46 74.71 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -177.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -65.51 -20.72 66.46 Favored 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -178.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 33.0 mttm -77.57 -41.15 39.88 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 176.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -72.39 -23.56 61.13 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.403 -0.817 . . . . 0.0 112.589 -179.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 12.2 tm-20 -56.37 -35.32 67.58 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 123.307 0.643 . . . . 0.0 111.362 -179.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -60.3 -14.14 16.63 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.261 0.838 . . . . 0.0 113.261 179.052 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -120.99 10.31 10.77 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 22.0 m -85.04 141.89 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 119.495 1.043 . . . . 0.0 110.101 -179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -137.33 -26.35 1.0 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 179.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 14.4 tt0 64.62 -42.88 0.3 Allowed 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 116.631 2.086 . . . . 0.0 116.631 178.844 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 58.21 25.19 12.3 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 177.047 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -178.7 174.64 46.78 Favored Glycine 0 CA--C 1.507 -0.406 0 N-CA-C 108.697 -1.761 . . . . 0.0 108.697 178.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 13.5 ptpt -159.77 165.6 32.11 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 64.2 tp -149.59 132.52 16.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 101.63 -3.471 . . . . 0.0 101.63 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -157.82 157.51 33.43 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 106.713 -1.588 . . . . 0.0 106.713 -176.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 47.36 90.39 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -150.94 114.97 5.01 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.494 0.664 . . . . 0.0 110.12 168.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -165.46 162.69 19.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.968 -1.015 . . . . 0.0 108.426 -175.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 32.6 tp -152.8 147.11 25.65 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 105.788 -1.93 . . . . 0.0 105.788 175.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 22.3 p90 -142.1 164.47 30.07 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 106.523 -1.658 . . . . 0.0 106.523 -177.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -157.21 172.95 17.72 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 106.415 -1.698 . . . . 0.0 106.415 -177.588 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 . . . . . 0 C--O 1.244 0.807 0 N-CA-C 105.324 -2.102 . . . . 0.0 105.324 179.049 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.4 mtp . . . . . 0 N--CA 1.49 1.53 0 CA-C-O 118.824 -0.608 . . . . 0.0 109.899 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 62.48 163.85 0.1 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.948 0.899 . . . . 0.0 113.416 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.3 tt -72.41 -42.8 64.74 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.558 0.694 . . . . 0.0 111.063 179.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -62.03 -35.25 78.01 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 115.617 1.71 . . . . 0.0 115.617 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -60.82 -29.73 69.66 Favored 'General case' 0 C--O 1.217 -0.626 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.5 178.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -61.2 -51.07 70.57 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -179.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.3 m -63.76 -42.0 97.9 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.489 0.661 . . . . 0.0 110.837 179.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -59.09 -51.75 68.67 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.97 -179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -72.37 -28.66 63.17 Favored 'General case' 0 C--N 1.326 -0.431 0 O-C-N 121.746 -0.596 . . . . 0.0 111.547 -179.463 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 56.0 mmtt -64.68 -44.42 90.39 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.1 mm -70.84 -37.67 69.48 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 N-CA-C 110.204 -0.295 . . . . 0.0 110.204 179.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.23 81.64 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 176.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.52 -46.12 89.86 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 116.894 -0.139 . . . . 0.0 111.305 178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 86.7 t60 -54.73 -47.18 74.1 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.228 0.611 . . . . 0.0 112.037 -177.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 10.2 mp -73.07 -45.82 55.14 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.409 179.299 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 51.6 t -56.97 -41.92 77.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 O-C-N 122.032 -0.417 . . . . 0.0 111.4 -179.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.477 HD22 ' C ' ' A' ' 17' ' ' ASN . 0.2 OUTLIER -72.08 -4.78 30.89 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 121.141 -0.974 . . . . 0.0 112.734 -179.862 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.4 m -98.31 13.56 31.03 Favored 'General case' 0 C--O 1.22 -0.471 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 177.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.68 -3.92 53.4 Favored Glycine 0 C--N 1.329 0.187 0 CA-C-N 115.998 -0.546 . . . . 0.0 114.394 176.32 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.469 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 13.0 m-85 -69.67 121.69 17.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.627 0.727 . . . . 0.0 109.694 -178.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.62 129.94 9.59 Favored Glycine 0 N--CA 1.449 -0.495 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 73.5 t -74.01 126.9 35.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 178.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 81.0 mt -96.2 -44.04 12.78 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -150.17 133.23 16.2 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 -176.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.13 127.31 21.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 118.936 0.789 . . . . 0.0 112.404 179.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.37 28.37 52.85 Favored Glycine 0 C--O 1.221 -0.666 0 C-N-CA 120.476 -0.869 . . . . 0.0 114.28 173.018 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -58.74 -34.31 71.23 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 122.574 1.178 . . . . 0.0 108.729 178.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 59.4 m -159.54 -72.21 0.08 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.872 -1.899 . . . . 0.0 105.872 175.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -138.93 20.17 2.65 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 121.382 0.611 . . . . 0.0 111.541 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -129.89 159.08 37.7 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 115.1 1.519 . . . . 0.0 115.1 -174.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.6 mt -139.25 131.19 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 C-N-CA 123.86 0.864 . . . . 0.0 109.036 176.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.7 m95 -100.92 135.9 41.62 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 175.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.1 mp -129.46 138.1 51.22 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 122.975 0.51 . . . . 0.0 110.095 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.05 137.78 32.03 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.742 -0.836 . . . . 0.0 108.742 174.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -88.45 107.47 16.96 Favored Pre-proline 0 CA--C 1.552 1.034 0 CA-C-N 117.905 0.32 . . . . 0.0 111.513 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.469 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 81.9 Cg_endo -70.06 -17.01 36.48 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 120.58 0.854 . . . . 0.0 112.474 -179.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -66.62 -25.26 66.52 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.379 -0.828 . . . . 0.0 110.884 178.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.7 mttt 60.7 42.96 12.94 Favored 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 -174.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.2 t -66.47 -177.52 0.57 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 112.577 -2.102 . . . . 0.0 112.943 -178.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.9 p -55.07 -33.98 63.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.21 178.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.504 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 7.8 p80 -107.29 143.24 35.83 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 105.703 -1.962 . . . . 0.0 105.703 173.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -89.73 -29.72 18.53 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.721 -173.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 87.7 mt -137.69 164.43 28.85 Favored 'General case' 0 C--O 1.239 0.54 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.479 -176.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 61.1 t -130.54 138.07 54.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 66.6 ttt180 -123.85 113.65 18.81 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.1 tp -94.57 128.56 41.27 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.832 -1.544 . . . . 0.0 106.832 179.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 3.8 t80 -136.46 118.4 15.26 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 118.426 0.557 . . . . 0.0 111.607 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -86.47 94.68 9.47 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.383 -0.823 . . . . 0.0 109.084 178.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -147.25 135.81 21.89 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.164 0.506 . . . . 0.0 111.314 -176.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -89.99 151.54 21.63 Favored 'General case' 0 C--N 1.32 -0.691 0 C-N-CA 124.951 1.3 . . . . 0.0 108.945 177.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 29.7 mt -138.32 140.06 39.36 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 -176.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -92.86 -44.71 8.34 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -129.64 160.57 32.92 Favored 'General case' 0 N--CA 1.468 0.462 0 O-C-N 121.712 -0.618 . . . . 0.0 109.634 -178.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 15.6 ptt85 -64.65 -22.42 66.97 Favored 'General case' 0 C--O 1.219 -0.513 0 N-CA-C 112.914 0.709 . . . . 0.0 112.914 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -66.28 -33.36 75.57 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.057 -0.657 . . . . 0.0 109.252 176.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -69.16 -35.06 75.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 177.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 53.0 ttm -64.27 -50.53 67.55 Favored 'General case' 0 C--O 1.216 -0.678 0 C-N-CA 120.874 -0.33 . . . . 0.0 110.327 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 16.3 m -63.72 -32.79 58.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 O-C-N 121.452 -0.78 . . . . 0.0 110.297 -178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -66.55 -36.92 83.85 Favored 'General case' 0 CA--C 1.507 -0.688 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.663 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -62.78 -46.71 86.72 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 179.482 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 4.2 mp -69.22 -33.94 60.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 121.418 -0.801 . . . . 0.0 110.744 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 79.7 mt-10 -57.91 -40.81 81.27 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 176.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -69.29 -44.74 71.2 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.122 -0.945 . . . . 0.0 109.477 -179.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -60.53 -42.92 97.45 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.864 0.691 . . . . 0.0 112.864 179.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.1 -31.28 66.98 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -176.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -41.49 98.15 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 122.214 1.007 . . . . 0.0 109.474 177.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.0 mpt_? -73.6 -33.93 64.82 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 93.8 t -65.32 -43.34 95.04 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 N-CA-C 109.662 -0.496 . . . . 0.0 109.662 177.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -67.92 -33.68 75.16 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 119.395 0.998 . . . . 0.0 110.556 179.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 4.6 tmt_? -62.18 -45.36 93.75 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 122.095 -0.378 . . . . 0.0 110.184 175.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 69.3 t -67.51 -40.43 84.38 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.92 -37.56 69.08 Favored 'General case' 0 N--CA 1.47 0.533 0 O-C-N 122.126 -0.359 . . . . 0.0 110.739 178.019 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 26.6 t-80 -63.08 -40.52 97.9 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.519 0.2 . . . . 0.0 110.787 179.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -65.91 -39.62 90.73 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.192 0.52 . . . . 0.0 110.307 179.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 77.5 mt -77.28 -9.66 58.95 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.868 -0.606 . . . . 0.0 112.6 -179.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.69 14.67 60.86 Favored Glycine 0 CA--C 1.52 0.396 0 CA-C-O 121.43 0.461 . . . . 0.0 113.837 179.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.5 mtp85 -73.51 148.65 42.9 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.955 -0.733 . . . . 0.0 112.665 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -70.48 -33.75 71.61 Favored 'General case' 0 C--O 1.22 -0.461 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.539 176.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 5.6 ttt180 -154.4 151.67 29.29 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.5 mmm -118.43 141.84 48.15 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 177.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.504 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 43.4 tttp -120.82 130.75 54.1 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 105.015 -2.217 . . . . 0.0 105.015 174.5 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -132.68 125.92 31.41 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.901 0.382 . . . . 0.0 111.857 -171.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.3 tp -88.23 123.32 32.73 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 107.84 -1.17 . . . . 0.0 107.84 175.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -116.41 127.97 55.09 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.9 t -124.18 116.36 47.57 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 120.991 0.424 . . . . 0.0 110.734 178.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -83.56 145.4 28.9 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -121.45 112.0 17.99 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 105.045 -2.206 . . . . 0.0 105.045 173.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 3.5 m -130.28 154.03 48.03 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.677 0.621 . . . . 0.0 112.677 -170.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 19.2 m -67.21 -48.28 68.34 Favored 'General case' 0 CA--C 1.51 -0.579 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 177.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -141.41 159.59 41.9 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 104.493 -2.41 . . . . 0.0 104.493 -177.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -89.86 157.84 45.59 Favored Pre-proline 0 C--N 1.312 -1.03 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.616 -178.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -61.45 146.86 96.7 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 117.715 -1.056 . . . . 0.0 111.168 175.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 18.0 m -70.66 -11.71 15.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 118.983 2.957 . . . . 0.0 118.983 -168.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.42 137.41 21.74 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 116.195 1.924 . . . . 0.0 116.195 -175.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 24.1 t0 47.17 14.48 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 119.242 3.053 . . . . 0.0 119.242 171.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 33.2 p-90 -69.02 -21.38 64.13 Favored 'General case' 0 C--N 1.318 -0.771 0 O-C-N 121.026 -1.046 . . . . 0.0 113.605 -178.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 79.0 mt-10 -59.3 -31.15 68.88 Favored 'General case' 0 C--N 1.322 -0.617 0 O-C-N 122.019 -0.425 . . . . 0.0 111.473 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -63.34 -31.07 72.13 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.196 0.522 . . . . 0.0 109.821 177.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 5.7 mm -71.1 -40.73 75.73 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.028 0.442 . . . . 0.0 110.159 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -76.97 5.38 8.09 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.461 0.648 . . . . 0.0 110.569 178.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -111.34 -2.69 15.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.815 179.203 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 15.0 ptmt -125.24 137.9 54.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.776 0.798 . . . . 0.0 112.512 -175.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 28.2 m -83.28 122.79 28.9 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 104.395 -2.446 . . . . 0.0 104.395 175.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.7 t80 -82.79 118.42 23.38 Favored 'General case' 0 C--N 1.316 -0.884 0 N-CA-C 104.898 -2.26 . . . . 0.0 104.898 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -119.78 126.2 50.46 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.943 0.877 . . . . 0.0 111.287 -176.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -127.46 75.45 1.59 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.684 -1.144 . . . . 0.0 108.228 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.76 -112.74 5.26 Favored Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 119.951 -1.119 . . . . 0.0 111.277 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 46.8 p -77.98 17.7 0.56 Allowed 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 83.0 t -130.47 140.53 48.56 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 C-N-CA 123.01 0.524 . . . . 0.0 110.663 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 66.8 m -131.51 132.54 44.28 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 104.399 -2.445 . . . . 0.0 104.399 169.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.3 t -132.01 133.43 60.79 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 177.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.7 pm0 -114.13 109.04 49.73 Favored Pre-proline 0 C--N 1.319 -0.755 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -81.18 159.57 20.37 Favored 'Trans proline' 0 C--N 1.349 0.587 0 C-N-CA 117.247 -1.369 . . . . 0.0 113.644 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.93 159.17 44.73 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 102.973 -2.973 . . . . 0.0 102.973 176.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 9.0 tt -149.23 139.76 16.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.5 t -114.72 108.72 26.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 107.242 -1.392 . . . . 0.0 107.242 176.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.61 136.29 33.35 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 177.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -64.11 -23.43 67.88 Favored Glycine 0 C--O 1.225 -0.45 0 C-N-CA 121.292 -0.48 . . . . 0.0 113.404 -178.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 26.7 p -59.0 -28.62 66.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.995 1.48 . . . . 0.0 114.995 -176.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -143.43 35.24 1.31 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 122.244 1.021 . . . . 0.0 108.355 -179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.8 tt -46.03 -40.55 10.78 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 -173.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -61.6 -37.93 85.74 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 119.227 -0.989 . . . . 0.0 112.606 -177.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -42.45 29.27 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.958 0.885 . . . . 0.0 110.573 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.42 -39.42 92.09 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.071 -0.968 . . . . 0.0 113.404 -174.677 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -68.27 -44.01 76.51 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 122.082 -0.386 . . . . 0.0 110.35 -177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -73.62 -14.32 61.16 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.51 -0.476 . . . . 0.0 110.928 -177.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -74.12 -31.58 62.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 110.105 -0.332 . . . . 0.0 110.105 177.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.61 -37.86 6.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 120.695 0.283 . . . . 0.0 110.964 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -130.16 77.07 77.02 Favored Pre-proline 0 C--N 1.326 -0.447 0 O-C-N 122.101 -0.374 . . . . 0.0 111.5 179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.64 -13.8 37.99 Favored 'Trans proline' 0 C--N 1.348 0.548 0 N-CA-C 113.819 0.661 . . . . 0.0 113.819 -179.177 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.9 m -73.26 -10.51 59.83 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 111.93 0.345 . . . . 0.0 111.93 178.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -102.53 125.64 49.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 82.6 mtp180 -71.58 110.41 6.14 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 177.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 13.3 t -63.15 -10.54 15.43 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.376 0.51 . . . . 0.0 112.376 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -62.59 -32.43 73.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.36 0.6 . . . . 0.0 109.767 175.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -71.29 -7.62 48.23 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.859 0.838 . . . . 0.0 110.232 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 10.9 t -129.71 33.43 4.45 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.078 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 68.0 m -61.38 146.79 47.07 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 88.2 tt0 -53.99 -41.75 68.27 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -175.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -61.53 -38.38 87.18 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.685 0.755 . . . . 0.0 111.274 179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 18.8 t60 -85.07 -17.69 36.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.783 -177.312 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.92 40.07 0.45 Allowed 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -178.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 67.5 m -63.09 149.93 43.94 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.184 0.516 . . . . 0.0 109.925 178.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -59.52 -30.81 68.85 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -177.012 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -72.53 -35.09 67.98 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.79 0.328 . . . . 0.0 111.213 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -69.04 -26.79 65.15 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 -179.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -60.33 -36.5 78.09 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.07 0.462 . . . . 0.0 110.209 175.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 41.3 tt0 -72.66 -40.92 65.94 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 178.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 54.2 mtt -62.09 -37.81 86.46 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.946 0.403 . . . . 0.0 109.988 179.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -63.9 -40.85 97.47 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 122.178 -0.326 . . . . 0.0 110.247 177.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 51.8 ttt180 -64.58 -44.7 89.84 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-O 120.958 0.408 . . . . 0.0 110.121 178.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -63.38 -43.29 98.02 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-O 121.545 0.688 . . . . 0.0 109.953 -178.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 37.6 ttt85 -64.02 -34.68 78.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.786 178.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -63.84 -39.56 94.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.745 -0.207 . . . . 0.0 111.215 177.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.96 -37.68 88.3 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.951 0.405 . . . . 0.0 109.995 179.068 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 14.5 m -69.74 -35.02 74.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.55 0.69 . . . . 0.0 110.904 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -42.93 74.3 Favored 'General case' 0 C--N 1.324 -0.506 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -177.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 10.9 p -62.57 -32.99 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 120.494 -0.483 . . . . 0.0 109.882 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -61.59 -46.02 91.62 Favored 'General case' 0 C--O 1.211 -0.968 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 177.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -64.84 -31.32 72.5 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 121.235 -0.915 . . . . 0.0 111.194 178.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -60.75 -28.47 68.73 Favored 'General case' 0 C--O 1.212 -0.89 0 O-C-N 121.538 -0.726 . . . . 0.0 111.351 178.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.42 -33.3 74.51 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 119.606 1.094 . . . . 0.0 110.665 -179.306 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -65.29 -44.42 88.03 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 177.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 93.0 mm-40 -70.9 -31.73 68.47 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.585 -178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 -69.61 -22.46 63.49 Favored 'General case' 0 N--CA 1.469 0.502 0 O-C-N 121.628 -0.67 . . . . 0.0 111.386 178.121 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -68.16 -37.36 80.92 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 176.39 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -32.23 66.12 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 121.103 -0.239 . . . . 0.0 111.329 175.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 27.2 tp10 -61.68 -24.34 66.69 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 122.986 0.514 . . . . 0.0 111.248 178.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.62 -14.12 56.6 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 177.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -67.18 151.81 46.89 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 22.1 t -77.06 94.54 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 -179.052 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.1 168.24 20.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.163 -177.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -135.33 135.53 40.83 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 -179.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -104.55 4.19 32.67 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 121.592 0.711 . . . . 0.0 110.243 -178.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 104.48 164.49 24.47 Favored Glycine 0 C--O 1.217 -0.961 0 N-CA-C 107.845 -2.102 . . . . 0.0 107.845 -176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -156.15 165.12 37.33 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 118.142 0.971 . . . . 0.0 109.428 -177.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 80.9 mt -111.02 164.3 12.95 Favored 'General case' 0 C--O 1.244 0.768 0 CA-C-O 121.206 0.527 . . . . 0.0 111.807 -178.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -75.08 149.15 39.22 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -88.31 81.54 7.25 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 -177.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -76.04 154.55 35.61 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.971 178.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -149.32 143.77 26.02 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 107.856 -1.165 . . . . 0.0 107.856 -179.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 40.1 tp -144.08 149.95 37.4 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 174.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 20.9 p90 -156.49 164.4 38.28 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 -175.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -140.15 146.4 38.76 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 104.14 -2.541 . . . . 0.0 104.14 177.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 . . . . . 0 C--O 1.251 1.139 0 CA-C-O 115.962 -1.97 . . . . 0.0 105.863 -177.803 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.9 mtm . . . . . 0 N--CA 1.488 1.451 0 CA-C-O 118.479 -0.772 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 72.29 106.45 0.07 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.605 1.562 . . . . 0.0 112.897 -178.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pp -61.74 -32.25 72.48 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.98 -177.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -62.1 -36.79 82.8 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 122.193 -0.317 . . . . 0.0 111.138 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.28 -32.36 73.93 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 178.412 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 64.4 t80 -62.95 -52.54 62.62 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 178.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.2 m -59.96 -42.09 93.34 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.766 0.317 . . . . 0.0 110.73 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -56.29 -55.37 34.19 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 123.063 0.545 . . . . 0.0 112.15 179.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -71.07 -28.98 64.74 Favored 'General case' 0 C--N 1.327 -0.37 0 O-C-N 121.725 -0.61 . . . . 0.0 111.94 -178.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.7 mmmt -70.51 -35.58 73.28 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.834 -0.541 . . . . 0.0 110.153 176.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.401 HD13 ' HA ' ' A' ' 11' ' ' ILE . 4.0 mm -69.38 -42.05 81.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 176.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.85 -44.27 81.98 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 177.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.05 -45.31 92.8 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.522 178.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -59.47 -49.08 79.15 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.728 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.7 mt -63.87 -50.01 70.5 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 121.132 -0.227 . . . . 0.0 111.464 -177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.95 -42.34 89.11 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-O 120.757 0.313 . . . . 0.0 110.569 -177.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -4.35 38.12 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.8 m -103.12 7.82 38.73 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 122.722 0.409 . . . . 0.0 110.655 176.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 106.98 0.33 35.95 Favored Glycine 0 C--O 1.228 -0.246 0 N-CA-C 116.527 1.371 . . . . 0.0 116.527 176.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.453 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.9 m-85 -72.89 117.96 15.25 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 118.312 1.056 . . . . 0.0 109.519 177.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.79 134.89 17.01 Favored Glycine 0 C--O 1.223 -0.572 0 N-CA-C 110.782 -0.927 . . . . 0.0 110.782 -178.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.8 t -78.12 126.1 38.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 117.733 0.767 . . . . 0.0 109.481 179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.401 HD11 HD22 ' A' ' 43' ' ' LEU . 51.9 mt -98.64 -47.98 12.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 177.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -149.64 138.68 21.18 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 105.296 -2.113 . . . . 0.0 105.296 179.469 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.12 121.98 15.5 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 118.847 0.749 . . . . 0.0 112.65 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 72.9 39.73 53.91 Favored Glycine 0 C--O 1.223 -0.568 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.61 175.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.8 tt0 -58.51 -44.72 89.58 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 43.9 t -154.5 -68.06 0.13 Allowed 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 105.591 -2.003 . . . . 0.0 105.591 175.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -139.36 19.39 2.57 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.837 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -130.63 154.94 47.36 Favored 'General case' 0 C--O 1.242 0.672 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -178.126 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 62.2 mt -139.4 132.23 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.599 0 N-CA-C 107.133 -1.432 . . . . 0.0 107.133 177.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 41.5 m95 -108.58 127.5 54.01 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.453 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 1.9 mm? -124.01 140.93 52.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.668 -0.696 . . . . 0.0 109.557 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -84.62 126.61 33.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 176.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.73 123.84 88.51 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -72.4 -29.22 14.0 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 115.56 -2.493 . . . . 0.0 113.12 -178.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -71.3 -31.97 68.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.186 0.517 . . . . 0.0 112.11 -178.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 95.7 mttt 58.07 38.31 26.57 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 123.829 1.775 . . . . 0.0 108.68 -176.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 8.6 t -60.78 -172.63 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 109.754 -3.384 . . . . 0.0 109.725 171.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.0 m -41.52 -26.13 0.06 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.743 1.386 . . . . 0.0 114.743 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 27.6 p-80 -114.92 139.92 49.41 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 108.428 -0.952 . . . . 0.0 108.428 165.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 78.8 m-20 -86.34 -31.58 21.47 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 121.843 -0.536 . . . . 0.0 109.786 -178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.401 HD22 HD11 ' A' ' 23' ' ' ILE . 68.9 mt -140.43 164.62 29.64 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 -177.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 5.2 p -135.29 137.36 50.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 109.724 -0.473 . . . . 0.0 109.724 175.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 75.0 ttt180 -111.83 125.17 53.73 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -95.13 124.66 39.29 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 104.009 -2.589 . . . . 0.0 104.009 174.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 22.0 t80 -136.44 125.55 24.51 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -175.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 ptmm? -107.34 99.16 8.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-O 121.878 0.847 . . . . 0.0 112.454 -178.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -146.92 150.1 34.54 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.092 -0.958 . . . . 0.0 108.618 -179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -106.88 144.44 33.52 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 107.659 -1.237 . . . . 0.0 107.659 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.72 133.85 55.32 Favored 'General case' 0 C--O 1.22 -0.467 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 -178.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.9 t0 -85.0 -39.88 17.53 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 122.37 1.081 . . . . 0.0 108.93 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 54.3 m-85 -132.05 157.34 44.41 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -64.35 -19.55 65.54 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 113.181 0.808 . . . . 0.0 113.181 -178.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.412 ' HA ' HG22 ' A' ' 58' ' ' VAL . 6.9 pt20 -62.34 -33.24 74.33 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.599 -0.519 . . . . 0.0 109.599 179.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.1 mm-40 -69.5 -33.04 72.27 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 177.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.412 ' O ' HD12 ' A' ' 61' ' ' ILE . 4.8 ttm -72.65 -48.45 39.2 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.798 177.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.412 HG22 ' HA ' ' A' ' 55' ' ' GLN . 23.6 m -58.05 -36.75 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -176.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.16 -29.8 65.66 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 120.784 -0.366 . . . . 0.0 111.668 -178.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -64.52 -39.18 93.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 178.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.412 HD12 ' O ' ' A' ' 57' ' ' MET . 2.9 mt -74.12 -38.32 48.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 122.004 -0.435 . . . . 0.0 111.857 179.286 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -66.59 -29.66 69.77 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -76.53 -37.76 56.17 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 108.795 -0.816 . . . . 0.0 108.795 176.375 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -56.71 -34.29 67.32 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.535 178.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.96 -34.01 67.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-O 119.111 -0.471 . . . . 0.0 112.04 -179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.1 tm-20 -69.3 -46.17 67.8 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 118.908 0.776 . . . . 0.0 109.097 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 -56.74 -43.78 81.05 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 179.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.4 t -70.4 -34.2 57.04 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.076 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -64.84 -42.0 95.28 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 119.685 1.13 . . . . 0.0 109.636 176.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.0 tmt_? -61.43 -46.37 90.39 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 178.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 54.4 t -66.36 -38.95 82.91 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.257 178.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -58.57 -44.2 89.66 Favored 'General case' 0 CA--C 1.511 -0.54 0 O-C-N 121.842 -0.536 . . . . 0.0 110.22 179.443 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 6.9 t-160 -66.06 -45.18 82.29 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -61.3 -41.43 96.97 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -179.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.6 mp -90.0 -5.78 56.31 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -177.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.04 9.0 45.62 Favored Glycine 0 CA--C 1.525 0.669 0 N-CA-C 116.413 1.325 . . . . 0.0 116.413 177.772 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 56.4 mtp85 -67.22 146.62 54.0 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 121.912 -0.758 . . . . 0.0 110.477 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -62.41 -35.59 79.71 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 121.068 0.461 . . . . 0.0 110.338 -178.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -149.49 148.37 29.33 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 175.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.5 tmm? -113.75 139.04 49.43 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 106.68 -1.6 . . . . 0.0 106.68 178.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -116.06 132.06 56.76 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -134.56 125.57 27.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 118.514 0.597 . . . . 0.0 111.022 -177.055 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 51.8 tp -89.13 124.44 34.33 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 174.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -113.89 108.64 17.33 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.9 t -100.53 111.55 30.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 CA-C-O 120.807 0.337 . . . . 0.0 110.52 -176.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -82.78 133.06 35.15 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 176.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -111.27 109.47 19.5 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 104.952 -2.24 . . . . 0.0 104.952 175.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 9.0 m -127.31 155.59 43.3 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.057 0.456 . . . . 0.0 112.108 -174.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 50.6 m -71.2 -46.92 60.2 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 175.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -138.85 158.76 43.63 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 -175.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.14 146.13 39.61 Favored Pre-proline 0 C--N 1.313 -0.989 0 CA-C-N 115.038 -0.983 . . . . 0.0 108.862 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -64.68 150.3 88.41 Favored 'Trans proline' 0 C--N 1.345 0.363 0 O-C-N 121.895 0.418 . . . . 0.0 113.177 178.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 22.3 m -79.46 -7.49 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 N-CA-C 116.728 2.121 . . . . 0.0 116.728 -173.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -108.49 97.0 6.73 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 96.8 m-20 14.96 55.62 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 118.482 2.771 . . . . 0.0 118.482 177.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 61.2 p-90 -73.12 -12.83 61.04 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.696 -0.683 . . . . 0.0 112.71 -177.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -60.62 -31.16 70.36 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 121.828 -0.545 . . . . 0.0 111.735 -177.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -62.77 -33.2 74.69 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.219 0.533 . . . . 0.0 110.249 175.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 3.0 mm -67.25 -37.11 78.48 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.372 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 -176.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.33 -32.21 73.72 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.383 0.611 . . . . 0.0 110.824 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 60.9 mttp -87.76 -9.31 54.36 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.367 0.603 . . . . 0.0 111.078 -179.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 18.1 ttpt -88.14 95.74 10.27 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.157 -178.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 86.3 m -68.51 124.24 23.02 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 104.882 -2.266 . . . . 0.0 104.882 173.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -87.41 108.28 18.93 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 -179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -106.18 128.41 53.91 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.516 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -132.15 75.54 1.64 Allowed 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.524 -1.288 . . . . 0.0 107.524 177.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.59 -112.68 5.21 Favored Glycine 0 CA--C 1.518 0.238 0 C-N-CA 120.015 -1.088 . . . . 0.0 111.116 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 40.1 p -79.32 20.72 0.51 Allowed 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -179.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 42.2 t -127.68 141.12 47.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.5 t -139.21 112.89 8.42 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 106.225 -1.769 . . . . 0.0 106.225 173.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 59.6 t -109.73 129.4 64.67 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.547 0 CA-C-O 122.561 1.172 . . . . 0.0 110.311 179.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -102.07 99.73 13.2 Favored Pre-proline 0 N--CA 1.425 -1.699 0 CA-C-N 111.801 -2.454 . . . . 0.0 107.919 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -79.94 151.87 21.59 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 115.292 -2.672 . . . . 0.0 113.032 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -150.54 150.84 31.76 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 105.522 -2.029 . . . . 0.0 105.522 175.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.9 tt -144.15 134.29 20.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 N-CA-C 108.196 -1.039 . . . . 0.0 108.196 -179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 27.8 m -115.36 127.59 72.88 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 N-CA-C 103.679 -2.711 . . . . 0.0 103.679 175.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.68 136.34 54.87 Favored 'General case' 0 C--O 1.221 -0.405 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 -176.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -46.91 -39.03 10.82 Favored Glycine 0 N--CA 1.461 0.304 0 N-CA-C 117.268 1.667 . . . . 0.0 117.268 -174.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.96 -37.34 63.83 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -178.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 25.4 ptm -136.53 34.38 2.72 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.961 1.362 . . . . 0.0 108.673 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 14.3 tp -51.0 -38.52 51.76 Favored 'General case' 0 C--O 1.212 -0.917 0 N-CA-C 116.966 2.21 . . . . 0.0 116.966 -172.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 33.2 ttm180 -64.97 -41.15 95.71 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 118.656 0.662 . . . . 0.0 111.255 -177.366 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -71.92 -37.57 70.02 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 -178.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -65.91 -40.89 91.88 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.596 0.712 . . . . 0.0 110.811 178.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -61.36 -49.03 78.6 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.803 -0.635 . . . . 0.0 111.161 -177.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 19.9 pt20 -71.76 -15.11 62.17 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.432 -177.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.99 -35.66 57.0 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.931 -0.308 . . . . 0.0 110.249 177.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 10.0 p -94.81 -37.67 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 CA-C-O 120.853 0.359 . . . . 0.0 111.583 -179.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -130.1 75.51 79.27 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 122.036 -0.415 . . . . 0.0 110.662 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -67.43 -13.83 40.51 Favored 'Trans proline' 0 C--N 1.349 0.598 0 CA-C-O 121.392 0.497 . . . . 0.0 112.813 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 11.9 p -75.62 -8.3 56.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.074 178.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -78.3 124.83 28.53 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.301 0.572 . . . . 0.0 110.704 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -76.13 100.03 4.86 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.004 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 5.2 p -62.55 -19.35 63.57 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 -177.316 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -63.93 -25.5 68.17 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.857 0.361 . . . . 0.0 111.431 176.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 29.4 t0 -70.92 -27.25 63.65 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 7.5 t -100.56 46.06 0.96 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.365 179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.73 151.89 32.68 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 178.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 33.6 mp0 -55.69 -40.32 72.19 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.271 1.211 . . . . 0.0 114.271 -173.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -65.48 -36.98 85.5 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.604 0.716 . . . . 0.0 110.928 179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -79.38 -23.54 43.25 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.098 -178.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.76 12.38 2.67 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 179.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 68.2 m -54.54 141.18 32.28 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.279 -0.638 . . . . 0.0 109.279 177.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -49.27 -45.86 45.49 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 116.279 1.955 . . . . 0.0 116.279 -172.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 5.6 tp10 -72.28 -26.47 61.99 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -177.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -55.79 -24.46 36.03 Favored 'General case' 0 C--O 1.217 -0.618 0 CA-C-O 120.992 0.425 . . . . 0.0 110.198 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.6 -36.7 64.72 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.362 0.504 . . . . 0.0 112.362 176.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -64.47 -45.91 85.32 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 75.4 mtm -69.6 -28.93 66.36 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.017 -179.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -59.97 -31.22 69.69 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 122.159 -0.338 . . . . 0.0 111.575 178.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 64.7 ttt-85 -65.81 -43.72 87.78 Favored 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -69.62 -36.63 76.32 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.434 0.635 . . . . 0.0 109.363 -179.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -42.28 92.55 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.023 -0.535 . . . . 0.0 109.657 177.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -66.78 -40.61 88.24 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 122.787 0.435 . . . . 0.0 111.86 176.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 38.7 mt -64.99 -37.78 88.8 Favored 'General case' 0 C--N 1.323 -0.578 0 O-C-N 121.68 -0.638 . . . . 0.0 110.039 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 38.7 m -69.06 -31.72 70.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.612 0.72 . . . . 0.0 110.282 175.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -70.88 -45.49 64.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.943 -179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.3 p -66.09 -33.06 60.99 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 179.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -66.54 -39.21 88.47 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.428 -0.795 . . . . 0.0 109.37 176.15 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 25.7 tttt -60.76 -34.43 74.44 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 175.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 4.9 tp60 -60.02 -28.54 67.82 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 -178.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -68.48 -36.31 78.77 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.156 0.503 . . . . 0.0 111.051 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 36.9 tp10 -76.73 -34.42 58.1 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 176.321 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 8.9 tm0? -63.42 -51.6 65.04 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.202 179.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 6.8 ptm180 -66.01 -22.87 66.47 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.399 0.619 . . . . 0.0 111.14 -178.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 47.6 tttt -75.27 -47.95 25.57 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.611 176.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 21.6 p -72.4 -17.43 61.81 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -57.79 -24.31 56.62 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.81 0.844 . . . . 0.0 111.789 177.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -56.36 -18.63 11.52 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 176.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -74.03 105.94 5.49 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 174.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 10.2 t -58.62 104.63 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 N-CA-C 113.158 0.799 . . . . 0.0 113.158 -175.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.66 172.7 15.67 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.522 -179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -128.92 116.25 19.09 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 177.412 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -143.04 168.56 19.43 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 105.151 -2.166 . . . . 0.0 105.151 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 72.55 -136.85 23.82 Favored Glycine 0 C--O 1.227 -0.298 0 N-CA-C 108.168 -1.973 . . . . 0.0 108.168 -178.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt 51.88 51.76 15.87 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 121.562 0.696 . . . . 0.0 112.134 178.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -68.5 155.36 40.07 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 179.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -65.2 151.69 45.5 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 177.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -160.82 169.05 23.49 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.197 -174.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 54.59 -153.53 0.3 Allowed 'General case' 0 N--CA 1.47 0.535 0 O-C-N 124.724 1.265 . . . . 0.0 111.092 174.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 62.06 -168.9 0.18 Allowed 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.318 0.647 . . . . 0.0 110.724 -178.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . 0.502 ' HG ' ' H ' ' A' ' 183' ' ' TYR . 7.5 tp 62.12 -174.42 0.14 Allowed 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.967 0.907 . . . . 0.0 112.546 179.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . 0.502 ' H ' ' HG ' ' A' ' 182' ' ' LEU . 51.8 p90 -163.35 165.56 23.93 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 103.806 -2.665 . . . . 0.0 103.806 179.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -133.39 149.78 51.82 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 178.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.032 0 N-CA-C 105.237 -2.135 . . . . 0.0 105.237 -178.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttp . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 120.997 0.427 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -134.29 154.26 51.4 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 110.302 -0.259 . . . . 0.0 110.302 -176.545 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.2 pp -59.66 -32.31 70.34 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.024 0.44 . . . . 0.0 111.231 179.967 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 31.9 tp -62.32 -36.54 82.5 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.897 0.379 . . . . 0.0 111.385 179.458 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -68.58 -29.58 68.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 122.332 -0.23 . . . . 0.0 110.679 -179.348 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 88.3 t80 -61.97 -50.0 73.84 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 107.244 -1.391 . . . . 0.0 107.244 179.157 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -64.79 -41.48 95.79 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.529 179.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 59.6 t80 -54.5 -52.34 62.26 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.986 0.422 . . . . 0.0 110.936 179.548 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 99.6 m95 -73.3 -29.27 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 122.005 -0.434 . . . . 0.0 111.977 -179.852 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -68.7 -36.09 78.01 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.546 -0.721 . . . . 0.0 111.304 176.881 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 16.6 mm -70.25 -39.08 76.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 177.843 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.27 -44.56 84.06 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 176.83 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.72 -42.32 95.33 Favored 'General case' 0 C--O 1.215 -0.73 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.968 178.347 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -62.2 -43.06 99.69 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 120.655 0.264 . . . . 0.0 111.371 -179.097 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.0 mt -69.84 -46.26 66.0 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.173 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 40.9 t -54.56 -42.55 60.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 121.956 -0.465 . . . . 0.0 110.857 173.171 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.4 t-20 -61.35 -33.82 74.26 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.89 0.376 . . . . 0.0 110.839 178.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -79.65 9.49 5.0 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 122.922 0.489 . . . . 0.0 112.271 177.886 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 96.19 -0.21 61.93 Favored Glycine 0 CA--C 1.517 0.212 0 N-CA-C 116.415 1.326 . . . . 0.0 116.415 175.507 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.412 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 16.8 m-85 -68.27 132.23 46.76 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.93 0.865 . . . . 0.0 110.075 179.891 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -85.33 133.4 11.77 Favored Glycine 0 C--O 1.227 -0.331 0 N-CA-C 110.088 -1.205 . . . . 0.0 110.088 -179.217 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 96.9 t -75.38 121.45 27.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 84.3 mt -85.67 -46.07 17.04 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 105.814 -1.921 . . . . 0.0 105.814 177.102 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 17.1 pt20 -160.52 132.3 5.94 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.542 -0.911 . . . . 0.0 108.542 176.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.39 141.99 35.53 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.491 -2.04 . . . . 0.0 105.491 174.731 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.58 -80.9 0.05 OUTLIER Glycine 0 CA--C 1.508 -0.391 0 C-N-CA 120.112 -1.042 . . . . 0.0 111.39 176.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -69.45 158.13 35.75 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 178.45 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 15.9 m -76.56 0.74 18.92 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.18 178.872 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -82.27 -46.19 14.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 -177.41 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -147.68 143.89 27.96 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 115.845 1.794 . . . . 0.0 115.845 -179.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 97.7 mt -136.69 133.08 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 177.039 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 57.5 m95 -112.25 133.12 54.55 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.142 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -128.59 131.59 48.16 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 123.426 0.69 . . . . 0.0 109.69 -178.716 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -80.92 132.91 35.46 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.686 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.74 109.59 12.53 Favored Pre-proline 0 CA--C 1.547 0.854 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.338 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 86.2 Cg_endo -74.72 -19.0 19.01 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 117.182 -1.412 . . . . 0.0 112.239 -178.044 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -68.83 -27.88 66.23 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.908 178.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 77.7 mttt 58.74 41.96 20.95 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-O 123.175 1.465 . . . . 0.0 107.106 -178.535 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.12 -177.08 0.24 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 111.188 -2.733 . . . . 0.0 113.409 -179.47 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 32.7 p -51.9 -28.22 15.55 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.704 175.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.532 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 46.8 p-80 -107.36 143.82 35.11 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 173.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -85.94 -36.9 19.57 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.566 -172.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 95.5 mt -141.66 163.26 33.4 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.13 -177.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 93.0 t -122.84 134.57 65.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 175.014 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.25 127.7 38.37 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 178.759 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 61.9 mt -97.51 129.81 44.64 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 178.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -136.56 150.37 48.58 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 -177.718 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -115.08 131.5 56.91 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 173.575 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -151.69 140.43 20.85 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.588 0.233 . . . . 0.0 111.265 179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -93.01 125.51 37.64 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 175.085 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.5 mt -128.49 101.48 6.2 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 122.137 -0.352 . . . . 0.0 111.11 -174.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.3 t0 -75.0 -42.15 58.03 Favored 'General case' 0 N--CA 1.473 0.714 0 CA-C-O 121.925 0.869 . . . . 0.0 111.251 -179.525 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -129.19 156.89 43.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.316 -179.324 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.557 ' HD2' HD11 ' A' ' 99' ' ' ILE . 25.7 ptt180 -65.82 -20.58 66.3 Favored 'General case' 0 CA--C 1.505 -0.767 0 O-C-N 122.05 -0.406 . . . . 0.0 111.249 -178.355 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.7 pt20 -62.34 -33.31 74.45 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 176.59 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -72.47 -34.65 67.88 Favored 'General case' 0 C--N 1.324 -0.509 0 O-C-N 121.537 -0.727 . . . . 0.0 109.186 178.264 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 50.2 ttm -65.25 -47.43 76.8 Favored 'General case' 0 C--O 1.218 -0.567 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.005 178.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.2 m -64.78 -31.76 55.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 O-C-N 121.538 -0.726 . . . . 0.0 111.207 179.442 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 69.0 mtp180 -68.13 -36.17 79.29 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.619 179.417 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -59.39 -44.81 92.73 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 179.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -65.4 -30.74 51.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -176.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -62.15 -40.5 96.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -70.59 -41.07 72.83 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 179.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.412 ' O ' HG23 ' A' ' 68' ' ' VAL . 83.2 mm-40 -57.08 -48.22 79.12 Favored 'General case' 0 C--O 1.216 -0.698 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.009 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.36 94.25 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.603 -177.891 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -66.55 -38.85 88.01 Favored 'General case' 0 C--O 1.24 0.599 0 CA-C-O 121.545 0.688 . . . . 0.0 110.281 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.5 tpt180 -61.19 -42.78 99.18 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.345 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.486 HG11 HG13 ' A' ' 109' ' ' VAL . 81.9 t -69.06 -38.71 78.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 119.131 -0.461 . . . . 0.0 112.111 -179.448 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -56.55 -41.16 76.38 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 119.038 0.835 . . . . 0.0 110.201 179.812 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.3 mtm-85 -63.55 -33.46 75.65 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 120.801 -0.36 . . . . 0.0 111.496 179.315 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 99.8 t -76.72 -44.38 33.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.902 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.4 mmt-85 -61.05 -34.82 75.48 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 36.0 t-80 -58.04 -39.64 78.92 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.144 0.497 . . . . 0.0 109.884 177.336 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 66.5 mt-30 -73.41 -38.65 65.51 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.918 0.389 . . . . 0.0 111.087 179.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -74.28 -18.02 60.78 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 -177.261 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 64.38 -3.08 1.95 Allowed Glycine 0 CA--C 1.529 0.964 0 N-CA-C 116.776 1.471 . . . . 0.0 116.776 179.311 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 58.7 ttt180 -75.27 143.39 43.05 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 -178.191 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -62.18 -36.58 82.31 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 116.211 1.93 . . . . 0.0 116.211 -173.385 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.2 ttt180 -149.14 157.86 43.71 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 178.231 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.38 157.76 27.52 Favored 'General case' 0 N--CA 1.445 -0.676 0 C-N-CA 124.659 1.184 . . . . 0.0 110.25 -178.886 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.532 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 17.5 mmtt -143.41 132.01 22.43 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 102.933 -2.988 . . . . 0.0 102.933 174.509 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.5 tt -142.47 127.41 18.35 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -175.198 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 56.4 tp -83.12 104.08 13.03 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 175.309 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 18.2 m-80 -102.62 108.55 19.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 -179.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 23.7 t -100.38 112.32 32.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.314 -176.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 25.6 m-85 -91.41 106.78 18.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.417 0.627 . . . . 0.0 112.045 -179.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 -79.19 126.89 31.35 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 105.523 -2.029 . . . . 0.0 105.523 175.482 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 92.2 p -141.42 164.04 31.3 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 122.696 0.398 . . . . 0.0 110.669 -174.342 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 74.3 m -69.7 -49.07 56.92 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 176.231 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -153.54 177.85 10.48 Favored 'General case' 0 C--N 1.319 -0.741 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 -175.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.439 ' HB2' ' HD2' ' A' ' 117' ' ' ARG . . . -96.01 151.19 38.12 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.638 -174.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_exo -59.58 149.74 80.42 Favored 'Trans proline' 0 C--N 1.351 0.661 0 O-C-N 122.475 0.724 . . . . 0.0 113.079 174.831 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 34.0 m -80.26 -10.71 12.58 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 -175.45 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.9 p-10 -117.57 74.87 0.95 Allowed 'General case' 0 C--O 1.213 -0.844 0 N-CA-C 116.367 1.988 . . . . 0.0 116.367 -172.836 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 53.38 49.16 20.3 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 174.083 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 49.5 p-90 -68.16 -19.71 64.82 Favored 'General case' 0 C--N 1.316 -0.85 0 O-C-N 121.522 -0.736 . . . . 0.0 109.875 175.517 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -63.06 -34.56 77.84 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.616 0.599 . . . . 0.0 112.616 -177.725 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -57.59 -35.2 70.1 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 176.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.557 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.3 mm -71.12 -44.57 74.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.132 0.491 . . . . 0.0 111.095 -176.341 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . 0.497 ' HA ' ' HG2' ' A' ' 113' ' ' PRO . . . -67.96 -27.89 66.99 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.645 0.736 . . . . 0.0 111.79 -177.414 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 63.1 mttm -93.89 6.22 49.14 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.236 -177.049 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -119.89 144.41 47.42 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.407 0.622 . . . . 0.0 111.436 176.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 79.7 m -88.2 127.77 35.45 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 178.415 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 77.0 t80 -85.0 129.77 34.74 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 175.582 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -132.32 128.96 38.85 Favored 'General case' 0 CA--C 1.505 -0.757 0 CA-C-O 121.543 0.687 . . . . 0.0 110.091 178.475 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 44.6 tttp -149.54 114.78 5.47 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.251 -179.418 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 58.01 -127.29 44.71 Favored Glycine 0 CA--C 1.523 0.564 0 C-N-CA 120.477 -0.868 . . . . 0.0 114.195 177.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 38.8 p -82.46 13.11 3.85 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 122.746 0.419 . . . . 0.0 111.155 -178.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.486 HG13 HG11 ' A' ' 68' ' ' VAL . 2.3 t -123.57 149.9 27.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -176.903 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 45.9 t -138.43 139.75 39.02 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 100.259 -3.978 . . . . 0.0 100.259 171.175 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 57.6 t -136.31 136.57 48.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 CA-C-N 118.42 0.554 . . . . 0.0 109.806 -177.189 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.3 pm0 -105.62 113.77 63.73 Favored Pre-proline 0 C--O 1.242 0.685 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 171.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.497 ' HG2' ' HA ' ' A' ' 100' ' ' ALA . 69.6 Cg_endo -76.36 158.28 36.88 Favored 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 116.158 -2.094 . . . . 0.0 111.638 176.873 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 152.78 37.66 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 103.935 -2.617 . . . . 0.0 103.935 175.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.2 tt -145.13 138.01 21.49 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.741 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -177.811 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 96.5 t -118.16 119.97 63.01 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 179.016 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.439 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.3 OUTLIER -85.91 156.55 20.46 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 105.847 -1.908 . . . . 0.0 105.847 179.687 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -79.69 -27.67 53.44 Favored Glycine 0 C--N 1.318 -0.456 0 N-CA-C 106.307 -2.717 . . . . 0.0 106.307 168.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 4.8 p -67.66 -42.82 81.56 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -177.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.3 ptp -128.28 37.98 4.06 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-O 122.559 1.171 . . . . 0.0 109.281 -179.272 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -45.55 -43.27 11.84 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.59 -1.641 . . . . 0.0 115.07 -177.233 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 56.3 mtm180 -69.5 -31.49 69.78 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.495 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 16.7 t0 -72.31 -41.54 66.44 Favored 'General case' 0 C--O 1.221 -0.442 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 178.443 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -64.5 -41.5 96.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.495 179.477 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 4.1 mt -61.38 -42.14 98.24 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-O 118.568 -0.73 . . . . 0.0 112.371 -179.446 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -76.38 -14.34 60.08 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 119.813 1.188 . . . . 0.0 112.105 -179.07 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -85.09 -40.01 17.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.27 0.557 . . . . 0.0 110.246 178.705 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 42.6 t -91.57 -40.87 12.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.417 0.627 . . . . 0.0 110.816 -177.523 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -128.44 70.57 79.73 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.876 -179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -63.04 -15.69 49.54 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 CA-C-N 118.39 0.461 . . . . 0.0 113.147 179.691 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.7 m -83.37 0.34 46.4 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 94.2 t80 -73.34 137.02 44.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.327 0.584 . . . . 0.0 109.683 179.376 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 18.2 ptp180 -83.56 119.08 24.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.592 0.71 . . . . 0.0 109.805 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.9 p -68.86 -12.68 61.81 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.025 -0.534 . . . . 0.0 112.303 -177.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -57.9 -38.98 76.82 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 122.036 0.922 . . . . 0.0 109.392 177.664 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.36 -9.25 58.26 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 114.466 -1.243 . . . . 0.0 112.675 -177.178 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.6 t -126.75 36.27 4.49 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.885 0.374 . . . . 0.0 111.809 -175.645 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 55.3 m -66.94 132.26 47.59 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 176.633 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -68.47 -25.26 64.89 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -175.561 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -64.01 -31.2 72.31 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 121.362 0.601 . . . . 0.0 110.484 178.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -96.98 10.27 39.68 Favored 'General case' 0 C--O 1.245 0.859 0 CA-C-O 121.298 0.57 . . . . 0.0 111.756 -178.441 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -75.25 109.11 8.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.275 0.56 . . . . 0.0 110.338 -178.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 68.1 m -139.1 147.33 41.82 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 178.064 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -66.76 -32.16 73.27 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -178.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 23.5 tp10 -68.25 -30.75 69.86 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.486 0.66 . . . . 0.0 110.07 178.235 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -61.3 -27.31 68.39 Favored 'General case' 0 C--O 1.216 -0.689 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 179.699 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.15 90.2 Favored 'General case' 0 C--N 1.329 -0.302 0 O-C-N 121.854 -0.529 . . . . 0.0 111.496 177.822 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -65.86 -41.98 90.98 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 107.934 -1.136 . . . . 0.0 107.934 179.446 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 63.2 mtt -67.68 -29.01 68.18 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.397 178.299 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -62.06 -34.07 75.56 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 122.048 -0.407 . . . . 0.0 111.803 -179.298 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 76.7 ttt-85 -65.41 -46.68 79.06 Favored 'General case' 0 C--O 1.212 -0.892 0 N-CA-C 108.177 -1.045 . . . . 0.0 108.177 178.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -61.65 -46.07 91.35 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 120.356 -0.537 . . . . 0.0 109.881 -179.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 1.3 ttm180 -60.7 -35.52 76.49 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.328 -178.364 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -65.76 -41.36 92.18 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 120.538 0.208 . . . . 0.0 111.004 176.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 46.2 mt -66.07 -35.94 81.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.033 0.444 . . . . 0.0 110.109 -179.523 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 41.5 t -69.77 -42.94 73.15 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.483 0.659 . . . . 0.0 109.422 175.431 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.8 tt -62.32 -46.0 90.7 Favored 'General case' 0 C--O 1.211 -0.922 0 N-CA-C 113.51 0.929 . . . . 0.0 113.51 -177.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.7 p -58.68 -39.4 76.19 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.412 0 CA-C-N 118.966 0.803 . . . . 0.0 111.986 -175.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -73.88 -41.08 62.68 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.165 178.305 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -61.37 -32.9 72.83 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 121.519 0.676 . . . . 0.0 110.295 178.258 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 46.5 tp60 -57.81 -25.77 61.06 Favored 'General case' 0 C--O 1.205 -1.238 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.273 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 55.6 mm-40 -61.54 -37.47 83.9 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 119.199 0.909 . . . . 0.0 110.607 -179.492 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -77.1 -50.45 13.02 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.731 0.777 . . . . 0.0 109.735 176.41 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 96.0 mm-40 -65.74 -36.18 82.85 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -174.614 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -61.3 -17.81 55.46 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -177.229 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 13.6 mmtm -66.08 -51.14 60.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 178.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 4.5 p -77.2 -34.33 56.2 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.092 0.775 . . . . 0.0 113.092 177.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.98 -24.38 67.87 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-O 120.935 0.398 . . . . 0.0 111.578 -177.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -63.3 -14.02 45.03 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 177.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -100.02 5.5 45.08 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -179.147 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 33.1 m -69.28 146.39 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 179.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 52.8 p90 -144.39 168.15 20.79 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-O 121.233 0.54 . . . . 0.0 110.019 -178.435 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -151.19 173.5 14.35 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 104.035 -2.58 . . . . 0.0 104.035 -179.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -125.75 45.73 2.55 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.324 -0.621 . . . . 0.0 109.324 179.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 141.64 173.02 13.64 Favored Glycine 0 N--CA 1.452 -0.247 0 N-CA-C 111.285 -0.726 . . . . 0.0 111.285 -179.13 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 6.6 ttmt -137.89 147.61 44.59 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 105.973 -1.862 . . . . 0.0 105.973 -179.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 96.3 mt -117.54 137.25 52.7 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 104.543 -2.392 . . . . 0.0 104.543 176.167 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -148.72 140.15 23.39 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 105.518 -2.031 . . . . 0.0 105.518 -174.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 96.0 mtt-85 -151.25 166.42 30.97 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 118.114 0.415 . . . . 0.0 111.078 -176.031 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 66.5 tt0 -142.51 141.92 32.17 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 102.134 -3.284 . . . . 0.0 102.134 175.298 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -135.25 45.89 2.45 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 179.702 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.63 87.19 4.57 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.804 -178.761 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -165.33 129.73 2.4 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.103 0.477 . . . . 0.0 110.499 169.726 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -144.26 39.23 1.3 Allowed 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.517 -173.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 . . . . . 0 C--O 1.251 1.154 0 CA-C-O 115.482 -2.199 . . . . 0.0 105.121 -178.535 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.9 ptt? . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.342 0.592 . . . . 0.0 110.761 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 -86.39 157.05 19.94 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.619 -0.676 . . . . 0.0 110.074 -178.516 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 56.0 tp -57.21 -36.22 70.6 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.824 0.821 . . . . 0.0 110.027 177.666 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 36.2 mt -59.9 -35.32 74.6 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.986 -178.853 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 8' ' ' TYR . 43.4 mt-10 -67.38 -26.0 66.24 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.17 -177.165 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 78.4 t80 -60.24 -52.74 63.99 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -71.65 -41.89 68.24 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.899 178.691 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.434 ' HB3' ' HA ' ' A' ' 5' ' ' GLU . 77.0 t80 -56.85 -52.16 66.18 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -178.052 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 85.6 m95 -73.8 -33.53 64.23 Favored 'General case' 0 C--N 1.327 -0.371 0 O-C-N 121.653 -0.654 . . . . 0.0 112.269 -179.506 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -69.16 -34.82 75.57 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.417 -0.802 . . . . 0.0 111.034 178.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 HD11 ' A' ' 125' ' ' LEU . 11.8 mm -72.72 -34.05 46.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 177.045 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.09 84.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 175.825 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.01 -40.81 87.39 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.568 178.032 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -60.33 -46.06 91.24 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.23 179.183 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 52.0 mt -64.99 -43.14 93.56 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 179.523 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.2 t -60.72 -43.01 94.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 C-N-CA 120.469 -0.492 . . . . 0.0 111.28 179.775 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.5 p30 -75.38 -10.56 59.56 Favored 'General case' 0 N--CA 1.473 0.702 0 O-C-N 121.3 -0.875 . . . . 0.0 112.079 178.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.2 m -89.98 6.05 43.85 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 173.723 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.92 -0.51 67.1 Favored Glycine 0 CA--C 1.517 0.172 0 N-CA-C 116.353 1.301 . . . . 0.0 116.353 175.623 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -66.39 131.1 45.32 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 118.187 0.993 . . . . 0.0 110.0 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.94 131.65 10.56 Favored Glycine 0 N--CA 1.451 -0.357 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 -178.208 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.6 t -74.57 125.82 34.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.62 -0.882 . . . . 0.0 108.62 179.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 61.3 mt -93.65 -48.43 13.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 107.721 -1.214 . . . . 0.0 107.721 178.58 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 6.2 pt20 -149.49 128.76 12.87 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 176.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.32 105.35 4.99 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 175.119 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.19 -25.89 0.05 OUTLIER Glycine 0 CA--C 1.508 -0.393 0 C-N-CA 120.403 -0.903 . . . . 0.0 112.062 178.283 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.436 ' CD ' ' H ' ' A' ' 27' ' ' GLU . 30.4 mp0 -62.9 -22.89 67.06 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.846 0.858 . . . . 0.0 111.08 -179.246 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.1 t 69.41 -23.52 0.15 Allowed 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 115.43 1.641 . . . . 0.0 115.43 176.426 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 84.0 m-20 -93.68 -30.19 15.04 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 174.596 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -133.28 152.07 51.92 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.262 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 25.8 mt -140.55 134.61 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 N-CA-C 105.922 -1.881 . . . . 0.0 105.922 175.063 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 66.6 m95 -109.04 132.25 54.29 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 109.606 -0.516 . . . . 0.0 109.606 177.578 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -125.72 135.38 52.02 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 -178.802 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.447 ' HA ' HD23 ' A' ' 43' ' ' LEU . 25.0 tt0 -94.75 133.59 38.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.495 -0.928 . . . . 0.0 108.495 175.748 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.75 128.17 93.75 Favored Pre-proline 0 CA--C 1.538 0.482 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 -179.746 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -77.78 -28.54 5.1 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 116.657 -1.762 . . . . 0.0 114.378 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.7 p-10 -77.67 -28.62 51.21 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 123.62 0.768 . . . . 0.0 112.033 -178.39 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 82.3 mttt 55.09 40.6 31.95 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 178.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 73.4 m -66.09 -173.12 0.17 Allowed 'General case' 0 C--O 1.218 -0.564 0 N-CA-C 105.176 -2.157 . . . . 0.0 105.176 164.612 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.7 t -41.25 -39.45 1.36 Allowed 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.054 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.2 m-70 -75.84 123.8 26.26 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 172.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -104.82 -26.32 12.28 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 176.955 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 34' ' ' GLU . 96.4 mt -140.35 155.41 46.79 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -176.488 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 95.4 t -132.83 136.12 56.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 N-CA-C 106.251 -1.759 . . . . 0.0 106.251 175.176 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 44.1 ttt85 -124.8 129.93 51.4 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.532 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 95.8 mt -102.55 131.43 49.28 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 174.448 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -136.4 103.03 5.14 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -174.912 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -80.9 96.38 7.02 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 178.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 86.1 t60 -151.69 122.73 7.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.125 -173.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -81.04 151.38 28.42 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 178.596 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 58.1 mt -138.59 110.46 7.2 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 113.134 0.791 . . . . 0.0 113.134 -173.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -72.26 -40.37 67.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 178.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -134.15 155.59 49.83 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.902 -175.206 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 14.7 ptt180 -63.87 -22.92 67.14 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 112.209 0.448 . . . . 0.0 112.209 177.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -66.6 -39.51 88.42 Favored 'General case' 0 C--O 1.211 -0.945 0 C-N-CA 119.496 -0.882 . . . . 0.0 109.424 -179.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -68.26 -37.02 80.32 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.495 ' O ' HD12 ' A' ' 61' ' ' ILE . 18.1 ttt -60.45 -51.6 68.77 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.379 178.925 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.6 m -64.42 -32.53 58.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 CA-C-N 118.895 0.771 . . . . 0.0 111.116 -179.138 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 20.1 mtm105 -66.53 -38.1 86.43 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.834 0.349 . . . . 0.0 110.439 -178.823 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -60.34 -39.72 88.12 Favored 'General case' 0 C--N 1.319 -0.742 0 C-N-CA 120.097 -0.641 . . . . 0.0 110.013 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.495 HD12 ' O ' ' A' ' 57' ' ' MET . 2.7 mp -74.18 -34.36 37.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 O-C-N 121.305 -0.872 . . . . 0.0 111.364 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -63.06 -35.33 79.88 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 178.257 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 26.1 tp10 -68.7 -43.44 76.03 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 175.66 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -58.42 -40.99 83.97 Favored 'General case' 0 C--O 1.218 -0.602 0 O-C-N 121.663 -0.648 . . . . 0.0 110.539 179.743 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.65 -43.4 84.72 Favored 'General case' 0 C--N 1.323 -0.544 0 O-C-N 122.233 -0.292 . . . . 0.0 110.777 -178.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 29.6 tp10 -64.64 -47.5 78.3 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.338 0.59 . . . . 0.0 110.017 179.146 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -59.14 -49.41 77.99 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.955 179.353 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.1 p -72.91 -32.34 39.55 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 -174.685 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.0 -40.16 94.53 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 118.984 0.811 . . . . 0.0 111.036 -178.074 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -61.16 -35.3 76.74 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 121.122 0.487 . . . . 0.0 110.232 -178.632 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 98.0 t -78.08 -50.46 19.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.385 0.612 . . . . 0.0 111.337 178.371 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? -71.08 -30.35 66.45 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 116.426 2.01 . . . . 0.0 116.426 -172.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 2.8 m170 -56.87 -29.65 63.13 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.613 0.642 . . . . 0.0 110.5 177.24 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -65.63 -21.19 66.55 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -179.855 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 mp -82.73 -12.35 57.62 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 120.912 0.387 . . . . 0.0 110.255 178.592 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.18 11.04 66.74 Favored Glycine 0 CA--C 1.521 0.431 0 C-N-CA 121.224 -0.513 . . . . 0.0 113.459 -178.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 48.5 ttt180 -67.26 136.94 55.71 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -179.258 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.2 tpp180 -63.18 -35.69 81.15 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 -174.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 46.1 ptt85 -153.25 156.55 38.69 Favored 'General case' 0 CA--C 1.513 -0.444 0 N-CA-C 108.099 -1.075 . . . . 0.0 108.099 174.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.8 mmm -115.85 154.31 29.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 122.982 0.513 . . . . 0.0 111.451 -177.823 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -136.51 125.37 24.1 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 167.394 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -114.59 145.02 42.47 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.49 -1.3 . . . . 0.0 107.49 -179.662 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.4 tp -108.64 121.28 44.69 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 105.536 -2.024 . . . . 0.0 105.536 172.486 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 36.4 t30 -115.86 108.69 16.61 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 118.035 0.38 . . . . 0.0 110.254 -178.641 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 20.4 t -104.94 107.71 23.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.93 0.395 . . . . 0.0 111.997 -176.433 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -77.17 147.94 36.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 176.176 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -127.14 114.95 18.38 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 171.038 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 77.7 p -133.55 160.15 38.31 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.34 0.656 . . . . 0.0 109.978 -173.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 65.1 m -75.97 -50.14 15.73 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.136 -0.69 . . . . 0.0 109.136 178.572 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -124.26 158.39 32.63 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 106.553 -1.647 . . . . 0.0 106.553 -176.231 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -84.36 150.11 56.63 Favored Pre-proline 0 C--N 1.311 -1.083 0 N-CA-C 106.629 -1.619 . . . . 0.0 106.629 177.229 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_exo -58.2 146.61 87.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 118.152 -0.766 . . . . 0.0 113.353 178.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.56 -12.43 15.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 N-CA-C 115.808 1.781 . . . . 0.0 115.808 -174.035 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -133.34 137.84 46.1 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 121.947 -0.471 . . . . 0.0 112.21 179.475 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 41.9 t0 14.57 59.19 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 119.087 2.995 . . . . 0.0 119.087 178.515 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 22.7 p-90 -87.43 -24.1 24.29 Favored 'General case' 0 N--CA 1.441 -0.916 0 O-C-N 121.133 -0.98 . . . . 0.0 109.73 178.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -64.17 -35.4 80.67 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 121.392 -0.818 . . . . 0.0 112.905 -174.446 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -72.8 -20.84 61.08 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 120.042 -0.663 . . . . 0.0 110.223 178.504 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 16.7 mm -70.41 -39.09 76.02 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 N-CA-C 109.197 -0.668 . . . . 0.0 109.197 177.557 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -64.52 -28.07 69.4 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.542 0.687 . . . . 0.0 111.153 -179.591 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -89.1 1.17 55.99 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.174 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.9 ttmm -103.31 101.15 11.07 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.412 0.893 . . . . 0.0 113.412 -173.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.8 m -70.19 123.25 21.17 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 173.967 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -84.22 123.3 29.97 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 106.261 -1.755 . . . . 0.0 106.261 178.001 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.82 127.96 48.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-O 121.795 0.807 . . . . 0.0 109.302 179.237 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? -145.5 122.12 11.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.229 -178.746 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 63.21 -112.95 5.42 Favored Glycine 0 C--O 1.226 -0.405 0 N-CA-C 110.246 -1.142 . . . . 0.0 110.246 179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 75.7 p -105.01 -2.9 23.89 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 111.575 0.213 . . . . 0.0 111.575 178.525 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.0 t -96.84 139.47 19.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -175.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 76.3 p -119.69 140.15 51.11 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 104.631 -2.359 . . . . 0.0 104.631 168.914 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 48.3 t -133.32 130.96 57.83 Favored 'Isoleucine or valine' 0 CA--C 1.478 -1.795 0 CA-C-O 121.984 0.897 . . . . 0.0 110.044 179.106 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -100.59 109.46 57.45 Favored Pre-proline 0 N--CA 1.427 -1.624 0 CA-C-N 113.632 -1.622 . . . . 0.0 109.384 -179.947 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 67.6 Cg_endo -80.5 154.61 21.16 Favored 'Trans proline' 0 C--N 1.344 0.318 0 C-N-CA 117.894 -0.937 . . . . 0.0 112.085 178.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -152.89 151.95 30.96 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 103.863 -2.643 . . . . 0.0 103.863 175.553 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.7 tt -145.69 132.71 15.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.777 0.799 . . . . 0.0 110.489 -177.757 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 99.2 t -104.72 126.19 59.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 N-CA-C 104.416 -2.439 . . . . 0.0 104.416 175.696 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.89 142.91 43.68 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 104.511 -2.403 . . . . 0.0 104.511 176.329 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -61.5 -20.64 59.27 Favored Glycine 0 C--O 1.227 -0.321 0 C-N-CA 121.531 -0.366 . . . . 0.0 113.926 -175.555 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 55.6 p -62.49 -27.82 69.4 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.261 0.838 . . . . 0.0 113.261 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 19.5 ptp -146.9 44.46 1.17 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 122.71 1.243 . . . . 0.0 107.714 178.231 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tp -42.79 -50.41 5.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 113.606 -1.634 . . . . 0.0 114.777 -175.473 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -66.99 -36.23 81.7 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 112.473 0.546 . . . . 0.0 112.473 -177.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -73.63 -38.77 64.93 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 122.876 0.47 . . . . 0.0 110.347 -175.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 62.8 m-20 -68.77 -38.97 80.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 176.128 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.447 HD11 HD11 ' A' ' 11' ' ' ILE . 1.8 tm? -59.39 -50.18 74.95 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.439 -177.615 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -71.92 -14.54 61.96 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.58 -177.733 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -77.64 -37.26 50.39 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 122.061 -0.399 . . . . 0.0 109.957 177.123 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 7.7 p -90.28 -36.99 8.95 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-O 120.922 0.391 . . . . 0.0 111.047 -179.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 64.0 m-85 -128.67 76.13 79.04 Favored Pre-proline 0 C--N 1.326 -0.44 0 C-N-CA 122.613 0.365 . . . . 0.0 110.657 178.205 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -68.02 -14.68 41.7 Favored 'Trans proline' 0 C--N 1.349 0.596 0 CA-C-O 121.1 0.375 . . . . 0.0 112.904 178.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 17.3 m -76.47 -8.98 58.28 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.798 177.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -72.39 138.54 47.28 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 178.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.82 83.15 2.76 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.738 0.78 . . . . 0.0 112.254 -179.398 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 25.9 p -70.4 -23.12 62.7 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 175.436 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 47.3 tt0 -63.57 -26.45 68.7 Favored 'General case' 0 N--CA 1.469 0.501 0 C-N-CA 123.825 0.85 . . . . 0.0 111.176 177.666 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 83.5 m-20 -86.96 7.43 27.52 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-O 121.384 0.611 . . . . 0.0 109.903 -179.499 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 65.0 m -128.12 164.13 23.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 122.028 0.918 . . . . 0.0 112.185 -175.56 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 75.3 m -149.99 162.62 40.01 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 102.85 -3.018 . . . . 0.0 102.85 175.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -60.01 -35.94 76.13 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 118.511 0.596 . . . . 0.0 111.079 -179.772 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -66.71 -24.31 66.23 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.33 0.586 . . . . 0.0 111.896 179.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -79.34 -13.77 59.42 Favored 'General case' 0 C--N 1.324 -0.535 0 O-C-N 121.853 -0.529 . . . . 0.0 109.717 -177.529 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.05 16.83 2.17 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.803 0.335 . . . . 0.0 111.665 179.662 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 43.0 t -55.65 152.06 9.9 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.53 0.681 . . . . 0.0 111.612 179.443 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 49.4 p90 -57.72 -30.85 65.88 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.962 -178.776 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -72.38 -35.5 68.47 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 -179.964 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -71.3 -38.23 71.77 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 179.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -61.21 -39.06 88.83 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.03 0.443 . . . . 0.0 110.681 177.972 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.9 tm0? -68.53 -49.81 56.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.3 178.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 59.5 mtt -64.92 -29.74 70.7 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -178.308 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.92 -33.24 64.49 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 111.518 0.192 . . . . 0.0 111.518 -179.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 78.3 ttt180 -63.98 -47.43 80.4 Favored 'General case' 0 CA--C 1.514 -0.442 0 CA-C-O 120.959 0.409 . . . . 0.0 109.925 177.878 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -68.18 -38.95 82.57 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.213 0.53 . . . . 0.0 110.573 -177.496 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -66.11 -38.17 87.53 Favored 'General case' 0 C--O 1.214 -0.778 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 179.153 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -63.9 -44.04 94.14 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.872 0.368 . . . . 0.0 111.207 176.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 43.4 mt -63.18 -33.29 75.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.991 0.425 . . . . 0.0 110.452 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.1 m -76.06 -35.77 59.28 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.576 0.703 . . . . 0.0 110.954 176.274 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.2 tt -65.63 -41.23 92.89 Favored 'General case' 0 C--O 1.218 -0.58 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -176.655 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.5 p -58.08 -39.5 72.89 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.149 -0.621 . . . . 0.0 111.248 -176.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -73.96 -40.15 63.23 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 177.15 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -61.53 -30.06 70.4 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.555 -0.716 . . . . 0.0 111.253 -179.877 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -56.23 -28.37 58.22 Favored 'General case' 0 C--N 1.317 -0.84 0 O-C-N 121.834 -0.541 . . . . 0.0 110.566 178.474 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 75.5 mt-10 -65.96 -40.39 91.27 Favored 'General case' 0 C--O 1.241 0.638 0 O-C-N 121.587 -0.696 . . . . 0.0 111.497 -178.046 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -76.9 -38.24 53.89 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.19 -0.604 . . . . 0.0 110.245 179.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 -69.56 -37.72 77.14 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -176.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . 0.416 ' HA ' ' HB3' ' A' ' 168' ' ' GLU . 48.6 mtp180 -56.65 -18.06 10.91 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 114.909 1.448 . . . . 0.0 114.909 -177.225 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 23.8 mtmm -62.72 -60.56 3.33 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 175.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 3.6 p -72.44 -32.97 66.74 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.377 0.51 . . . . 0.0 112.377 179.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . 0.416 ' HB3' ' HA ' ' A' ' 165' ' ' ARG . 20.2 tt0 -61.99 -27.77 69.09 Favored 'General case' 0 C--O 1.214 -0.799 0 CA-C-N 116.152 -0.476 . . . . 0.0 112.17 -177.136 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -61.03 -16.14 40.05 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.38 0.881 . . . . 0.0 113.38 -179.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.91 -28.49 61.57 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.966 0.413 . . . . 0.0 111.796 178.6 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 31.4 m -118.68 150.62 20.91 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.818 0 CA-C-O 122.984 1.373 . . . . 0.0 111.208 -170.968 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 50.7 p90 -148.6 167.06 26.45 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 113.499 -1.682 . . . . 0.0 110.149 179.328 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -135.69 167.34 21.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 103.358 -2.83 . . . . 0.0 103.358 176.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 2.1 p30 -145.84 162.64 37.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 118.103 0.41 . . . . 0.0 110.537 -178.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 164.35 176.39 36.1 Favored Glycine 0 C--O 1.243 0.668 0 N-CA-C 105.779 -2.929 . . . . 0.0 105.779 -179.338 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 2.0 tppt? -159.21 168.92 25.3 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 179.566 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -111.23 144.02 41.06 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 103.357 -2.831 . . . . 0.0 103.357 175.17 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -126.22 158.88 34.53 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 105.431 -2.062 . . . . 0.0 105.431 179.454 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 71.9 ttt180 -141.66 130.13 22.55 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.55 0.214 . . . . 0.0 110.928 -176.537 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -104.0 172.32 6.87 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 176.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 54.4 t30 -122.32 144.7 48.85 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 120.854 0.359 . . . . 0.0 111.889 -179.04 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 61.6 tp -83.07 -64.23 1.21 Allowed 'General case' 0 C--O 1.22 -0.462 0 CA-C-N 116.174 -0.466 . . . . 0.0 109.789 178.149 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -161.72 -85.81 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 107.514 -1.291 . . . . 0.0 107.514 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 100.0 m-85 54.19 52.43 12.66 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-O 121.674 0.749 . . . . 0.0 111.191 -179.383 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 . . . . . 0 C--O 1.244 0.813 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 179.262 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.6 ttt . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.282 0.087 . . . . 0.0 110.98 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -99.25 165.1 11.86 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 -178.208 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt -57.02 -32.31 66.03 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -175.821 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 34.8 tp -57.61 -43.7 84.94 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.064 0.459 . . . . 0.0 110.886 -179.952 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.99 -29.82 70.27 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.336 -179.61 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -59.56 -55.65 31.86 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 179.785 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.9 m -60.41 -40.68 91.85 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.164 0.507 . . . . 0.0 111.561 -178.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -56.85 -43.55 81.27 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 178.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 78.3 m95 -78.84 -35.15 44.44 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 123.086 1.422 . . . . 0.0 109.151 -177.236 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -64.91 -39.11 93.02 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 113.131 -1.85 . . . . 0.0 111.798 -176.912 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 26.0 mm -70.23 -37.68 72.14 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.492 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 176.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.17 -42.54 91.03 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 178.318 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.19 -41.89 94.13 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.191 177.939 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -58.27 -46.71 85.51 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 178.341 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.0 mt -67.85 -49.42 62.2 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -179.92 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -59.21 -43.01 88.69 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 120.571 -0.452 . . . . 0.0 111.052 -177.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -70.77 -11.28 60.86 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 121.73 -0.606 . . . . 0.0 112.478 -179.028 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 48.9 m -95.49 6.79 48.06 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 101.7 -1.2 52.51 Favored Glycine 0 C--O 1.228 -0.247 0 N-CA-C 115.989 1.156 . . . . 0.0 115.989 176.527 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -68.03 118.85 11.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 118.519 1.159 . . . . 0.0 109.103 178.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -70.66 127.52 16.31 Favored Glycine 0 N--CA 1.451 -0.344 0 N-CA-C 108.772 -1.731 . . . . 0.0 108.772 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.9 p -84.48 130.51 35.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.656 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 -178.539 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 70.6 mt -102.39 -41.41 7.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.244 -176.867 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.9 tp-100 -140.71 140.24 34.86 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 103.881 -2.637 . . . . 0.0 103.881 178.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.461 ' HA ' HG23 ' A' ' 31' ' ' ILE . . . -136.84 105.32 5.77 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.087 0.773 . . . . 0.0 113.087 -179.206 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 47.26 50.4 17.18 Favored Glycine 0 N--CA 1.45 -0.405 0 N-CA-C 116.513 1.365 . . . . 0.0 116.513 171.736 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 1.3 pm0 -64.1 -32.26 73.75 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 178.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 29.9 m -164.67 -57.26 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 107.878 -1.156 . . . . 0.0 107.878 176.512 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 63.6 m-20 -128.62 -17.0 4.17 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 118.214 2.672 . . . . 0.0 118.214 -174.433 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 23.6 pt-20 -121.97 158.63 28.67 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 116.346 1.98 . . . . 0.0 116.346 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.461 HG23 ' HA ' ' A' ' 25' ' ' ALA . 7.2 mt -138.33 127.42 32.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 N-CA-C 105.859 -1.904 . . . . 0.0 105.859 176.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -112.51 132.47 55.07 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 178.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -127.62 131.85 49.84 Favored 'General case' 0 C--N 1.322 -0.596 0 O-C-N 123.542 0.526 . . . . 0.0 109.684 -178.421 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -84.15 134.48 34.57 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -72.59 114.97 34.88 Favored Pre-proline 0 CA--C 1.546 0.814 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.389 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -73.61 -28.07 12.21 Favored 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 117.239 -1.374 . . . . 0.0 114.157 -174.174 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -9.88 59.25 Favored 'General case' 0 CA--C 1.509 -0.608 0 O-C-N 122.171 -0.331 . . . . 0.0 111.461 -179.502 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 14.7 mtmm 62.2 39.68 12.44 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 105.582 -2.007 . . . . 0.0 105.582 -175.176 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.74 -177.71 0.63 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 111.519 -2.582 . . . . 0.0 115.726 -176.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -44.99 -28.09 0.63 Allowed 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 115.522 1.675 . . . . 0.0 115.522 177.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -114.51 141.43 47.72 Favored 'General case' 0 C--O 1.218 -0.558 0 N-CA-C 106.193 -1.78 . . . . 0.0 106.193 174.053 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.06 -36.85 55.62 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 -178.739 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.7 mt -140.65 163.02 33.99 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 -177.587 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 87.0 t -128.19 136.56 59.82 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 105.213 -2.144 . . . . 0.0 105.213 174.569 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 53.1 ttt-85 -123.48 129.19 50.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.881 0.372 . . . . 0.0 110.23 179.289 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.4 mt -109.87 120.86 43.78 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 104.769 -2.308 . . . . 0.0 104.769 176.407 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -136.45 132.85 35.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 117.95 0.341 . . . . 0.0 110.289 -176.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -106.96 118.79 37.62 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 121.212 0.529 . . . . 0.0 110.41 179.518 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 34.7 t60 -151.55 150.18 30.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -177.966 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -86.05 143.27 28.18 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 176.023 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 83.9 mt -143.69 103.58 4.09 Favored 'General case' 0 C--O 1.219 -0.516 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 -178.729 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -79.62 -38.41 33.89 Favored 'General case' 0 N--CA 1.476 0.849 0 CA-C-O 121.769 0.795 . . . . 0.0 111.99 -178.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 51.2 m-85 -129.1 152.77 48.33 Favored 'General case' 0 C--N 1.326 -0.426 0 O-C-N 121.952 -0.468 . . . . 0.0 110.116 -177.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 7.6 ptt180 -64.02 -20.9 66.24 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 -64.7 -33.49 76.08 Favored 'General case' 0 C--O 1.213 -0.863 0 C-N-CA 119.671 -0.812 . . . . 0.0 108.875 179.301 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.9 mm-40 -73.07 -32.28 64.92 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 177.311 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 28.6 ttm -66.23 -51.02 61.64 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 177.448 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 18.4 m -61.91 -34.55 63.4 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-N 118.82 0.736 . . . . 0.0 111.291 178.894 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 88.3 mtt180 -64.71 -38.25 90.34 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 120.752 0.311 . . . . 0.0 110.969 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -59.75 -44.07 94.0 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 -179.911 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.417 HG21 ' HB2' ' A' ' 104' ' ' PHE . 1.3 mm -66.14 -31.15 52.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 C-N-CA 120.54 -0.464 . . . . 0.0 112.13 -177.474 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -64.14 -39.77 94.72 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 177.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 41.3 tp10 -68.52 -44.9 73.61 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 178.145 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -57.97 -44.17 86.91 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 -179.698 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.87 -43.85 90.94 Favored 'General case' 0 N--CA 1.441 -0.919 0 N-CA-C 111.477 0.177 . . . . 0.0 111.477 -176.984 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -69.08 -36.26 77.41 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 119.965 -0.694 . . . . 0.0 110.88 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 21.5 mmt180 -64.21 -45.74 86.93 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 121.705 -0.622 . . . . 0.0 109.548 177.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 54.2 t -64.69 -37.87 81.21 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.648 -179.492 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -61.6 -41.65 97.74 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 122.211 -0.306 . . . . 0.0 110.643 178.76 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 83.8 mtt85 -62.98 -44.72 95.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 120.909 -0.316 . . . . 0.0 110.426 179.139 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 92.7 t -63.24 -40.81 90.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.485 ' HA ' ' HE ' ' A' ' 72' ' ' ARG . 0.2 OUTLIER -68.0 -40.54 83.01 Favored 'General case' 0 C--N 1.324 -0.534 0 O-C-N 121.249 -0.907 . . . . 0.0 111.619 179.659 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 27.9 t-80 -60.16 -35.96 76.5 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.926 0.393 . . . . 0.0 110.201 179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 42.5 tt0 -60.75 -31.11 70.46 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 113.982 1.105 . . . . 0.0 113.982 -179.241 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -120.81 9.06 10.62 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -177.348 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.09 5.67 21.43 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 121.472 3.349 . . . . 0.0 121.472 171.274 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 -67.44 146.61 53.83 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 119.877 1.839 . . . . 0.0 107.44 178.763 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 51.8 tpt85 -62.31 -42.67 99.56 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.675 1.361 . . . . 0.0 114.675 -174.596 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 3.3 ptm85 -147.39 152.31 37.95 Favored 'General case' 0 CA--C 1.504 -0.79 0 CA-C-N 118.918 0.781 . . . . 0.0 110.307 179.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . 0.441 ' HG2' ' CZ ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -100.4 163.83 12.2 Favored 'General case' 0 N--CA 1.44 -0.956 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.37 123.08 12.58 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.775 -3.787 . . . . 0.0 100.775 174.746 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -142.41 114.27 8.08 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.879 0.763 . . . . 0.0 111.803 -173.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 62.2 tp -81.46 117.26 21.74 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 176.011 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -111.47 109.52 19.51 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 110.283 -0.265 . . . . 0.0 110.283 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 21.1 t -103.28 112.18 35.78 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-O 120.866 0.365 . . . . 0.0 111.955 -176.483 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -85.76 117.78 24.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.11 177.744 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 54.7 m-85 -94.23 111.44 23.18 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 105.179 -2.156 . . . . 0.0 105.179 174.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 98.2 p -122.16 155.19 36.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 120.83 0.348 . . . . 0.0 111.111 -176.038 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 16.4 m -67.24 -48.41 67.86 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.701 -1.222 . . . . 0.0 107.701 176.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -148.72 159.81 43.77 Favored 'General case' 0 N--CA 1.439 -0.986 0 N-CA-C 103.644 -2.725 . . . . 0.0 103.644 -177.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -91.09 159.12 40.45 Favored Pre-proline 0 C--N 1.314 -0.951 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.717 -175.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -56.34 147.84 65.0 Favored 'Trans proline' 0 C--N 1.351 0.699 0 N-CA-C 115.614 1.352 . . . . 0.0 115.614 179.151 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 30.2 m -84.44 -5.24 9.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.4 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -115.03 97.11 6.03 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.649 0.38 . . . . 0.0 111.316 -177.325 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 14.55 64.14 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 117.9 2.555 . . . . 0.0 117.9 176.506 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 54.8 p-90 -83.57 -16.74 44.21 Favored 'General case' 0 C--N 1.319 -0.752 0 O-C-N 121.5 -0.75 . . . . 0.0 112.34 -178.821 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.16 -37.06 71.54 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -173.957 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -66.06 -23.95 66.63 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 121.644 -0.66 . . . . 0.0 111.686 178.533 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 9.1 mm -67.07 -37.3 79.03 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 -176.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -60.99 -22.9 64.95 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 112.975 0.731 . . . . 0.0 112.975 -177.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.4 mptt -92.04 3.27 55.63 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -179.217 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 38.8 mttm -102.72 98.45 8.47 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 122.033 -0.417 . . . . 0.0 111.63 -178.23 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 88.6 m -68.04 126.54 29.82 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 174.251 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . 0.417 ' HB2' HG21 ' A' ' 61' ' ' ILE . 9.5 t80 -82.72 109.03 16.53 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 -178.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -111.07 114.43 27.7 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-N 114.391 -1.277 . . . . 0.0 109.327 -176.226 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -134.57 80.48 1.85 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.609 -177.774 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 70.13 -108.48 2.49 Favored Glycine 0 CA--C 1.517 0.185 0 C-N-CA 118.902 -1.618 . . . . 0.0 112.747 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 66.0 p -86.92 11.59 13.12 Favored 'General case' 0 C--N 1.323 -0.585 0 C-N-CA 123.221 0.608 . . . . 0.0 111.062 179.489 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 92.6 t -120.68 141.06 42.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 113.105 0.78 . . . . 0.0 113.105 -176.317 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 22.8 t -141.23 127.4 19.63 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 104.45 -2.426 . . . . 0.0 104.45 169.734 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 85.1 t -133.64 123.49 45.86 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -102.89 115.8 63.59 Favored Pre-proline 0 C--N 1.318 -0.782 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.046 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -79.86 157.58 24.21 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 116.033 -2.178 . . . . 0.0 112.975 179.257 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.78 151.83 35.49 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 103.615 -2.735 . . . . 0.0 103.615 174.31 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 15.1 tt -146.18 142.68 21.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.702 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 -179.94 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 35.1 m -124.34 138.19 54.7 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 N-CA-C 104.478 -2.415 . . . . 0.0 104.478 174.373 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -111.38 142.35 43.74 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.242 -2.132 . . . . 0.0 105.242 178.569 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.86 -19.48 61.02 Favored Glycine 0 C--N 1.323 -0.194 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.806 -176.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 49.1 p -63.9 -33.38 75.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 114.207 1.188 . . . . 0.0 114.207 -178.012 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.4 ptm -138.33 36.63 2.29 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 122.738 1.256 . . . . 0.0 108.54 -178.74 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 20.4 tp -49.87 -36.53 27.39 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 116.948 2.203 . . . . 0.0 116.948 -173.238 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -63.64 -48.2 78.2 Favored 'General case' 0 N--CA 1.471 0.59 0 O-C-N 121.706 -0.621 . . . . 0.0 110.862 -178.111 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -72.87 -34.17 66.54 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.294 -177.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.79 -42.64 81.31 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.961 178.264 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -60.7 -48.6 81.05 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.789 -0.364 . . . . 0.0 111.703 -177.941 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -68.85 -13.78 62.62 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 120.817 -0.353 . . . . 0.0 111.529 -177.201 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.05 -32.48 50.91 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.171 -0.33 . . . . 0.0 110.66 176.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 6.9 p -95.63 -38.19 8.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 CA-C-O 120.887 0.375 . . . . 0.0 111.078 178.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 48.2 m-85 -126.87 76.12 75.55 Favored Pre-proline 0 C--N 1.325 -0.495 0 C-N-CA 122.475 0.31 . . . . 0.0 110.534 178.53 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.09 -13.98 39.59 Favored 'Trans proline' 0 C--N 1.347 0.493 0 CA-C-O 121.195 0.415 . . . . 0.0 112.412 178.443 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 4.4 m -69.87 -13.71 62.39 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.3 177.07 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -105.65 127.88 53.32 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.07 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 14.0 ptt180 -85.77 135.36 33.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.167 0.508 . . . . 0.0 112.242 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 28.4 p -67.15 -19.6 65.62 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.15 0.5 . . . . 0.0 110.073 177.754 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -64.65 -14.96 60.4 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 178.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.84 2.06 6.04 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -175.277 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 48.8 t -149.74 100.79 3.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 173.063 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 34.4 t -62.02 151.55 34.93 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 177.618 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -61.9 -34.12 75.47 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.33 0.586 . . . . 0.0 109.697 178.761 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -61.89 -32.58 72.96 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 122.117 0.96 . . . . 0.0 110.492 177.411 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -93.93 -4.16 50.34 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.65 -176.668 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -79.27 37.79 0.34 Allowed 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -176.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 75.7 m -68.8 150.51 47.75 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 178.179 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -60.86 -28.81 69.13 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -177.365 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.67 -26.78 68.82 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 121.908 -0.495 . . . . 0.0 110.714 177.913 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -67.64 -27.57 66.99 Favored 'General case' 0 C--O 1.216 -0.659 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -178.518 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.29 -35.29 80.57 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.979 0.419 . . . . 0.0 110.293 178.535 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -74.26 -45.88 45.03 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 177.961 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 20.2 mmt -59.14 -31.4 68.93 Favored 'General case' 0 C--O 1.219 -0.546 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.339 179.642 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -58.98 -39.2 81.06 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 122.244 -0.285 . . . . 0.0 111.147 179.453 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 -67.85 -47.39 69.08 Favored 'General case' 0 C--O 1.213 -0.839 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 178.921 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -62.22 -42.86 99.68 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.263 0.554 . . . . 0.0 111.019 -176.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -69.39 -34.44 74.53 Favored 'General case' 0 C--O 1.212 -0.9 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.635 178.649 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -66.35 -45.45 80.14 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-N 118.075 0.398 . . . . 0.0 110.13 176.963 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 65.2 mt -62.18 -39.72 93.63 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 179.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 40.1 m -67.02 -37.47 84.19 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.675 177.223 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 3.7 tt -65.14 -38.83 91.87 Favored 'General case' 0 C--O 1.214 -0.807 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.278 -179.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 55.3 t -57.75 -47.96 84.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.699 -0.482 . . . . 0.0 109.699 179.462 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -70.18 -39.07 75.48 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 121.808 -0.558 . . . . 0.0 110.342 179.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.6 ttpp -63.11 -29.98 71.23 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 121.965 -0.459 . . . . 0.0 111.837 178.841 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -56.23 -30.72 62.74 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 177.463 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -70.19 -34.94 73.57 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.188 0.518 . . . . 0.0 110.755 -179.412 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -68.66 -40.9 79.99 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 176.647 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 26.2 mt-30 -70.48 -38.31 74.38 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -59.28 -17.61 30.24 Favored 'General case' 0 C--O 1.214 -0.806 0 N-CA-C 117.621 2.452 . . . . 0.0 117.621 -171.912 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.4 -22.59 43.95 Favored 'General case' 0 N--CA 1.473 0.686 0 O-C-N 121.347 -0.845 . . . . 0.0 110.347 173.563 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 1.9 m -72.39 -23.35 61.09 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 177.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 92.4 mt-10 -64.23 -24.29 67.62 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 122.992 0.517 . . . . 0.0 110.444 -179.478 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -66.82 -14.21 62.42 Favored 'General case' 0 CA--C 1.542 0.646 0 N-CA-C 112.673 0.62 . . . . 0.0 112.673 178.808 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -69.01 142.79 54.53 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 178.986 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 24.5 t -76.73 94.22 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.421 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -151.84 173.99 14.11 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.498 -177.442 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -147.38 148.66 31.56 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 177.749 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -155.48 144.38 20.64 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 179.387 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 74.04 174.44 30.58 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.186 -179.204 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -164.3 127.88 2.54 Favored 'General case' 0 C--O 1.22 -0.478 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.552 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.2 mp -131.28 150.1 52.29 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 106.269 -1.752 . . . . 0.0 106.269 176.18 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 179.42 152.34 0.4 Allowed 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 177.491 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 47.1 mtt85 61.35 -121.95 0.81 Allowed 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 106.381 -1.711 . . . . 0.0 106.381 -177.056 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 24.0 mt-10 52.66 36.92 22.14 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.173 0.589 . . . . 0.0 111.152 177.342 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.7 p-10 -144.03 157.43 44.33 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -175.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 11.8 tp 67.91 167.91 0.26 Allowed 'General case' 0 N--CA 1.475 0.822 0 O-C-N 124.871 1.357 . . . . 0.0 112.653 178.226 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 42.5 p90 -151.3 157.82 43.03 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 105.471 -2.048 . . . . 0.0 105.471 -178.856 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -152.54 5.67 0.39 Allowed 'General case' 0 C--N 1.323 -0.552 0 O-C-N 123.191 0.307 . . . . 0.0 110.922 179.362 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 31.7 mt-30 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 117.03 -1.462 . . . . 0.0 111.11 -177.103 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.2 mtm . . . . . 0 N--CA 1.497 1.92 0 N-CA-C 110.345 -0.242 . . . . 0.0 110.345 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -67.99 -2.54 7.8 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 115.192 1.552 . . . . 0.0 115.192 -177.484 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.01 -44.93 83.31 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.544 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 58.0 mt -68.02 -35.28 78.02 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.332 179.963 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -63.64 -33.03 74.71 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.95 -176.275 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 82.2 t80 -60.38 -48.59 81.09 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.577 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.0 m -68.84 -40.11 79.57 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.046 0.45 . . . . 0.0 111.198 179.362 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -54.44 -52.23 62.45 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.185 0.439 . . . . 0.0 112.185 -178.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 87.0 m95 -70.14 -27.01 64.21 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.604 -0.685 . . . . 0.0 111.339 -179.885 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.8 mmtm -68.51 -36.75 79.32 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.796 -0.565 . . . . 0.0 110.23 176.452 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 21.8 mm -67.0 -45.09 87.85 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 177.421 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.34 77.52 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.221 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.1 -42.5 99.28 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 112.757 0.651 . . . . 0.0 112.757 179.293 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.79 -35.71 77.37 Favored 'General case' 0 C--O 1.218 -0.573 0 C-N-CA 120.442 -0.503 . . . . 0.0 110.889 -178.308 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.5 mt -69.72 -47.25 63.78 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 178.441 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.2 t -57.62 -41.59 79.54 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 120.407 -0.517 . . . . 0.0 112.168 177.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -75.05 -6.65 50.58 Favored 'General case' 0 C--O 1.217 -0.618 0 O-C-N 121.026 -1.046 . . . . 0.0 112.34 179.45 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 52.3 m -92.6 10.3 31.03 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 173.583 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 100.62 -3.55 56.25 Favored Glycine 0 C--N 1.329 0.167 0 N-CA-C 116.147 1.219 . . . . 0.0 116.147 175.716 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -67.53 125.23 25.51 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.649 0.724 . . . . 0.0 110.246 -179.902 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -84.71 131.24 10.29 Favored Glycine 0 C--O 1.225 -0.437 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 -179.135 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.6 t -73.55 126.69 34.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 N-CA-C 108.868 -0.789 . . . . 0.0 108.868 179.334 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.491 HD11 HD22 ' A' ' 43' ' ' LEU . 71.8 mt -92.72 -43.12 13.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.006 -1.479 . . . . 0.0 107.006 177.305 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -149.16 121.03 8.16 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.607 -176.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.24 122.86 16.26 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 105.224 -2.139 . . . . 0.0 105.224 171.501 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -176.28 -54.82 0.06 OUTLIER Glycine 0 CA--C 1.504 -0.6 0 N-CA-C 110.167 -1.173 . . . . 0.0 110.167 178.438 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -68.97 139.88 55.04 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 105.072 -2.196 . . . . 0.0 105.072 176.143 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 28.6 m -74.74 -8.95 57.98 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 -174.027 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -111.14 -9.8 14.34 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 113.839 1.051 . . . . 0.0 113.839 -175.305 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.69 129.72 20.75 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.8 1.037 . . . . 0.0 113.8 -177.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 89.1 mt -135.89 131.78 50.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.478 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 179.077 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 39.8 m95 -109.17 138.74 45.06 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.046 0.45 . . . . 0.0 110.882 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mp -132.57 137.97 47.29 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 124.131 0.972 . . . . 0.0 109.963 -178.31 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -86.57 133.92 33.68 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 175.375 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.07 119.76 77.93 Favored Pre-proline 0 CA--C 1.536 0.441 0 N-CA-C 103.393 -2.818 . . . . 0.0 103.393 174.964 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -70.55 -23.32 27.32 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 116.356 -1.962 . . . . 0.0 112.807 -173.545 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -71.35 -34.82 70.85 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 179.632 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.6 mptt 58.05 41.08 24.66 Favored 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 123.818 1.771 . . . . 0.0 108.652 -169.22 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 23.0 t -75.12 -172.78 1.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 110.939 -2.846 . . . . 0.0 105.681 172.816 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 5.2 m -41.22 -27.79 0.08 Allowed 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 116.183 1.92 . . . . 0.0 116.183 179.964 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 87.5 m-70 -108.58 133.84 52.16 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 172.085 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 47.5 m-20 -87.69 -44.73 10.96 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.185 0.516 . . . . 0.0 111.152 -178.224 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.491 HD22 HD11 ' A' ' 23' ' ' ILE . 76.2 mt -137.07 160.64 38.36 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -177.674 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 81.1 t -130.7 135.61 59.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 N-CA-C 106.954 -1.499 . . . . 0.0 106.954 177.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.49 135.66 52.54 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 174.588 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 tp -106.04 130.21 54.0 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 106.257 -1.757 . . . . 0.0 106.257 -179.591 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -130.27 124.74 33.11 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.846 0.355 . . . . 0.0 111.54 -176.823 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.4 ttpt -103.3 94.52 5.55 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 107.282 -1.377 . . . . 0.0 107.282 -179.548 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 9.2 t60 -149.36 133.85 17.58 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 -175.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 8.5 p-10 -78.28 144.64 35.95 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 114.739 -1.119 . . . . 0.0 108.439 176.889 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -135.93 110.05 8.31 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -177.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -81.42 -39.66 24.58 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-O 121.661 0.743 . . . . 0.0 111.4 -179.407 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 87.5 m-85 -127.0 149.78 49.73 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.567 -178.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -66.29 -18.86 65.6 Favored 'General case' 0 CA--C 1.504 -0.803 0 O-C-N 122.341 -0.225 . . . . 0.0 111.378 -178.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -62.99 -33.42 75.37 Favored 'General case' 0 C--O 1.211 -0.97 0 C-N-CA 119.616 -0.834 . . . . 0.0 108.874 178.054 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -71.36 -38.26 71.6 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.964 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.5 ttm -59.8 -51.18 70.83 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.802 178.888 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 15.1 m -64.55 -31.83 55.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 CA-C-O 121.166 0.508 . . . . 0.0 111.496 -178.112 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 30.5 mmt180 -70.06 -41.47 74.12 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-N 115.745 -0.661 . . . . 0.0 109.55 -177.64 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -58.57 -41.99 86.94 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 179.139 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.9 mm -70.07 -33.69 56.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 C-N-CA 119.776 -0.769 . . . . 0.0 111.788 -178.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.57 -31.05 69.98 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.763 -178.772 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -45.33 58.77 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 175.15 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -57.49 -35.05 69.7 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.176 179.525 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.72 -34.48 74.45 Favored 'General case' 0 N--CA 1.445 -0.676 0 O-C-N 122.354 -0.216 . . . . 0.0 111.261 -179.867 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -69.91 -38.97 76.42 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 178.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.9 mmt180 -61.59 -43.43 98.88 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.679 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.421 HG11 HG13 ' A' ' 109' ' ' VAL . 70.8 t -64.98 -44.24 96.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.339 179.41 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -58.41 -46.06 87.2 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 179.746 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.4 ttm105 -61.33 -42.3 98.44 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 -177.719 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 8.8 p -78.3 -38.54 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 C-N-CA 120.052 -0.659 . . . . 0.0 111.695 179.504 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.18 -30.21 70.1 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.151 -0.968 . . . . 0.0 111.533 -177.959 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -40.24 78.22 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.759 0.314 . . . . 0.0 110.415 179.354 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -67.18 -39.38 86.41 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.917 -178.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mp -80.11 -8.13 59.25 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.892 -179.975 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.38 19.44 68.6 Favored Glycine 0 CA--C 1.521 0.469 0 N-CA-C 114.029 0.372 . . . . 0.0 114.029 179.787 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.2 mtp85 -67.39 141.23 57.13 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 121.761 -0.846 . . . . 0.0 111.936 -177.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -67.35 -35.14 78.77 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 178.002 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -155.72 147.56 23.2 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 104.575 -2.38 . . . . 0.0 104.575 175.414 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -122.45 139.91 53.32 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 105.91 -1.885 . . . . 0.0 105.91 178.104 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -113.46 121.39 44.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.92 0.39 . . . . 0.0 111.033 177.703 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -110.95 130.54 55.55 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.363 -178.121 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 65.5 tp -93.05 121.13 34.07 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 173.607 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -115.89 128.33 55.71 Favored 'General case' 0 CA--C 1.504 -0.816 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 177.742 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.4 t -125.45 113.87 37.05 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.644 0 CA-C-O 120.969 0.414 . . . . 0.0 110.676 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 73.6 m-85 -80.05 146.21 32.06 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.056 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.8 m-85 -123.85 111.85 16.58 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 106.377 -1.712 . . . . 0.0 106.377 173.209 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 46.3 t -135.41 161.08 36.44 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 -175.465 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 13.6 t -75.17 -29.06 60.32 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 121.799 -0.563 . . . . 0.0 110.042 -177.615 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.6 pt-20 -152.76 167.35 29.3 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 177.961 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -98.73 160.76 27.09 Favored Pre-proline 0 C--N 1.319 -0.749 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 -176.84 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_exo -55.24 149.77 43.64 Favored 'Trans proline' 0 C--N 1.35 0.626 0 N-CA-C 115.609 1.35 . . . . 0.0 115.609 -179.339 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 31.2 m -76.27 -15.15 15.09 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 N-CA-C 115.455 1.65 . . . . 0.0 115.455 -176.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -119.2 98.44 6.16 Favored 'General case' 0 C--O 1.21 -1.022 0 N-CA-C 116.118 1.896 . . . . 0.0 116.118 -175.087 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 67.7 m-20 45.42 29.1 0.55 Allowed 'General case' 0 N--CA 1.484 1.269 0 N-CA-C 118.549 2.796 . . . . 0.0 118.549 170.967 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 37.2 p-90 -61.73 -22.25 65.22 Favored 'General case' 0 C--O 1.214 -0.789 0 O-C-N 121.089 -1.007 . . . . 0.0 111.283 178.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -62.69 -31.42 72.31 Favored 'General case' 0 C--N 1.319 -0.723 0 O-C-N 121.839 -0.538 . . . . 0.0 111.01 -178.026 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -60.47 -35.56 76.18 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 176.8 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 11.5 mm -67.58 -40.06 83.51 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 -176.627 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.68 -15.85 63.85 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 44.8 mmtm -96.56 0.56 50.24 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 122.054 -0.404 . . . . 0.0 110.912 179.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -123.8 116.01 22.28 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.791 0.805 . . . . 0.0 111.466 -178.459 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 96.1 m -68.19 128.3 36.06 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 104.61 -2.367 . . . . 0.0 104.61 176.19 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -82.74 107.81 15.65 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 107.301 -1.37 . . . . 0.0 107.301 -178.32 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -117.11 137.63 52.17 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.894 0.854 . . . . 0.0 111.926 -176.312 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 11.5 mmtt -137.21 75.29 1.52 Allowed 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 107.709 -1.219 . . . . 0.0 107.709 177.467 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.42 -111.09 3.9 Favored Glycine 0 CA--C 1.519 0.332 0 C-N-CA 119.491 -1.338 . . . . 0.0 112.221 178.767 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 21.5 p -73.43 8.9 1.53 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.547 1.139 . . . . 0.0 113.39 -179.872 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.421 HG13 HG11 ' A' ' 68' ' ' VAL . 67.6 t -127.82 143.79 39.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 C-N-CA 122.793 0.437 . . . . 0.0 111.307 -177.687 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 8.8 p -143.62 131.32 21.33 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 171.56 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 43.0 t -136.77 138.9 45.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 122.178 -0.326 . . . . 0.0 110.284 -179.033 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -98.25 122.62 53.45 Favored Pre-proline 0 CA--C 1.535 0.381 0 C-N-CA 120.271 -0.572 . . . . 0.0 109.672 175.557 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -83.31 65.28 7.73 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 121.829 1.686 . . . . 0.0 113.708 178.151 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -79.26 153.69 29.72 Favored 'General case' 0 C--N 1.319 -0.738 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 -177.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 12.0 tt -149.37 143.23 18.19 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 85.5 t -116.41 112.31 38.92 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 N-CA-C 105.294 -2.113 . . . . 0.0 105.294 173.222 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.413 ' HE ' ' CG ' ' A' ' 124' ' ' ASP . 0.0 OUTLIER -94.52 136.18 35.12 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-O 121.353 0.597 . . . . 0.0 109.7 178.995 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.94 -37.82 93.22 Favored Glycine 0 C--O 1.227 -0.295 0 N-CA-C 115.496 0.958 . . . . 0.0 115.496 -176.699 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 9.5 t -57.04 -17.77 11.44 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 115.217 1.562 . . . . 0.0 115.217 -178.298 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.6 ptm -146.48 31.97 0.98 Allowed 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 176.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 5.7 tt -46.71 -40.09 12.73 Favored 'General case' 0 C--O 1.209 -1.073 0 N-CA-C 115.369 1.618 . . . . 0.0 115.369 -173.496 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -59.24 -50.23 74.81 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.313 -0.555 . . . . 0.0 111.985 -176.756 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -73.76 -39.45 64.19 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 122.1 0.953 . . . . 0.0 111.817 179.168 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.413 ' CG ' ' HE ' ' A' ' 117' ' ' ARG . 1.8 t0 -67.11 -35.23 79.3 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-O 121.73 0.776 . . . . 0.0 112.136 -176.454 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 8.6 tt -69.23 -43.34 74.24 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.105 -179.192 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -69.92 -16.96 63.3 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 120.452 -0.499 . . . . 0.0 111.92 -175.954 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.25 -25.73 61.73 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.905 0.383 . . . . 0.0 110.294 177.356 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 29.2 t -103.06 -41.5 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 CA-C-O 121.203 0.525 . . . . 0.0 110.545 179.735 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -127.05 75.91 76.37 Favored Pre-proline 0 CA--C 1.54 0.583 0 C-N-CA 123.113 0.565 . . . . 0.0 111.434 -178.635 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -68.91 -17.49 41.49 Favored 'Trans proline' 0 C--N 1.346 0.419 0 N-CA-C 114.759 1.023 . . . . 0.0 114.759 -177.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.1 m -85.61 0.99 51.02 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -179.911 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 64.4 t80 -72.48 134.72 45.46 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.646 0.736 . . . . 0.0 112.877 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -82.18 97.68 8.34 Favored 'General case' 0 CA--C 1.513 -0.442 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.902 177.674 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 41.8 p -68.21 -18.62 64.63 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.954 178.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -63.0 -36.02 82.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 120.913 0.387 . . . . 0.0 111.049 177.566 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -75.75 -13.92 60.31 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.757 0.789 . . . . 0.0 109.854 -179.356 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 24.6 t -131.1 50.58 2.22 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.369 -176.22 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 76.6 p -64.59 157.16 27.75 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 179.367 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -60.78 -34.52 74.61 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.121 0.486 . . . . 0.0 112.071 -176.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -70.34 -31.2 68.38 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.432 0.634 . . . . 0.0 111.132 -179.544 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -79.51 -11.82 59.88 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.82 -176.374 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -77.51 34.25 0.17 Allowed 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -176.15 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 58.7 m -65.32 151.65 45.72 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.047 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -64.05 -37.53 87.77 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -174.109 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -71.47 -30.19 65.71 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.662 0.744 . . . . 0.0 109.287 178.47 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -68.92 -24.32 64.27 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.15 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.34 -38.22 90.28 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 176.497 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.69 -42.8 95.07 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 177.656 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 80.9 mtp -64.2 -28.94 70.09 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.92 178.397 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -65.15 -28.39 69.38 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.59 -0.694 . . . . 0.0 110.373 178.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 85.4 mtt180 -68.85 -46.43 68.55 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 177.06 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -61.81 -40.95 97.05 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.764 0.792 . . . . 0.0 109.579 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 58.9 ttt85 -59.14 -45.49 90.81 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 115.221 -0.9 . . . . 0.0 109.387 176.77 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -67.21 -41.44 85.79 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 -179.583 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -62.65 -39.13 92.89 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.474 -0.565 . . . . 0.0 109.474 179.332 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.1 m -69.58 -38.44 77.37 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.34 0.591 . . . . 0.0 110.445 176.983 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -63.69 -49.07 74.58 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.863 -178.355 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 12.1 p -62.43 -38.91 82.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 118.343 0.52 . . . . 0.0 110.809 -177.371 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -72.06 -40.48 68.29 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 119.857 -0.737 . . . . 0.0 110.028 179.772 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 26.4 tttt -65.18 -31.76 73.1 Favored 'General case' 0 C--N 1.327 -0.41 0 O-C-N 121.261 -0.899 . . . . 0.0 110.797 178.57 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.15 -28.47 62.78 Favored 'General case' 0 C--N 1.322 -0.622 0 O-C-N 122.257 -0.277 . . . . 0.0 110.749 179.094 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -62.02 -37.38 84.69 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 120.485 -0.486 . . . . 0.0 110.474 -179.726 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -76.92 -51.01 11.97 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 120.891 0.377 . . . . 0.0 110.031 -179.993 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -60.12 -45.47 92.89 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 113.132 0.79 . . . . 0.0 113.132 -174.194 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 31.1 ptt180 -63.54 -17.77 63.15 Favored 'General case' 0 C--O 1.22 -0.485 0 N-CA-C 114.688 1.366 . . . . 0.0 114.688 -177.084 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -68.84 -43.94 74.44 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 178.79 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 19.5 m -72.31 -45.82 58.34 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.611 178.636 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 22.3 tt0 -63.71 -24.48 67.79 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 114.029 1.122 . . . . 0.0 114.029 -176.033 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -54.87 -29.24 55.05 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 -179.197 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . 40.16 57.62 2.37 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 121.817 0.817 . . . . 0.0 112.47 179.401 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . 0.422 HG23 ' H ' ' A' ' 171' ' ' VAL . 1.7 t -51.14 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 N-CA-C 115.421 1.637 . . . . 0.0 115.421 -174.055 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -154.24 163.82 39.52 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 105.939 -1.875 . . . . 0.0 105.939 178.759 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -71.16 -25.16 62.43 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.565 179.22 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 58.63 -168.64 0.14 Allowed 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.728 0.811 . . . . 0.0 113.007 177.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 173.28 102.88 0.16 Allowed Glycine 0 C--O 1.225 -0.421 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 179.472 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -143.99 131.28 20.82 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -177.723 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -148.67 114.56 5.73 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 178.551 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -160.98 167.86 25.7 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 -178.502 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.2 tpt180 -145.81 122.0 10.83 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.262 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -73.33 157.08 37.66 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.536 -0.912 . . . . 0.0 108.536 176.557 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 55.5 t30 -145.52 98.57 3.16 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 178.722 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -156.03 162.51 40.3 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -179.503 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 94.1 m-85 -148.27 154.46 40.07 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 178.831 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -149.99 39.26 0.76 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 177.45 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 . . . . . 0 C--O 1.251 1.166 0 CA-C-O 116.275 -1.821 . . . . 0.0 106.764 -176.724 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.246 0 CA-C-O 119.577 -0.249 . . . . 0.0 110.35 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -137.54 155.14 49.58 Favored 'General case' 0 C--O 1.218 -0.567 0 CA-C-N 117.908 0.322 . . . . 0.0 111.472 -179.99 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 72.4 mt -66.37 -32.32 73.63 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 173.05 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 37.2 mt -60.72 -40.39 92.12 Favored 'General case' 0 C--O 1.206 -1.221 0 CA-C-N 114.508 -1.224 . . . . 0.0 110.328 177.247 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 78.4 tt0 -67.84 -38.42 83.17 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 123.071 0.548 . . . . 0.0 109.988 -179.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -60.27 -46.63 89.14 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 177.83 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 10.7 m -68.01 -40.71 82.94 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.511 179.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 27.7 t80 -55.55 -52.14 64.72 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 123.497 0.719 . . . . 0.0 111.907 -179.535 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -68.33 -28.35 67.07 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 121.661 -0.649 . . . . 0.0 111.571 -178.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.0 mtpp -69.71 -38.2 76.84 Favored 'General case' 0 N--CA 1.469 0.521 0 O-C-N 121.906 -0.496 . . . . 0.0 109.684 176.333 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.662 HD11 HD11 ' A' ' 125' ' ' LEU . 12.4 mm -62.48 -45.79 97.94 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 177.357 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.85 -41.91 75.04 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.132 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.3 -42.32 96.43 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.946 0.721 . . . . 0.0 112.946 178.518 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 80.4 m-70 -62.84 -45.69 91.41 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 120.628 -0.429 . . . . 0.0 110.259 -178.874 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.4 mt -65.84 -46.92 76.76 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.277 -176.644 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.4 t -57.38 -43.43 82.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-O 121.511 0.672 . . . . 0.0 109.537 178.798 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -78.88 3.75 16.05 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -178.04 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 60.6 m -107.58 11.21 28.85 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 176.645 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 93.24 7.06 62.49 Favored Glycine 0 CA--C 1.516 0.148 0 N-CA-C 115.528 0.971 . . . . 0.0 115.528 177.499 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -69.91 129.65 40.09 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 177.382 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.77 133.31 15.28 Favored Glycine 0 C--O 1.226 -0.344 0 N-CA-C 109.139 -1.585 . . . . 0.0 109.139 -179.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.8 t -84.44 115.66 26.85 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 117.83 0.815 . . . . 0.0 108.999 179.892 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 73.9 mt -90.19 -44.54 14.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 106.668 -1.604 . . . . 0.0 106.668 178.237 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -149.86 132.43 15.78 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 177.514 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.26 132.47 28.14 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 106.012 -1.847 . . . . 0.0 106.012 172.395 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -168.96 -59.99 0.03 OUTLIER Glycine 0 C--N 1.322 -0.224 0 C-N-CA 119.744 -1.217 . . . . 0.0 115.317 176.975 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -132.2 163.81 27.73 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 -176.609 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.0 m -65.81 -8.11 19.82 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 178.965 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -65.47 -49.24 69.83 Favored 'General case' 0 C--O 1.215 -0.724 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 176.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -151.05 124.91 9.15 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 175.181 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 52.8 mt -124.65 120.61 59.32 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 169.131 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -107.28 121.79 45.26 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 -178.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -120.47 128.94 53.61 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.1 -179.001 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -84.67 126.13 33.1 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.24 178.443 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.56 135.32 95.71 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 -178.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.82 -24.85 20.82 Favored 'Trans proline' 0 CA--C 1.535 0.56 0 C-N-CA 115.903 -2.265 . . . . 0.0 112.641 178.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -74.94 -29.6 60.99 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.073 0.549 . . . . 0.0 112.124 179.422 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 49.0 mttm 57.04 39.69 29.09 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 122.188 0.994 . . . . 0.0 112.641 178.701 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -64.24 -177.61 0.3 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 113.892 -1.504 . . . . 0.0 110.474 176.322 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.9 m -51.87 -34.02 39.11 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 175.306 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -90.63 112.12 23.72 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 103.495 -2.78 . . . . 0.0 103.495 170.069 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -105.49 -35.14 7.57 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.523 -0.762 . . . . 0.0 112.12 -175.057 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 13.4 mt -127.43 154.99 44.38 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 122.046 -0.409 . . . . 0.0 111.81 -175.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 2.7 p -131.79 137.57 54.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 175.406 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -118.48 114.19 22.48 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 107.022 -1.473 . . . . 0.0 107.022 175.404 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 7.1 tp -79.37 132.71 36.5 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 179.297 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.0 t80 -136.46 150.52 48.76 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.727 0.64 . . . . 0.0 112.727 -174.745 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -125.76 110.5 13.8 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 177.441 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -151.74 150.32 30.06 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 178.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -114.09 134.79 54.64 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 104.903 -2.258 . . . . 0.0 104.903 177.601 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -121.25 134.35 55.18 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -175.312 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -84.21 -36.58 22.67 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.678 0.752 . . . . 0.0 110.912 176.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 41.1 m-85 -135.61 164.63 27.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.476 -176.619 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.413 ' HD2' HD11 ' A' ' 99' ' ' ILE . 19.4 ptt-85 -64.38 -22.75 67.06 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 113.014 0.746 . . . . 0.0 113.014 178.787 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -67.72 -33.15 74.33 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.668 -0.813 . . . . 0.0 110.007 -177.237 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -65.75 -41.32 92.27 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 175.794 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 56.9 ttm -62.22 -51.88 66.01 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.828 -179.407 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.9 m -60.87 -31.85 50.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 CA-C-N 118.813 0.733 . . . . 0.0 111.099 -178.133 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 18.7 mmm180 -68.6 -38.71 80.83 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.283 -178.02 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -65.77 -35.71 81.48 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.276 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 10.4 mm -67.27 -34.67 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.489 0 C-N-CA 120.201 -0.6 . . . . 0.0 110.864 179.427 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -68.25 -29.09 67.82 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 179.481 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -69.75 -42.82 73.37 Favored 'General case' 0 C--O 1.236 0.395 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 174.164 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -57.73 -39.7 77.91 Favored 'General case' 0 C--O 1.214 -0.807 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 179.411 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.27 -37.12 79.49 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.591 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -64.49 -44.96 89.33 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 177.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 mmt180 -60.96 -43.09 99.24 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.404 179.09 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 62.0 t -67.65 -31.25 51.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 122.038 -0.414 . . . . 0.0 110.399 -179.05 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -62.76 -33.55 75.39 Favored 'General case' 0 C--N 1.323 -0.557 0 O-C-N 121.513 -0.742 . . . . 0.0 109.476 175.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 12.2 mmt85 -72.4 -46.89 53.18 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 174.096 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.0 t -57.96 -47.29 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.912 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.91 -30.25 67.67 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.815 -0.553 . . . . 0.0 110.804 -179.237 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -73.58 -39.99 64.24 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 122.111 -0.368 . . . . 0.0 110.636 176.678 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -65.41 -48.6 72.26 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -177.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -97.13 5.7 49.78 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.351 0.596 . . . . 0.0 112.124 -178.764 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 68.55 -3.08 6.58 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 119.297 2.479 . . . . 0.0 119.297 173.331 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 15.4 mtp180 -64.24 132.87 51.56 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 119.144 1.472 . . . . 0.0 108.767 -178.807 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 -64.71 -24.34 67.54 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 113.254 0.835 . . . . 0.0 113.254 -175.977 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.9 ttt-85 -147.0 148.89 32.16 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 103.094 -2.928 . . . . 0.0 103.094 178.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 8.9 mmm -136.77 148.48 47.25 Favored 'General case' 0 CA--C 1.508 -0.659 0 O-C-N 123.47 0.481 . . . . 0.0 111.155 -176.968 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 110' ' ' SER . 85.7 tttt -126.61 133.94 50.91 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 171.865 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -126.84 133.76 50.67 Favored 'General case' 0 C--N 1.325 -0.491 0 C-N-CA 123.525 0.73 . . . . 0.0 109.039 -176.075 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 48.9 tp -94.66 126.26 39.84 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 107.495 -1.298 . . . . 0.0 107.495 175.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -116.5 108.7 16.33 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.206 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.1 t -105.83 114.87 46.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.237 -176.71 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -83.3 156.08 23.26 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 176.62 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 14.3 m-85 -128.18 111.48 13.48 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 105.096 -2.187 . . . . 0.0 105.096 172.145 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 4.9 m -130.11 158.72 38.89 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 123.576 0.547 . . . . 0.0 111.453 -173.543 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 39.9 m -67.06 -47.3 71.7 Favored 'General case' 0 CA--C 1.508 -0.661 0 CA-C-O 121.71 0.767 . . . . 0.0 109.051 -179.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -148.48 174.39 12.13 Favored 'General case' 0 N--CA 1.436 -1.148 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -179.012 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.55 145.32 29.73 Favored Pre-proline 0 C--N 1.313 -0.992 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.798 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -60.65 146.25 97.48 Favored 'Trans proline' 0 C--N 1.346 0.43 0 O-C-N 122.246 0.603 . . . . 0.0 112.759 176.714 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.9 m -81.8 -21.61 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.561 0 N-CA-C 115.252 1.575 . . . . 0.0 115.252 -174.487 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -86.68 83.3 7.62 Favored 'General case' 0 C--O 1.216 -0.667 0 O-C-N 121.986 -0.446 . . . . 0.0 110.906 -177.618 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 56.7 t0 14.81 78.9 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 116.996 2.221 . . . . 0.0 116.996 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -90.08 -13.63 35.45 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.326 -1.306 . . . . 0.0 109.995 177.752 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -65.49 -31.3 72.3 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 107.535 -1.284 . . . . 0.0 107.535 -179.133 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 40.5 tp10 -59.24 -34.76 72.6 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 173.835 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.413 HD11 ' HD2' ' A' ' 54' ' ' ARG . 3.0 mm -71.2 -40.09 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 N-CA-C 108.675 -0.861 . . . . 0.0 108.675 179.847 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -66.91 -22.2 65.97 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.091 0.472 . . . . 0.0 111.256 178.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -87.97 0.47 55.87 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -125.99 130.27 50.87 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.953 0.882 . . . . 0.0 113.064 -179.503 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.0 m -74.37 128.88 36.66 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 173.766 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -82.91 124.29 30.21 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 105.152 -2.166 . . . . 0.0 105.152 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -128.38 129.09 45.69 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.624 0.726 . . . . 0.0 109.537 178.959 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 42.8 tttm -143.1 122.74 13.29 Favored 'General case' 0 N--CA 1.475 0.801 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.5 179.868 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 64.09 -112.7 5.21 Favored Glycine 0 C--O 1.225 -0.418 0 N-CA-C 108.8 -1.72 . . . . 0.0 108.8 -178.813 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 9.7 t -122.87 22.67 9.62 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-O 121.722 0.772 . . . . 0.0 109.641 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 1.2 m -104.24 156.72 5.66 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.546 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 175.521 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.407 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 31.5 t -138.51 127.96 24.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 103.657 -2.72 . . . . 0.0 103.657 178.114 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 47.7 t -129.98 136.5 58.72 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.483 0 CA-C-O 122.296 1.046 . . . . 0.0 109.223 179.12 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -112.3 114.96 50.32 Favored Pre-proline 0 N--CA 1.429 -1.5 0 CA-C-N 113.328 -1.76 . . . . 0.0 109.939 -177.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -79.56 151.69 22.56 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 116.701 -1.733 . . . . 0.0 112.204 178.269 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -151.12 149.74 29.85 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 102.639 -3.097 . . . . 0.0 102.639 174.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 4.7 tt -149.43 122.29 1.48 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 118.431 0.559 . . . . 0.0 109.63 -176.732 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 58.7 t -95.32 110.36 23.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 177.704 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.63 136.23 37.44 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 106.38 -1.711 . . . . 0.0 106.38 178.778 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.43 -25.46 57.91 Favored Glycine 0 C--O 1.229 -0.211 0 CA-C-N 116.359 -0.382 . . . . 0.0 113.99 -177.396 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 41.7 p -58.0 -30.4 66.04 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 114.749 1.388 . . . . 0.0 114.749 -177.829 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.9 ptm -139.19 25.14 2.49 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.315 0.579 . . . . 0.0 110.292 -177.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 7.5 tt -44.41 -37.63 3.53 Favored 'General case' 0 C--O 1.212 -0.874 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -174.541 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 40.3 ptt180 -56.93 -49.36 75.87 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.845 0.748 . . . . 0.0 111.772 -178.976 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -78.66 -39.24 37.44 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 122.362 1.077 . . . . 0.0 111.141 178.735 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.6 t0 -63.35 -38.14 90.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 114.872 -1.058 . . . . 0.0 112.776 -175.268 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.662 HD11 HD11 ' A' ' 11' ' ' ILE . 1.9 tm? -66.59 -48.36 69.81 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 122.006 -0.434 . . . . 0.0 110.18 -178.628 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -69.35 -17.04 63.66 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.961 -176.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -71.49 -26.87 62.87 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.695 -0.23 . . . . 0.0 110.929 178.723 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 5.8 p -109.06 -37.32 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 CA-C-O 120.794 0.33 . . . . 0.0 111.137 179.352 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -129.38 80.5 72.04 Favored Pre-proline 0 C--N 1.326 -0.449 0 O-C-N 121.954 -0.466 . . . . 0.0 111.247 178.963 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_endo -71.29 0.29 6.98 Favored 'Trans proline' 0 CA--C 1.537 0.634 0 N-CA-C 114.294 0.844 . . . . 0.0 114.294 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 42.8 p -82.4 -2.63 53.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.166 0.508 . . . . 0.0 110.942 177.622 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -70.5 120.57 16.33 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.442 0.639 . . . . 0.0 111.114 -179.993 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.9 ttt85 -84.09 102.79 12.8 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 178.352 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 30.5 p -62.28 -23.2 66.58 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.162 0.506 . . . . 0.0 111.875 -179.898 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -65.27 -28.56 69.42 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.005 0.431 . . . . 0.0 111.491 177.74 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -81.52 -1.76 47.35 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.511 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.3 t -132.84 51.42 2.16 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.5 -175.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 87.7 p -68.29 162.73 24.5 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 107.832 -1.173 . . . . 0.0 107.832 177.528 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 58.4 mt-10 -61.58 -26.1 67.75 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.396 0.517 . . . . 0.0 112.396 -176.694 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -63.71 -30.21 71.34 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.708 0.766 . . . . 0.0 110.619 177.771 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 79.7 m80 -95.07 -2.67 49.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.334 -177.338 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -83.31 32.19 0.45 Allowed 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.928 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 46.7 t -82.8 151.21 26.2 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 121.74 -0.6 . . . . 0.0 109.859 177.714 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -65.83 -31.19 72.01 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 179.792 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -68.84 -26.46 65.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.432 0.634 . . . . 0.0 110.901 -178.11 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -68.89 -23.28 64.18 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.974 -179.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.47 -43.74 71.96 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 113.373 0.879 . . . . 0.0 113.373 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 16.1 pt20 -72.12 -31.33 65.92 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 120.348 -0.541 . . . . 0.0 109.698 -179.395 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 76.6 mtp -70.51 -28.93 65.34 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.981 -0.377 . . . . 0.0 109.981 178.733 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.22 -31.01 72.05 Favored 'General case' 0 C--N 1.326 -0.425 0 O-C-N 121.872 -0.517 . . . . 0.0 110.241 177.556 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 69.8 ttt180 -67.07 -44.67 79.52 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -65.06 -40.24 94.41 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-O 121.763 0.792 . . . . 0.0 109.57 -178.98 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 59.1 ttt85 -58.85 -44.62 91.05 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.072 -0.967 . . . . 0.0 109.195 177.295 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -68.35 -43.33 77.7 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 178.994 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 72.3 mt -63.28 -34.88 78.63 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.865 0.364 . . . . 0.0 110.042 -179.367 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 26.2 m -72.72 -38.57 67.43 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.516 0.674 . . . . 0.0 110.166 175.526 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 4.6 tt -64.75 -39.11 93.07 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 114.337 1.236 . . . . 0.0 114.337 -177.121 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 7.3 p -59.88 -42.93 90.84 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 CA-C-N 119.056 0.843 . . . . 0.0 111.561 -177.607 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -72.87 -31.41 64.71 Favored 'General case' 0 C--O 1.217 -0.62 0 O-C-N 121.372 -0.83 . . . . 0.0 108.861 178.323 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 2.0 tttp -64.3 -36.14 83.14 Favored 'General case' 0 C--N 1.322 -0.613 0 O-C-N 121.19 -0.944 . . . . 0.0 110.345 176.526 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 -67.56 -35.02 78.23 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 177.509 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 15.1 tp10 -68.34 -36.94 80.01 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.53 0.681 . . . . 0.0 109.226 178.173 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 17.3 tp10 -66.48 -37.46 85.15 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 176.458 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -61.61 -46.89 87.89 Favored 'General case' 0 C--O 1.211 -0.926 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.53 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 21.7 mtp85 -56.51 -34.85 67.39 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -179.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -67.07 -51.97 47.95 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.092 -0.38 . . . . 0.0 110.911 177.22 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 14.7 t -72.3 -19.58 61.65 Favored 'General case' 0 N--CA 1.474 0.74 0 N-CA-C 113.971 1.1 . . . . 0.0 113.971 -179.478 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -60.61 -24.36 65.44 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.591 0.757 . . . . 0.0 112.25 179.386 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -62.52 -14.22 39.48 Favored 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 176.72 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.92 146.61 43.84 Favored 'General case' 0 C--O 1.223 -0.323 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 176.702 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 23.4 t -73.55 96.79 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 -178.809 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.18 179.99 7.64 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.43 -177.804 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 17.6 pt20 -150.89 160.42 43.91 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 178.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -156.96 142.99 17.92 Favored 'General case' 0 C--O 1.222 -0.378 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 178.283 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -159.92 27.96 0.35 Allowed Glycine 0 C--O 1.228 -0.262 0 N-CA-C 110.09 -1.204 . . . . 0.0 110.09 177.518 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 55.1 tttp -82.4 86.83 6.66 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.096 0.474 . . . . 0.0 111.818 -175.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 56.5 tp -67.83 -40.87 83.71 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.417 179.125 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 54.07 33.83 18.58 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 179.301 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 26.2 tpt180 -138.13 104.57 5.26 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 175.913 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 53.4 mt-10 -140.92 -171.75 3.32 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -177.338 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 36.0 t30 56.6 37.37 28.76 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 177.616 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -88.29 166.09 14.55 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 106.385 -1.709 . . . . 0.0 106.385 175.072 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -149.53 164.45 35.03 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.672 -0.492 . . . . 0.0 109.672 -175.468 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 26.3 p90 -159.31 166.45 31.19 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 103.715 -2.698 . . . . 0.0 103.715 177.687 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 . . . . . 0 C--O 1.243 0.742 0 N-CA-C 104.649 -2.352 . . . . 0.0 104.649 179.405 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.2 mtp . . . . . 0 N--CA 1.484 1.244 0 CA-C-O 119.9 -0.095 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -69.14 138.63 54.35 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -56.98 -32.07 65.7 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-O 120.888 0.375 . . . . 0.0 110.414 -179.937 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 78.0 mt -53.74 -35.23 60.99 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 179.091 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.466 ' HB2' ' HB1' ' A' ' 147' ' ' ALA . 40.0 mt-10 -61.34 -28.89 69.55 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 120.662 0.268 . . . . 0.0 110.734 -178.215 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -60.31 -55.1 37.81 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 -179.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.71 -41.34 68.69 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.921 -179.484 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -56.23 -55.76 29.24 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -177.833 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -69.83 -30.85 68.45 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -176.747 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 2.4 ptpt -75.43 -25.76 57.76 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 119.183 -1.007 . . . . 0.0 112.038 178.158 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 12.9 mm -73.13 -39.13 56.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 107.29 -1.374 . . . . 0.0 107.29 174.686 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.94 -42.64 85.3 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 177.043 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.98 -48.68 80.68 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.472 177.45 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 75.8 t60 -57.09 -43.88 82.65 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.582 -179.407 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -65.2 -44.71 87.52 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.835 0.35 . . . . 0.0 110.133 179.177 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 48.8 t -61.91 -40.06 85.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.711 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.455 HD21 HD21 ' A' ' 157' ' ' LEU . 14.3 m120 -66.06 -29.17 69.46 Favored 'General case' 0 N--CA 1.47 0.552 0 O-C-N 121.636 -0.665 . . . . 0.0 110.346 179.492 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.3 t -76.07 3.71 9.91 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.637 0.375 . . . . 0.0 111.574 178.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.28 -0.15 59.96 Favored Glycine 0 C--O 1.228 -0.243 0 N-CA-C 115.138 0.815 . . . . 0.0 115.138 176.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -67.22 125.77 27.11 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.044 0.922 . . . . 0.0 109.131 179.231 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.53 124.46 8.11 Favored Glycine 0 N--CA 1.447 -0.623 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.519 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 7.4 p -75.8 124.52 34.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 107.077 -1.453 . . . . 0.0 107.077 179.098 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 72.8 mt -90.06 -41.52 13.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.604 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 -177.447 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -147.82 123.34 10.41 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.542 -177.475 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.18 139.84 35.79 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 106.512 -1.662 . . . . 0.0 106.512 174.198 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 146.09 -31.4 1.58 Allowed Glycine 0 CA--C 1.505 -0.554 0 N-CA-C 107.408 -2.277 . . . . 0.0 107.408 179.135 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -65.72 154.5 38.78 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 175.094 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.4 p -88.76 -19.22 26.31 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.641 0.978 . . . . 0.0 113.641 -177.761 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -133.41 4.52 3.69 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 115.398 1.629 . . . . 0.0 115.398 -172.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -142.12 138.36 31.58 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 117.937 0.335 . . . . 0.0 110.567 178.687 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 33.8 mt -140.12 132.7 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 176.624 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 m95 -109.03 135.33 50.37 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.772 0.32 . . . . 0.0 110.424 178.602 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -129.43 137.21 50.76 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 124.067 0.947 . . . . 0.0 109.19 -176.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 76.3 tt0 -101.24 137.3 39.77 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 176.911 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -84.05 106.42 7.91 Favored Pre-proline 0 CA--C 1.546 0.821 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 176.836 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.45 -28.57 26.57 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 117.049 -1.501 . . . . 0.0 114.646 -176.362 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -78.01 -1.81 34.02 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -178.579 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.7 mtmt 58.28 43.31 20.38 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 -176.636 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 20.1 m -64.56 -177.63 0.33 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 113.328 -1.76 . . . . 0.0 113.098 -178.651 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.4 m -41.43 -26.98 0.07 Allowed 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 178.178 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 51.2 m-70 -130.17 135.69 48.45 Favored 'General case' 0 C--N 1.328 -0.338 0 N-CA-C 105.958 -1.867 . . . . 0.0 105.958 172.827 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -70.41 -37.7 74.49 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 121.412 0.625 . . . . 0.0 110.858 -178.64 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.9 mt -137.68 157.37 46.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.003 -177.607 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 60.2 t -133.44 137.18 53.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 176.682 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.03 135.95 49.64 Favored 'General case' 0 CA--C 1.514 -0.424 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 173.118 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -102.1 132.88 47.71 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 104.799 -2.297 . . . . 0.0 104.799 179.338 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -136.35 115.78 12.73 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 113.394 0.887 . . . . 0.0 113.394 -179.187 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.8 ttpt -86.8 96.37 10.17 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.881 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -147.34 128.79 14.94 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.663 0.744 . . . . 0.0 111.67 -176.606 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -77.13 147.25 36.68 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 125.081 1.352 . . . . 0.0 108.769 175.263 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 47.6 mt -143.8 118.2 9.66 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.982 -0.377 . . . . 0.0 109.982 -177.282 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -87.43 -43.73 11.86 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 122.077 0.942 . . . . 0.0 111.467 -179.58 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 37.6 m-85 -127.34 148.76 50.25 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -179.04 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.574 ' HD2' HD11 ' A' ' 99' ' ' ILE . 38.2 ptt180 -65.05 -16.0 62.97 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -178.307 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -63.05 -33.55 75.67 Favored 'General case' 0 C--O 1.216 -0.68 0 C-N-CA 119.702 -0.799 . . . . 0.0 109.675 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.5 mm-40 -77.57 -31.86 53.41 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 121.602 -0.687 . . . . 0.0 109.883 176.335 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 19.8 ttt -62.44 -51.84 65.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.372 178.008 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 28.8 m -61.07 -36.3 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.829 0 CA-C-O 120.718 0.294 . . . . 0.0 111.59 179.849 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -62.5 -38.44 89.89 Favored 'General case' 0 CA--C 1.506 -0.728 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.169 -177.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -59.47 -45.18 92.37 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.212 179.764 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.443 HG23 HG11 ' A' ' 111' ' ' VAL . 2.6 mp -73.16 -34.21 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.753 -0.592 . . . . 0.0 111.534 -178.318 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -59.23 -35.8 74.3 Favored 'General case' 0 C--O 1.244 0.803 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 177.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.51 -45.64 29.99 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.657 178.825 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -55.2 -41.51 72.07 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.285 179.346 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -63.2 -32.5 73.91 Favored 'General case' 0 N--CA 1.443 -0.819 0 O-C-N 122.201 -0.312 . . . . 0.0 111.705 -178.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -73.16 -36.09 66.57 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 176.742 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.32 -44.76 95.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 175.852 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 60.2 t -68.61 -36.04 72.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 116.703 -0.226 . . . . 0.0 110.785 179.475 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -60.42 -40.18 90.08 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 121.321 -0.862 . . . . 0.0 109.68 176.994 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 67.3 mtm180 -67.64 -33.64 75.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.486 178.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.2 t -73.87 -47.97 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 O-C-N 122.299 -0.251 . . . . 0.0 111.431 177.678 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -62.22 -30.36 71.03 Favored 'General case' 0 N--CA 1.473 0.719 0 O-C-N 121.618 -0.677 . . . . 0.0 111.781 -177.912 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -59.46 -45.62 91.11 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.247 -0.649 . . . . 0.0 109.247 178.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -73.3 -42.39 62.46 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 179.563 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 8.3 mp -78.35 -18.08 55.63 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 -175.256 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 69.34 9.25 60.68 Favored Glycine 0 CA--C 1.522 0.476 0 N-CA-C 116.751 1.46 . . . . 0.0 116.751 177.176 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 90.0 mtt180 -69.99 141.68 52.92 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 118.202 1.001 . . . . 0.0 109.03 -178.877 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 57.8 ttt85 -62.19 -34.73 77.0 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.604 0.594 . . . . 0.0 112.604 -174.874 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -144.37 161.86 37.92 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 101.837 -3.394 . . . . 0.0 101.837 176.545 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.3 mmm -135.69 112.54 10.22 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 123.552 0.533 . . . . 0.0 109.799 179.458 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 25.2 mttt -93.72 132.25 38.26 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.509 -0.477 . . . . 0.0 109.855 177.484 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -128.06 121.83 30.63 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.943 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 66.6 tp -89.52 121.61 31.9 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 106.601 -1.629 . . . . 0.0 106.601 175.469 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -112.04 113.29 25.49 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 17.0 t -112.76 106.27 20.42 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 CA-C-O 121.253 0.549 . . . . 0.0 111.301 -178.724 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -74.6 152.06 39.3 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 175.597 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 20.4 m-85 -128.48 109.01 11.01 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 106.436 -1.69 . . . . 0.0 106.436 172.623 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 89.2 p -131.88 164.96 24.94 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.196 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 10.8 t -77.48 -29.01 52.42 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 121.674 -0.641 . . . . 0.0 109.55 179.776 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -152.59 165.52 34.93 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.61 -1.255 . . . . 0.0 107.61 179.714 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -93.95 154.61 40.74 Favored Pre-proline 0 C--N 1.324 -0.524 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 -177.534 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -57.03 145.31 86.44 Favored 'Trans proline' 0 C--N 1.351 0.66 0 N-CA-C 114.829 1.05 . . . . 0.0 114.829 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 35.3 m -77.62 -21.37 13.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.223 0.535 . . . . 0.0 111.331 -179.693 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -90.85 99.12 12.21 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-N 116.069 -0.514 . . . . 0.0 109.972 179.571 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.0 t0 14.72 58.8 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 118.975 2.954 . . . . 0.0 118.975 176.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 39.8 p-90 -68.34 -18.72 64.56 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 121.446 0.641 . . . . 0.0 110.486 179.044 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -62.74 -36.36 82.79 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.884 -177.467 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -37.67 74.11 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.614 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.574 HD11 ' HD2' ' A' ' 54' ' ' ARG . 5.3 mm -66.55 -39.99 85.27 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.604 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.267 -178.205 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.15 -23.92 65.84 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.514 0.674 . . . . 0.0 110.987 179.823 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 30.6 mtmt -94.9 6.16 49.83 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.773 179.295 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 36.8 ttpt -118.94 95.94 5.03 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.802 0.667 . . . . 0.0 112.802 -176.833 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 85.7 m -68.34 124.97 24.97 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.515 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -85.72 107.44 17.59 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.944 0.878 . . . . 0.0 109.83 -178.501 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -99.53 123.53 43.88 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.824 -1.08 . . . . 0.0 108.662 -178.578 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 15.8 tptm -130.17 75.4 1.65 Allowed 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -178.775 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 75.38 -112.68 3.7 Favored Glycine 0 C--O 1.223 -0.574 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -178.334 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 61.7 p -83.04 -20.82 34.27 Favored 'General case' 0 C--N 1.322 -0.59 0 O-C-N 122.217 -0.578 . . . . 0.0 110.367 179.741 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 53.1 t -74.92 140.62 17.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 N-CA-C 112.337 0.495 . . . . 0.0 112.337 -178.101 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 44.9 m -130.79 112.85 13.42 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 106.679 -1.6 . . . . 0.0 106.679 171.081 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.443 HG11 HG23 ' A' ' 61' ' ' ILE . 54.1 t -106.29 129.65 59.26 Favored 'Isoleucine or valine' 0 CA--C 1.486 -1.504 0 O-C-N 121.527 -0.733 . . . . 0.0 110.222 178.866 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.64 104.0 22.01 Favored Pre-proline 0 N--CA 1.435 -1.22 0 CA-C-N 113.995 -1.457 . . . . 0.0 108.039 178.458 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -78.24 142.91 19.48 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 116.721 -1.719 . . . . 0.0 112.13 179.442 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -148.33 153.28 38.42 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 105.081 -2.192 . . . . 0.0 105.081 178.05 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 6.6 tt -146.86 123.57 3.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.646 0 CA-C-O 121.143 0.497 . . . . 0.0 109.766 -177.334 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 1.9 t -89.87 126.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.758 0 N-CA-C 104.098 -2.556 . . . . 0.0 104.098 174.592 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.61 136.27 54.45 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 105.602 -1.999 . . . . 0.0 105.602 175.907 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.82 -22.44 66.38 Favored Glycine 0 C--O 1.227 -0.298 0 C-N-CA 121.178 -0.534 . . . . 0.0 113.899 -176.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 43.7 p -57.35 -26.74 61.44 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 -177.253 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.5 ptm -141.16 30.58 1.78 Allowed 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.976 -0.75 . . . . 0.0 108.976 -178.546 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -44.37 -42.45 6.88 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 116.417 2.006 . . . . 0.0 116.417 -171.612 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 3.4 ptp180 -58.56 -51.33 70.34 Favored 'General case' 0 N--CA 1.469 0.496 0 O-C-N 121.685 -0.634 . . . . 0.0 112.395 -178.366 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -75.22 -33.06 61.33 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 121.582 0.706 . . . . 0.0 111.334 -179.175 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -72.08 -42.02 66.67 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 114.003 1.112 . . . . 0.0 114.003 -175.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 20.8 tp -64.27 -41.81 96.75 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 121.717 -0.615 . . . . 0.0 111.272 -176.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -75.63 -13.31 60.33 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.648 -178.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.68 -33.03 58.27 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.317 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 43.0 t -91.64 -40.35 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 121.33 0.586 . . . . 0.0 110.234 179.096 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 57.9 m-85 -123.02 77.21 50.86 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.602 -179.398 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -68.25 -13.86 38.94 Favored 'Trans proline' 0 C--N 1.348 0.543 0 N-CA-C 114.127 0.78 . . . . 0.0 114.127 -177.841 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.5 m -77.83 -7.22 56.35 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.719 0.295 . . . . 0.0 111.57 177.308 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 61.7 t80 -99.4 132.98 44.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.236 0.541 . . . . 0.0 110.674 -178.736 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 47.1 mtm105 -84.41 105.76 15.48 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 179.824 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 16.8 p -68.66 -26.69 65.45 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -177.744 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -73.07 -24.43 60.67 Favored 'General case' 0 N--CA 1.468 0.427 0 O-C-N 122.104 -0.373 . . . . 0.0 111.349 178.743 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -67.49 -30.47 70.16 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 122.083 0.944 . . . . 0.0 111.399 179.09 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 73.8 m -139.57 50.91 1.76 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.652 -174.189 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 23.1 m -64.6 159.94 20.78 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.098 0.475 . . . . 0.0 112.04 -178.746 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -61.49 -35.74 78.53 Favored 'General case' 0 C--O 1.218 -0.587 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.955 -176.193 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -65.92 -11.81 50.03 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 113.137 0.792 . . . . 0.0 113.137 178.735 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -97.88 -4.82 35.82 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 121.711 0.767 . . . . 0.0 110.537 177.472 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -81.13 167.34 19.8 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 121.645 0.736 . . . . 0.0 110.79 -178.741 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 13.4 t -160.06 155.65 25.62 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 106.172 -1.788 . . . . 0.0 106.172 178.286 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -58.81 -37.25 75.94 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.783 0.801 . . . . 0.0 109.509 179.0 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 52.0 mt-10 -72.54 -47.12 50.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.098 179.663 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 -60.67 -32.51 71.71 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.524 0.678 . . . . 0.0 109.417 -178.489 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.466 ' HB1' ' HB2' ' A' ' 5' ' ' GLU . . . -63.29 -44.93 93.64 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 179.192 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 -76.76 -31.33 56.99 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 120.252 -0.579 . . . . 0.0 110.465 -179.42 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 25.3 mmt -65.3 -28.78 69.55 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 176.142 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -60.73 -30.89 70.26 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 119.53 -0.271 . . . . 0.0 111.298 178.401 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -65.52 -51.28 61.07 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.433 -0.507 . . . . 0.0 110.48 177.694 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -61.11 -42.12 97.93 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.163 0.982 . . . . 0.0 108.6 -178.211 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 21.5 ttp180 -58.9 -40.15 83.64 Favored 'General case' 0 C--O 1.213 -0.848 0 CA-C-N 114.579 -1.192 . . . . 0.0 110.995 178.839 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 42.0 t80 -64.91 -43.19 93.64 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 118.317 0.508 . . . . 0.0 112.063 177.152 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.7 -41.31 98.13 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.346 -179.496 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 46.6 t -65.86 -38.82 89.84 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.184 0.516 . . . . 0.0 110.466 177.423 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.455 HD21 HD21 ' A' ' 17' ' ' ASN . 2.5 tm? -61.31 -45.92 92.45 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 123.103 0.561 . . . . 0.0 110.908 179.749 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 56.0 t -56.79 -50.12 76.02 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.559 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 -178.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -65.07 -39.37 93.14 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.965 0.412 . . . . 0.0 110.497 -178.662 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -64.75 -33.93 77.14 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.667 -0.646 . . . . 0.0 112.502 179.927 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -59.99 -23.81 63.94 Favored 'General case' 0 C--O 1.21 -1.005 0 C-N-CA 120.26 -0.576 . . . . 0.0 111.605 179.478 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -63.76 -39.48 94.37 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 178.581 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -69.62 -44.73 70.07 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 177.402 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 20.3 mm100 -66.79 -53.17 35.63 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -176.1 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 31.3 ptt85 -67.45 -27.35 66.96 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -174.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 17.6 ttpp -63.18 -45.8 90.1 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 175.805 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 14.7 m -72.36 -45.43 59.87 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.561 -0.745 . . . . 0.0 112.363 -178.679 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -66.37 -24.47 66.5 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 113.762 1.023 . . . . 0.0 113.762 -176.653 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -75.69 -14.06 60.33 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 178.167 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -73.47 145.14 45.91 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 105.346 -2.094 . . . . 0.0 105.346 174.177 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 13.2 m 32.66 64.96 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.97 1 N-CA-C 121.949 4.055 . . . . 0.0 121.949 170.567 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 49.3 p90 -114.4 14.81 17.98 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 121.086 -1.009 . . . . 0.0 112.236 -178.744 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 87.0 mm-40 62.24 -136.86 0.48 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.911 -175.748 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 13.6 p-10 -152.99 151.75 30.64 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 178.9 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 157.84 128.8 1.05 Allowed Glycine 0 C--O 1.226 -0.354 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 177.864 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -159.48 151.56 20.8 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 107.589 -1.263 . . . . 0.0 107.589 179.206 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 2.1 pp -154.79 163.29 40.48 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 105.006 -2.22 . . . . 0.0 105.006 176.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 68.7 tt0 -147.62 164.53 33.2 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 104.106 -2.553 . . . . 0.0 104.106 177.677 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.32 135.65 35.63 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 118.025 0.375 . . . . 0.0 110.011 -177.305 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 19.7 pt-20 -146.02 173.36 12.23 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 105.633 -1.988 . . . . 0.0 105.633 175.505 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -150.76 145.35 25.69 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 105.665 -1.976 . . . . 0.0 105.665 173.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 2.2 tt -146.59 150.86 36.31 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 -177.736 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 40.0 p90 -154.31 171.99 18.39 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 104.945 -2.243 . . . . 0.0 104.945 -179.672 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -151.64 156.45 40.43 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 104.965 -2.235 . . . . 0.0 104.965 179.402 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 11.0 mm100 . . . . . 0 C--O 1.244 0.763 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -177.958 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.5 mmt . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 118.75 -0.643 . . . . 0.0 110.005 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 94.1 m-85 54.69 34.26 21.21 Favored 'General case' 0 N--CA 1.48 1.025 0 O-C-N 123.82 0.7 . . . . 0.0 111.242 -178.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.3 pp -61.87 -32.21 72.55 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.577 0.703 . . . . 0.0 111.1 -177.106 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -73.78 -35.2 64.93 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.679 -0.692 . . . . 0.0 112.306 -179.91 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -65.78 -29.33 69.81 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.364 0.602 . . . . 0.0 110.272 -176.924 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -62.23 -45.16 94.6 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 176.196 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.3 m -70.54 -40.31 73.5 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.302 178.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -55.35 -51.15 67.72 Favored 'General case' 0 C--N 1.321 -0.666 0 C-N-CA 124.018 0.927 . . . . 0.0 111.082 179.602 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -71.1 -30.11 66.12 Favored 'General case' 0 C--N 1.328 -0.362 0 O-C-N 121.664 -0.647 . . . . 0.0 111.769 178.659 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 55.6 mttt -66.71 -37.56 84.95 Favored 'General case' 0 N--CA 1.467 0.382 0 O-C-N 121.855 -0.528 . . . . 0.0 110.955 176.665 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.4 mm -71.19 -39.35 73.27 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 178.009 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.32 -44.58 80.1 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 177.535 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.51 -47.24 79.61 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.56 178.018 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 34.8 t60 -55.46 -45.56 76.89 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 122.683 0.393 . . . . 0.0 111.415 -178.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.7 mt -70.44 -47.89 58.57 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.588 -178.839 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 54.5 t -56.85 -40.29 70.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 CA-C-N 118.422 0.556 . . . . 0.0 109.983 175.639 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -64.17 -27.22 68.93 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.147 -0.346 . . . . 0.0 111.511 179.151 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 32.7 m -86.62 10.25 16.14 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 123.01 0.524 . . . . 0.0 111.345 177.971 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.85 0.28 58.98 Favored Glycine 0 C--O 1.229 -0.159 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 175.602 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.408 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 26.0 m-85 -67.81 129.25 39.34 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 118.311 1.056 . . . . 0.0 109.748 178.611 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -81.17 109.41 2.98 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 108.215 -1.954 . . . . 0.0 108.215 179.318 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 11.8 p -70.32 129.15 34.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.192 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 85.9 mt -94.89 -47.11 13.33 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-N 114.773 -1.103 . . . . 0.0 108.358 -177.321 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 57.6 tp60 -142.36 139.95 31.92 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 105.662 -1.977 . . . . 0.0 105.662 -177.226 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -137.52 124.4 21.3 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 118.111 0.414 . . . . 0.0 110.262 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.49 40.11 94.22 Favored Glycine 0 C--O 1.221 -0.707 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 178.217 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -59.49 -35.72 74.66 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 122.356 1.074 . . . . 0.0 109.213 -178.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.8 t -166.84 -67.68 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 101.287 -3.597 . . . . 0.0 101.287 174.922 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -138.95 15.21 2.66 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.792 174.984 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.402 ' CD ' HH21 ' A' ' 45' ' ' ARG . 47.8 mt-10 -112.92 144.69 42.04 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -177.674 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 90.8 mt -135.36 127.78 47.34 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 105.612 -1.996 . . . . 0.0 105.612 172.71 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 82.9 m95 -110.84 133.11 53.63 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 -179.068 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.1 mp -131.72 129.69 41.01 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.213 0.605 . . . . 0.0 109.788 -178.383 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -81.43 132.76 35.34 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.491 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.85 117.77 60.82 Favored Pre-proline 0 CA--C 1.538 0.487 0 N-CA-C 107.123 -1.436 . . . . 0.0 107.123 177.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 79.2 Cg_endo -72.6 -26.12 16.85 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 115.892 -2.272 . . . . 0.0 112.807 -175.899 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -72.49 -26.5 61.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.701 -179.859 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.8 mttp 59.24 41.95 19.26 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 123.646 1.688 . . . . 0.0 108.113 -178.83 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 96.4 p -71.09 -177.61 1.73 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 111.042 -2.799 . . . . 0.0 108.39 176.85 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.2 p -45.85 -26.63 0.71 Allowed 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.413 0.894 . . . . 0.0 113.413 176.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 7.5 m-70 -101.51 127.19 48.31 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 106.339 -1.726 . . . . 0.0 106.339 174.367 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 37.1 m-20 -89.8 -37.7 14.31 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -178.523 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 63.9 mt -137.36 161.61 35.83 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 53.7 t -127.29 134.53 65.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 174.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.402 HH21 ' CD ' ' A' ' 30' ' ' GLU . 31.6 ttt180 -122.46 112.99 18.72 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.176 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.5 mp -88.79 131.12 35.2 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 104.38 -2.452 . . . . 0.0 104.38 175.069 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.6 t80 -136.36 114.67 11.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.217 0.532 . . . . 0.0 111.416 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.5 tttm -82.56 94.71 7.56 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 178.541 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 80.0 t60 -151.62 136.59 17.31 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 -174.644 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -96.26 146.11 24.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.498 -0.319 . . . . 0.0 110.234 -178.729 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -127.26 119.35 26.14 Favored 'General case' 0 C--O 1.22 -0.45 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 -177.236 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 53.3 t0 -79.12 -43.5 23.92 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-O 122.661 1.219 . . . . 0.0 109.845 178.316 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -127.83 164.67 21.71 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.185 -0.916 . . . . 0.0 108.87 -178.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 ptt180 -64.21 -15.82 60.75 Favored 'General case' 0 CA--C 1.509 -0.597 0 C-N-CA 120.741 -0.384 . . . . 0.0 110.579 175.476 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 -62.4 -41.37 98.62 Favored 'General case' 0 C--O 1.215 -0.761 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 179.6 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -66.59 -39.37 88.39 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.8 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 49.7 ttm -63.11 -51.85 64.93 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.396 -178.878 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.87 -31.85 53.93 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 CA-C-N 118.641 0.655 . . . . 0.0 112.585 -179.219 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.1 mmt180 -68.51 -35.03 76.92 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 121.018 -0.273 . . . . 0.0 110.667 -178.138 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.72 -41.73 91.5 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 178.297 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 2.6 mm -67.12 -30.88 50.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 N-CA-C 112.463 0.542 . . . . 0.0 112.463 -178.077 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -58.45 -40.06 81.58 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.611 -0.436 . . . . 0.0 110.097 179.529 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -76.63 -43.91 36.37 Favored 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.423 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 67.0 mt-30 -56.45 -36.52 69.13 Favored 'General case' 0 C--O 1.212 -0.898 0 C-N-CA 120.625 -0.43 . . . . 0.0 111.934 -178.536 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.478 ' HA ' HG11 ' A' ' 109' ' ' VAL . . . -64.17 -40.43 96.1 Favored 'General case' 0 N--CA 1.442 -0.862 0 O-C-N 121.938 -0.476 . . . . 0.0 111.102 179.463 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 55.8 mt-10 -76.02 -29.68 58.21 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 121.313 -0.867 . . . . 0.0 109.638 178.385 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.1 tpt180 -60.7 -41.48 95.26 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 173.62 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.456 HG11 HG13 ' A' ' 109' ' ' VAL . 45.9 t -64.83 -39.67 86.46 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.475 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.05 177.275 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -54.56 -37.95 66.06 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 118.779 0.718 . . . . 0.0 111.69 -179.557 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 7.9 mpt_? -61.68 -48.08 82.44 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.996 179.579 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 45.3 t -70.63 -41.41 77.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-O 121.564 0.697 . . . . 0.0 110.943 -178.026 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -41.67 93.54 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 121.971 -0.456 . . . . 0.0 109.942 179.719 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -64.59 -45.82 85.33 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 178.106 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -58.64 -42.28 87.94 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.433 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 11.0 mp -83.75 -3.69 58.02 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 112.022 0.379 . . . . 0.0 112.022 -179.489 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 65.68 20.1 67.83 Favored Glycine 0 C--O 1.242 0.615 0 C-N-CA 121.508 -0.377 . . . . 0.0 113.654 179.656 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 75.6 mtp85 -73.04 147.84 44.69 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.825 -0.809 . . . . 0.0 110.944 -176.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.2 mpt_? -69.45 -37.52 77.37 Favored 'General case' 0 C--O 1.215 -0.715 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.47 159.62 39.94 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 105.014 -2.217 . . . . 0.0 105.014 171.569 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 2.9 ttp -134.15 147.19 50.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -178.745 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 110' ' ' SER . 83.6 tttt -116.0 136.67 52.81 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.81 0.67 . . . . 0.0 112.81 179.482 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 60.4 tp -119.81 134.0 55.39 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 123.056 0.543 . . . . 0.0 110.699 178.448 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.78 109.85 22.44 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 173.066 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -97.71 127.34 43.59 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.053 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 25.9 t -122.08 109.31 24.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.177 0.513 . . . . 0.0 110.937 179.055 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -81.24 151.83 27.94 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 176.489 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 50.3 m-85 -127.29 107.63 10.16 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 103.61 -2.737 . . . . 0.0 103.61 171.658 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 13.3 m -127.17 158.65 36.53 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 123.683 0.614 . . . . 0.0 110.896 -174.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 22.5 m -67.06 -45.21 78.07 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 -177.434 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -146.81 176.74 9.65 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 -178.711 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.19 143.39 29.6 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.395 -0.821 . . . . 0.0 108.874 -176.119 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -56.71 147.06 73.81 Favored 'Trans proline' 0 C--N 1.35 0.622 0 N-CA-C 114.93 1.088 . . . . 0.0 114.93 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 26.9 m -81.17 -10.23 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.506 0 N-CA-C 114.525 1.305 . . . . 0.0 114.525 -177.092 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -112.67 95.77 5.61 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 119.339 -0.362 . . . . 0.0 111.559 -178.378 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 47.9 t0 14.83 67.33 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 117.377 2.362 . . . . 0.0 117.377 176.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 56.6 p-90 -83.99 -13.99 51.9 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 115.064 -0.971 . . . . 0.0 111.195 179.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -66.65 -31.48 72.19 Favored 'General case' 0 C--N 1.319 -0.75 0 O-C-N 121.119 -0.988 . . . . 0.0 111.905 -175.21 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -65.31 -21.74 66.75 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 120.191 -0.603 . . . . 0.0 109.958 175.615 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.502 HG22 ' HG3' ' A' ' 113' ' ' PRO . 15.5 mm -72.7 -40.48 61.65 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -72.3 -5.03 33.27 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.983 179.22 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 14.2 mptt -111.35 3.14 18.02 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.797 -179.383 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 51.1 pttt -126.74 128.42 46.62 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-O 121.88 0.847 . . . . 0.0 112.142 179.068 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 26.5 m -78.46 126.79 31.26 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 176.819 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 40.9 t80 -82.64 111.44 18.61 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 106.181 -1.785 . . . . 0.0 106.181 177.016 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -118.17 120.99 39.39 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.461 0.648 . . . . 0.0 109.76 -178.392 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -116.69 75.31 0.96 Allowed 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 178.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 68.31 -112.7 4.85 Favored Glycine 0 C--O 1.225 -0.466 0 C-N-CA 120.561 -0.828 . . . . 0.0 111.774 179.583 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 4.0 p -81.96 24.64 0.62 Allowed 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 123.561 0.744 . . . . 0.0 112.173 -178.662 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.478 HG11 ' HA ' ' A' ' 65' ' ' ALA . 86.2 t -134.83 140.63 45.09 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.264 -178.957 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.404 ' O ' ' HA ' ' A' ' 81' ' ' LYS . 33.8 t -130.62 126.49 36.78 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 175.67 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 26.9 t -136.7 136.42 48.2 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 106.538 -1.652 . . . . 0.0 106.538 176.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -125.56 131.33 24.01 Favored Pre-proline 0 C--N 1.317 -0.841 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 175.865 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.502 ' HG3' HG22 ' A' ' 99' ' ' ILE . 47.9 Cg_endo -84.56 154.73 12.05 Favored 'Trans proline' 0 N--CA 1.461 -0.4 0 CA-C-O 122.101 0.792 . . . . 0.0 113.774 -177.61 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -143.78 150.73 39.0 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 102.152 -3.277 . . . . 0.0 102.152 174.438 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 3.7 tt -146.42 124.33 4.21 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.732 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 -176.774 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 52.1 t -97.44 115.95 38.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.641 0 N-CA-C 103.798 -2.667 . . . . 0.0 103.798 175.057 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -102.35 138.17 39.63 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 107.129 -1.434 . . . . 0.0 107.129 -179.061 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -56.86 -25.88 53.48 Favored Glycine 0 C--O 1.223 -0.591 0 N-CA-C 114.728 0.651 . . . . 0.0 114.728 -176.646 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 34.7 p -59.66 -27.2 66.17 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -177.545 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 17.8 ptm -143.07 18.42 1.94 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.925 0.869 . . . . 0.0 109.906 -177.831 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 2.1 tt -42.08 -42.41 2.91 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 118.418 2.747 . . . . 0.0 118.418 -170.613 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -60.79 -51.54 68.91 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 119.562 -0.855 . . . . 0.0 112.278 -174.078 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -78.54 -33.27 48.0 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 176.301 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 37.3 t0 -58.86 -32.15 69.18 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 122.432 1.111 . . . . 0.0 110.818 -178.829 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.63 -36.35 73.95 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.953 -1.021 . . . . 0.0 113.178 -179.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -75.33 -15.0 60.53 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -176.269 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -72.55 -28.56 62.91 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.163 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 22.7 t -95.56 -41.63 11.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 115.444 -0.798 . . . . 0.0 109.858 179.851 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -126.22 80.19 68.89 Favored Pre-proline 0 C--N 1.325 -0.46 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.33 -178.908 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -67.55 -14.53 42.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 118.08 -0.813 . . . . 0.0 112.774 179.752 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.2 m -75.72 -5.71 46.98 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.923 176.461 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -99.48 135.5 40.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.706 0.765 . . . . 0.0 110.575 -179.022 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 92.5 mtm-85 -69.3 119.78 14.1 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.344 179.963 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 36.7 p -70.36 -20.41 62.97 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 121.767 -0.583 . . . . 0.0 110.856 178.66 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -81.01 -10.77 59.66 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.705 0.288 . . . . 0.0 111.226 176.665 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -84.59 -24.62 29.1 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 177.079 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 14.1 t -87.98 125.46 34.54 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.798 -1.186 . . . . 0.0 107.798 178.743 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 1.7 t -144.32 132.32 21.55 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -176.635 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -68.2 -32.63 73.0 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.551 0.691 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -62.14 -17.26 57.31 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.536 -0.756 . . . . 0.0 111.634 -179.188 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -117.13 10.93 14.01 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.214 179.592 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -95.08 67.86 3.09 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.948 0.88 . . . . 0.0 110.574 -177.505 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 83.3 p -125.06 171.95 9.85 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.886 -178.569 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -66.72 -39.77 88.12 Favored 'General case' 0 C--O 1.218 -0.568 0 CA-C-O 120.959 0.409 . . . . 0.0 111.703 -177.654 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . 0.563 ' CD ' ' H ' ' A' ' 145' ' ' GLU . 2.0 mp0 -63.02 -39.93 96.23 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.85 0.833 . . . . 0.0 108.801 -179.597 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 21.8 m-80 -71.74 -35.1 70.03 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.41 -0.813 . . . . 0.0 110.655 178.566 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -65.89 -39.49 90.69 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.404 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -62.73 -51.08 68.55 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.576 -0.284 . . . . 0.0 110.632 178.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 21.5 ptp -65.33 -28.84 69.59 Favored 'General case' 0 C--O 1.215 -0.719 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.353 179.419 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.05 -37.37 85.68 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.456 -0.778 . . . . 0.0 110.034 177.378 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 44.5 ttt180 -65.64 -45.86 81.39 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.595 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -65.01 -40.31 94.72 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.843 0.83 . . . . 0.0 110.316 -178.821 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 31.3 ttm180 -64.71 -40.0 94.62 Favored 'General case' 0 C--O 1.21 -0.975 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.872 178.491 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -63.34 -41.22 98.85 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.83 0.348 . . . . 0.0 111.639 176.568 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 42.8 mt -65.17 -33.13 75.29 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.043 0.449 . . . . 0.0 109.823 179.23 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.3 m -75.05 -34.81 61.87 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.624 0.726 . . . . 0.0 110.571 175.086 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -65.06 -44.15 89.92 Favored 'General case' 0 C--O 1.218 -0.597 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.639 -178.624 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.7 p -62.16 -36.78 76.21 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.417 0 C-N-CA 119.634 -0.826 . . . . 0.0 110.014 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -65.24 -50.67 64.92 Favored 'General case' 0 C--O 1.207 -1.165 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 178.024 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -60.36 -30.13 69.35 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 119.864 -0.734 . . . . 0.0 112.489 -178.577 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -56.97 -28.57 62.42 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 112.17 0.433 . . . . 0.0 112.17 -179.615 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -66.95 -38.1 85.52 Favored 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 -179.165 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -69.46 -38.49 77.79 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 176.722 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 25.2 mm100 -59.58 -44.11 93.45 Favored 'General case' 0 C--O 1.212 -0.895 0 C-N-CA 120.588 -0.445 . . . . 0.0 109.804 177.695 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -68.95 -34.39 75.27 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 112.395 0.516 . . . . 0.0 112.395 -178.189 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -65.25 -37.32 86.88 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 176.296 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 22.9 m -72.3 -38.77 68.65 Favored 'General case' 0 CA--C 1.543 0.68 0 CA-C-O 121.269 0.557 . . . . 0.0 110.597 178.402 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -58.59 -25.41 62.58 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 124.708 1.203 . . . . 0.0 112.529 -179.276 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.34 -14.12 54.43 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.165 0.431 . . . . 0.0 112.165 178.105 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -123.22 -39.73 2.45 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 179.344 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 12.1 m -90.91 154.05 3.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-O 122.649 1.214 . . . . 0.0 114.099 -172.798 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 48.4 p90 -142.94 164.09 31.01 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 105.684 -1.969 . . . . 0.0 105.684 175.854 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -135.47 -16.13 1.84 Allowed 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 53.9 m-20 53.44 -137.12 1.26 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.127 0.571 . . . . 0.0 109.882 -178.387 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 86.76 179.34 49.09 Favored Glycine 0 C--O 1.229 -0.178 0 C-N-CA 121.205 -0.521 . . . . 0.0 112.152 179.408 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 55.0 tptt -156.55 136.75 12.85 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 -178.792 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 60.4 tp -153.0 141.67 20.96 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 105.526 -2.028 . . . . 0.0 105.526 176.513 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -161.04 168.34 24.65 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 178.61 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 1.2 ttm105 -154.0 152.89 31.05 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 179.101 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -139.19 145.99 40.0 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 103.517 -2.772 . . . . 0.0 103.517 175.974 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 52.8 t-20 -151.59 107.29 3.36 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 117.952 0.342 . . . . 0.0 111.693 -179.318 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 29.6 tp -133.72 144.51 49.16 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 177.368 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 12.1 p90 -151.34 161.85 41.97 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 106.551 -1.648 . . . . 0.0 106.551 -174.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -132.28 33.43 3.86 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -178.239 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 . . . . . 0 C--O 1.247 0.97 0 CA-C-N 113.903 -1.499 . . . . 0.0 109.254 -174.784 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.0 mtp . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 119.619 -0.229 . . . . 0.0 110.702 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -59.56 -37.53 78.71 Favored 'General case' 0 C--O 1.217 -0.639 0 N-CA-C 117.048 2.24 . . . . 0.0 117.048 -171.801 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.77 -45.41 86.47 Favored 'General case' 0 N--CA 1.469 0.523 0 O-C-N 121.212 -0.93 . . . . 0.0 108.797 179.441 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -65.25 -35.3 80.61 Favored 'General case' 0 C--O 1.208 -1.084 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.277 178.507 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -65.14 -42.21 94.03 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 110.215 -0.291 . . . . 0.0 110.215 178.575 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -60.69 -49.17 78.57 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 107.219 -1.4 . . . . 0.0 107.219 177.484 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.2 m -59.12 -43.69 91.97 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.613 -178.216 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -57.26 -52.31 65.84 Favored 'General case' 0 C--N 1.32 -0.696 0 C-N-CA 123.073 0.549 . . . . 0.0 110.363 179.906 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 95.9 m95 -69.3 -33.32 73.01 Favored 'General case' 0 C--N 1.324 -0.536 0 C-N-CA 120.338 -0.545 . . . . 0.0 111.979 -179.268 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.69 -31.48 69.55 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.683 -0.636 . . . . 0.0 111.018 178.803 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 18.8 mm -77.06 -39.2 28.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 178.18 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.88 -43.1 80.94 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 176.746 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.09 -45.85 86.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.915 177.517 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.95 -47.45 77.57 Favored 'General case' 0 C--N 1.325 -0.482 0 C-N-CA 122.454 0.302 . . . . 0.0 110.623 179.936 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 34.4 mt -67.1 -51.03 59.29 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 111.612 0.227 . . . . 0.0 111.612 -178.64 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 79.2 t -57.33 -42.71 80.88 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 120.727 -0.389 . . . . 0.0 111.979 178.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -66.52 -19.09 65.7 Favored 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.351 -0.843 . . . . 0.0 111.814 -179.642 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.4 t -87.53 8.1 26.52 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-O 121.021 0.439 . . . . 0.0 111.046 177.876 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 99.59 1.24 56.53 Favored Glycine 0 C--O 1.228 -0.266 0 N-CA-C 116.033 1.173 . . . . 0.0 116.033 176.25 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.463 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 38.3 m-85 -71.9 110.52 6.47 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 118.046 0.923 . . . . 0.0 109.018 178.215 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -67.41 134.48 30.89 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.945 -177.454 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -75.79 125.81 35.84 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.717 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.437 HD11 HD22 ' A' ' 43' ' ' LEU . 45.3 mt -92.22 -43.83 13.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 N-CA-C 105.638 -1.986 . . . . 0.0 105.638 176.014 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -153.41 127.55 9.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.793 175.661 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.21 129.65 24.06 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.734 -1.209 . . . . 0.0 107.734 174.352 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 158.95 -31.97 0.46 Allowed Glycine 0 CA--C 1.506 -0.493 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 176.206 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -66.22 147.51 53.22 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 106.492 -1.67 . . . . 0.0 106.492 176.599 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.4 m -82.08 -11.87 58.55 Favored 'General case' 0 C--N 1.323 -0.568 0 O-C-N 122.136 -0.353 . . . . 0.0 111.428 -178.635 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -108.17 -39.38 5.5 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 114.487 1.291 . . . . 0.0 114.487 -173.704 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -136.39 146.97 47.06 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 114.655 1.354 . . . . 0.0 114.655 178.839 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 83.6 mt -134.92 134.23 53.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.681 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 49.2 m95 -110.41 135.57 50.9 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.0 0.429 . . . . 0.0 111.45 -179.229 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.409 ' HB3' ' HB3' ' A' ' 20' ' ' TYR . 4.1 mp -132.37 143.02 49.55 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 124.105 0.962 . . . . 0.0 109.226 -177.58 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -102.47 135.56 43.87 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.899 -0.778 . . . . 0.0 108.899 178.537 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.76 115.62 39.73 Favored Pre-proline 0 CA--C 1.545 0.762 0 N-CA-C 110.172 -0.307 . . . . 0.0 110.172 -177.976 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 20' ' ' TYR . 93.9 Cg_endo -73.56 -24.43 16.09 Favored 'Trans proline' 0 C--N 1.351 0.675 0 C-N-CA 117.373 -1.285 . . . . 0.0 112.547 -177.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -76.28 -24.45 54.43 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.971 178.78 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 63.69 42.72 6.09 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 -178.378 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 2.0 m -59.87 -177.52 0.06 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 112.559 -2.11 . . . . 0.0 115.078 179.515 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.4 m -52.98 -28.84 25.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.074 -0.966 . . . . 0.0 110.652 173.603 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.436 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 14.4 p-80 -100.53 140.48 34.74 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 105.237 -2.134 . . . . 0.0 105.237 172.101 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 29.3 t0 -97.42 -43.83 7.12 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.032 0.444 . . . . 0.0 111.761 -172.818 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.437 HD22 HD11 ' A' ' 23' ' ' ILE . 51.1 mt -130.5 158.1 40.86 Favored 'General case' 0 CA--C 1.51 -0.561 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 177.959 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 62.8 t -127.6 136.63 59.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 N-CA-C 106.969 -1.493 . . . . 0.0 106.969 177.777 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.48 134.26 35.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.871 0.843 . . . . 0.0 109.371 173.032 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.7 tp -97.55 137.06 37.05 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -178.937 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -136.01 108.81 7.55 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -175.381 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.22 94.78 6.12 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.591 -1.262 . . . . 0.0 107.591 179.505 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -151.52 118.88 5.98 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.342 0.592 . . . . 0.0 111.657 -175.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -87.16 151.48 23.15 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 107.352 -1.351 . . . . 0.0 107.352 175.47 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 13.3 mt -141.19 143.53 34.25 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 119.319 -0.372 . . . . 0.0 110.856 -172.788 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 40.8 m-20 -98.11 -39.46 8.89 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.102 0.477 . . . . 0.0 110.356 176.628 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -133.77 151.09 51.49 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -176.835 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.411 ' H ' ' HB3' ' A' ' 94' ' ' ASP . 9.3 ptt180 -64.48 -21.13 66.57 Favored 'General case' 0 C--O 1.212 -0.908 0 O-C-N 121.528 -0.733 . . . . 0.0 112.535 179.937 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.426 HE21 ' HG3' ' A' ' 56' ' ' GLU . 0.2 OUTLIER -61.15 -33.05 72.78 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.914 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.426 ' HG3' HE21 ' A' ' 55' ' ' GLN . 42.4 mt-10 -72.49 -45.51 59.12 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 176.517 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.0 ttt -55.0 -49.03 72.5 Favored 'General case' 0 C--O 1.219 -0.514 0 CA-C-N 115.298 -0.865 . . . . 0.0 112.591 -178.584 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 11.6 m -65.06 -35.25 75.01 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.75 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.758 178.529 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 86.1 mtt180 -71.13 -32.99 69.66 Favored 'General case' 0 N--CA 1.477 0.918 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.214 -177.106 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -58.4 -38.02 76.51 Favored 'General case' 0 C--N 1.319 -0.757 0 N-CA-C 107.4 -1.333 . . . . 0.0 107.4 175.897 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . . . . . . . . . 3.1 mm -71.58 -30.91 40.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -178.745 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -59.89 -40.18 87.84 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 25.8 tp10 -74.55 -42.7 58.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 178.816 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -58.22 -43.71 87.82 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 122.012 -0.43 . . . . 0.0 110.683 -179.854 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -67.7 -40.27 84.32 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.633 -178.529 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 27.3 tp10 -64.17 -49.37 72.33 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.294 -0.563 . . . . 0.0 109.59 177.883 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -64.5 -40.61 95.98 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 -177.833 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.4 p -72.89 -33.33 43.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.675 -178.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 tt0 -66.74 -38.23 86.24 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 177.274 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.2 ttt180 -60.32 -43.83 96.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.092 -176.398 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 7.6 p -78.23 -35.82 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 120.567 -0.453 . . . . 0.0 111.626 178.673 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -71.0 -30.31 66.51 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 120.888 -1.133 . . . . 0.0 113.552 -178.542 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -58.18 -31.75 67.59 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.129 -0.228 . . . . 0.0 111.554 179.494 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -67.46 -20.47 65.49 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.499 0.926 . . . . 0.0 113.499 -177.705 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -105.01 9.37 34.47 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.927 0.394 . . . . 0.0 110.195 177.503 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 61.79 29.19 71.56 Favored Glycine 0 C--O 1.236 0.24 0 N-CA-C 115.754 1.062 . . . . 0.0 115.754 175.81 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 38.2 ttt85 -69.89 128.29 35.87 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 121.728 -0.866 . . . . 0.0 108.678 -178.819 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -63.73 -36.16 82.95 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -176.326 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -150.22 149.17 29.82 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 176.932 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -120.66 147.98 44.53 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 -174.66 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -134.96 117.47 15.83 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 107.857 -1.164 . . . . 0.0 107.857 177.257 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 62.3 tp -112.89 128.31 56.43 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 111.906 0.335 . . . . 0.0 111.906 -177.13 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 50.0 tp -94.26 104.1 16.11 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 106.805 -1.554 . . . . 0.0 106.805 174.232 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -101.85 128.48 48.2 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 107.437 -1.32 . . . . 0.0 107.437 178.319 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 18.6 t -123.48 109.38 23.19 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.549 0 C-N-CA 120.679 -0.408 . . . . 0.0 110.316 176.551 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -72.9 141.91 47.88 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 175.247 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -118.27 103.75 10.12 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 105.216 -2.142 . . . . 0.0 105.216 174.261 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 83.5 p -123.07 158.74 29.97 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.991 0.424 . . . . 0.0 110.557 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 5.2 t -75.94 -28.87 58.14 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 121.482 -0.761 . . . . 0.0 108.999 -179.335 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -155.32 166.61 33.01 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 105.479 -2.045 . . . . 0.0 105.479 177.247 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -90.18 150.31 43.0 Favored Pre-proline 0 C--N 1.323 -0.545 0 N-CA-C 110.507 -0.183 . . . . 0.0 110.507 -176.008 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.87 145.23 85.49 Favored 'Trans proline' 0 C--N 1.349 0.583 0 C-N-CA 118.03 -0.847 . . . . 0.0 112.046 177.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 33.8 m -76.25 -19.74 15.2 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 N-CA-C 115.775 1.769 . . . . 0.0 115.775 -172.56 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.411 ' HB3' ' H ' ' A' ' 54' ' ' ARG . 43.7 t0 -84.31 87.43 7.2 Favored 'General case' 0 C--O 1.21 -1.023 0 CA-C-O 119.484 -0.293 . . . . 0.0 111.333 -177.526 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 27.56 48.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 118.041 2.608 . . . . 0.0 118.041 176.221 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 34.1 p-90 -62.06 -20.21 63.74 Favored 'General case' 0 N--CA 1.444 -0.755 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -179.03 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -61.03 -31.23 70.86 Favored 'General case' 0 C--N 1.327 -0.378 0 O-C-N 121.841 -0.537 . . . . 0.0 110.356 -179.253 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -60.03 -35.19 74.56 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 177.744 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 6.7 mm -72.45 -43.52 63.52 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.812 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.94 -176.06 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -67.73 -17.33 64.52 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.755 -0.591 . . . . 0.0 112.244 -178.525 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -101.92 17.06 24.08 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -179.771 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 37.6 ttmt -131.02 104.25 7.0 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.601 -176.507 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 38.0 m -68.25 125.9 27.87 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 105.34 -2.096 . . . . 0.0 105.34 174.355 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -82.71 127.79 33.75 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 106.473 -1.677 . . . . 0.0 106.473 179.255 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -126.03 133.06 51.85 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.795 0.807 . . . . 0.0 111.311 179.351 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -142.26 111.47 6.47 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 114.441 -1.254 . . . . 0.0 108.08 178.354 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 59.75 -115.94 8.26 Favored Glycine 0 C--N 1.322 -0.195 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.091 179.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 60.7 p -87.46 -12.61 45.54 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -179.442 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 6.6 t -94.1 141.33 15.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 114.707 1.373 . . . . 0.0 114.707 -174.163 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 11.3 m -120.76 138.45 54.0 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 104.416 -2.438 . . . . 0.0 104.416 167.234 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 25.2 t -132.39 134.03 59.46 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.712 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 179.366 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -96.09 114.48 64.28 Favored Pre-proline 0 CA--C 1.544 0.713 0 N-CA-C 105.948 -1.871 . . . . 0.0 105.948 176.818 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -84.28 59.63 5.97 Favored 'Trans proline' 0 CA--C 1.537 0.655 0 C-N-CA 121.987 1.792 . . . . 0.0 114.209 -177.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -69.33 153.01 44.27 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.88 -178.328 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 10.7 tt -147.46 135.43 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.585 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.189 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 28.0 m -112.18 132.72 60.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 172.587 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -120.2 141.17 50.16 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -176.307 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.1 -26.44 55.82 Favored Glycine 0 C--O 1.227 -0.283 0 N-CA-C 114.808 0.683 . . . . 0.0 114.808 -176.559 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 67.0 p -55.3 -29.6 58.54 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 114.593 1.331 . . . . 0.0 114.593 -179.345 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 23.7 ptm -141.63 26.49 1.93 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.348 0.594 . . . . 0.0 110.298 -178.025 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 12.1 tp -45.35 -37.75 5.2 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 119.328 3.084 . . . . 0.0 119.328 -169.301 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 66.6 mtp180 -65.98 -43.37 88.01 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.301 0.955 . . . . 0.0 110.778 -179.235 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -73.7 -36.0 65.21 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 122.218 1.009 . . . . 0.0 109.495 178.562 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -62.81 -42.72 99.84 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.291 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 11.2 mt -62.13 -43.93 97.76 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.592 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 17.2 pt20 -75.07 -15.24 60.63 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.355 -177.311 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -76.61 -40.85 48.13 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 122.232 -0.292 . . . . 0.0 110.716 178.123 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . 0.422 HG13 ' CD2' ' A' ' 129' ' ' PHE . 12.2 p -92.25 -32.91 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 CA-C-O 120.995 0.426 . . . . 0.0 111.252 179.975 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . 0.422 ' CD2' HG13 ' A' ' 128' ' ' VAL . 38.5 m-85 -127.24 80.67 71.29 Favored Pre-proline 0 C--N 1.326 -0.421 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 178.396 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -65.5 -11.84 32.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 N-CA-C 114.694 0.998 . . . . 0.0 114.694 -177.704 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.9 m -77.97 -2.85 38.97 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 122.123 -0.361 . . . . 0.0 111.666 176.332 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 83.7 t80 -77.0 127.43 32.68 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.596 0.712 . . . . 0.0 111.85 -179.1 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 59.9 mtt180 -88.7 97.1 10.94 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.701 178.795 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 1.5 t -80.09 -16.6 54.66 Favored 'General case' 0 C--N 1.32 -0.681 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.25 178.193 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -73.92 -36.17 64.67 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 179.155 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -59.21 -29.67 67.67 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -177.792 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 65.0 m 62.04 176.81 0.13 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.962 0.905 . . . . 0.0 111.513 -176.219 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 66.9 m -154.6 173.9 15.71 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 179.207 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -57.4 -18.63 18.72 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 113.311 0.856 . . . . 0.0 113.311 179.774 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -58.78 -23.53 60.34 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 120.854 0.359 . . . . 0.0 111.933 177.572 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 5.8 t-80 -81.04 -7.31 59.53 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 120.731 0.3 . . . . 0.0 111.161 -179.06 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -101.52 -52.96 3.1 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.598 -0.273 . . . . 0.0 111.112 -179.334 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 63.0 m -151.01 150.19 30.47 Favored 'General case' 0 C--O 1.222 -0.38 0 CA-C-O 121.695 0.76 . . . . 0.0 112.583 179.401 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 47.0 p90 -66.64 -28.76 68.73 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.829 178.978 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 91.0 mt-10 -62.01 -26.34 68.18 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.379 0.609 . . . . 0.0 111.786 -177.723 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 31.5 m120 -56.91 -22.54 38.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.751 178.253 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -54.43 -32.49 57.53 Favored 'General case' 0 N--CA 1.47 0.557 0 O-C-N 121.96 -0.463 . . . . 0.0 111.759 178.43 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -62.99 -41.05 99.47 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.635 0.731 . . . . 0.0 109.41 177.959 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 68.6 mtp -70.84 -29.01 65.03 Favored 'General case' 0 C--O 1.213 -0.831 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.567 -179.613 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -64.36 -40.42 95.82 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.164 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 49.2 ttt180 -63.43 -46.63 85.45 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 177.94 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -59.43 -42.7 92.47 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.301 0.572 . . . . 0.0 110.317 -179.88 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.5 tpp180 -58.73 -44.68 90.52 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.951 -179.993 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -65.9 -46.2 79.16 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 179.171 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -58.7 -41.51 86.43 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.219 0.533 . . . . 0.0 109.667 -178.156 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 23.7 m -69.76 -35.73 75.18 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.418 178.585 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 1.7 tt -65.47 -39.44 91.97 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -177.126 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 88.7 t -53.68 -54.01 22.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 CA-C-N 118.586 0.63 . . . . 0.0 112.696 -174.715 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -73.88 -38.7 64.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.342 0.592 . . . . 0.0 109.833 -179.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -58.8 -29.76 67.09 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -179.577 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 14.0 tm0? -55.07 -30.49 59.75 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 -178.49 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 65.3 mm-40 -65.48 -38.44 89.79 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 120.992 0.425 . . . . 0.0 110.76 -179.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 53.0 tp10 -77.04 -34.39 57.26 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 177.639 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 4.6 mm100 -61.63 -43.45 98.83 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 121.994 -0.441 . . . . 0.0 110.426 179.508 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -71.63 -23.15 61.65 Favored 'General case' 0 C--O 1.217 -0.614 0 O-C-N 121.923 -0.485 . . . . 0.0 111.299 177.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.7 -21.41 62.57 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-O 121.435 0.636 . . . . 0.0 111.406 178.649 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -63.46 -9.86 14.74 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 175.75 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -47.23 -29.79 2.61 Favored 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 116.883 2.179 . . . . 0.0 116.883 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -64.24 -22.81 67.08 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.102 0.477 . . . . 0.0 111.872 178.242 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -86.73 96.94 10.33 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.63 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 4.8 t -64.85 99.92 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.302 -178.932 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -152.78 170.26 20.74 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -176.873 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -154.9 -34.01 0.1 Allowed 'General case' 0 C--O 1.216 -0.695 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.076 178.229 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 21.6 t30 61.78 20.32 11.3 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.454 0.909 . . . . 0.0 113.454 -178.71 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 76.73 -158.24 48.36 Favored Glycine 0 C--O 1.223 -0.551 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.043 179.185 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -152.16 -29.51 0.16 Allowed 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 113.668 0.988 . . . . 0.0 113.668 178.593 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 63.33 5.93 2.23 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 179.175 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -62.78 128.5 36.23 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 177.57 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 16.6 ttp85 -158.69 89.58 0.96 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 -176.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -142.34 154.93 45.09 Favored 'General case' 0 C--N 1.32 -0.676 0 O-C-N 122.028 -0.42 . . . . 0.0 111.269 179.977 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 24.3 t-20 -169.79 125.46 0.83 Allowed 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 177.219 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 26.3 tp -156.76 152.47 27.01 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 178.341 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 10.8 p90 -160.52 169.85 22.14 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 179.727 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -137.18 150.19 47.75 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 105.972 -1.862 . . . . 0.0 105.972 177.177 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 . . . . . 0 C--O 1.245 0.818 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 -178.881 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.488 ' H2 ' ' HB3' ' A' ' 147' ' ' ALA . 94.9 mmm . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 119.515 -0.279 . . . . 0.0 111.421 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -78.08 151.19 33.55 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.033 0.833 . . . . 0.0 108.893 179.934 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 4.8 tt -65.89 -36.47 83.5 Favored 'General case' 0 C--O 1.218 -0.573 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 175.019 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -65.79 -35.3 80.31 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.315 179.255 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -60.14 -32.15 70.75 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.149 0.5 . . . . 0.0 109.793 -179.817 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 50.8 t80 -62.78 -54.47 38.54 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 177.6 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.8 m -64.17 -38.13 89.96 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.196 0.522 . . . . 0.0 111.381 -179.646 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -56.23 -52.98 62.47 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 123.46 0.704 . . . . 0.0 110.538 178.234 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -70.72 -28.09 64.46 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 121.211 -0.931 . . . . 0.0 111.744 179.094 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 52.3 mmtt -65.26 -43.43 91.33 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 176.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.403 HD11 HD11 ' A' ' 125' ' ' LEU . 18.0 mm -69.28 -38.55 77.77 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 178.835 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 -45.18 80.08 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.15 -42.5 93.74 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.954 0.407 . . . . 0.0 111.382 178.98 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 24.1 t60 -60.15 -46.81 88.41 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.399 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.2 mt -65.1 -53.52 44.18 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 120.86 0.362 . . . . 0.0 111.132 -179.911 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 59.6 t -59.41 -43.57 90.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.465 -175.226 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -69.6 -14.2 62.71 Favored 'General case' 0 N--CA 1.47 0.551 0 O-C-N 121.513 -0.742 . . . . 0.0 112.592 -179.385 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.9 m -89.71 1.49 56.0 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 177.914 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 112.05 -3.0 27.04 Favored Glycine 0 C--O 1.224 -0.48 0 N-CA-C 115.588 0.995 . . . . 0.0 115.588 176.806 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -67.35 118.33 10.56 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 118.284 1.042 . . . . 0.0 109.427 178.571 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -76.64 133.95 14.52 Favored Glycine 0 C--O 1.226 -0.403 0 N-CA-C 110.658 -0.977 . . . . 0.0 110.658 -177.727 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.4 t -77.1 132.62 32.47 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-O 121.34 0.591 . . . . 0.0 110.154 179.457 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 53.7 mt -105.5 -48.51 9.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 N-CA-C 105.954 -1.869 . . . . 0.0 105.954 174.436 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -141.64 116.2 9.63 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -140.09 129.03 23.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 118.25 0.477 . . . . 0.0 111.597 178.19 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 125.97 -17.62 6.72 Favored Glycine 0 CA--C 1.51 -0.25 0 C-N-CA 121.12 -0.562 . . . . 0.0 112.645 176.778 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.67 -22.16 63.59 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.69 0.396 . . . . 0.0 111.394 -179.647 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 6.8 m 72.78 -28.94 0.19 Allowed 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.526 1.53 . . . . 0.0 114.595 176.223 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -80.69 -53.01 6.9 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 106.36 -1.719 . . . . 0.0 106.36 172.822 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mt-10 -116.66 151.9 35.36 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 178.365 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 75.8 mt -137.62 126.48 33.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 104.597 -2.372 . . . . 0.0 104.597 165.082 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 78.6 m95 -108.09 125.48 51.63 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.427 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -122.71 135.24 54.51 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 114.873 -1.058 . . . . 0.0 109.821 -177.874 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -84.88 132.95 34.32 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 107.045 -1.465 . . . . 0.0 107.045 175.238 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -71.11 124.95 91.87 Favored Pre-proline 0 C--N 1.326 -0.451 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.259 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -74.52 -23.67 14.68 Favored 'Trans proline' 0 C--N 1.348 0.503 0 C-N-CA 116.591 -1.806 . . . . 0.0 112.486 -179.79 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -67.96 -37.24 81.33 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.792 -178.633 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 92.7 mttt 59.07 28.13 17.3 Favored 'General case' 0 N--CA 1.48 1.057 0 CA-C-O 123.548 1.642 . . . . 0.0 109.858 -176.073 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 56.3 m -77.38 -173.13 2.75 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 110.871 -2.877 . . . . 0.0 108.5 173.802 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.48 -28.84 0.14 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 117.418 2.377 . . . . 0.0 117.418 -174.576 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.553 ' HA ' ' HB3' ' A' ' 81' ' ' LYS . 11.6 p80 -107.69 131.54 54.3 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 120.004 1.275 . . . . 0.0 108.709 169.871 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -87.12 -39.79 15.23 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 113.837 -1.529 . . . . 0.0 111.582 -172.267 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.3 mt -135.37 164.08 28.58 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.333 -178.6 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 96.6 t -128.68 136.76 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 107.348 -1.353 . . . . 0.0 107.348 175.678 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 65.5 ttt-85 -120.95 116.48 25.19 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 179.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -93.68 130.08 39.76 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 104.865 -2.272 . . . . 0.0 104.865 175.459 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 16.1 t80 -136.2 124.39 23.11 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -174.92 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.87 94.87 5.42 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 121.213 0.53 . . . . 0.0 110.076 -179.315 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -144.16 141.64 30.07 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.561 -0.904 . . . . 0.0 108.561 178.188 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -99.17 137.0 38.32 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 -177.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.84 145.59 47.92 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 -174.903 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 47.3 t0 -107.36 -39.69 5.59 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 177.172 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -122.47 161.26 23.9 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.878 179.411 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -66.19 -15.47 63.17 Favored 'General case' 0 CA--C 1.509 -0.634 0 N-CA-C 109.958 -0.386 . . . . 0.0 109.958 178.095 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -59.74 -43.15 94.38 Favored 'General case' 0 C--O 1.214 -0.795 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.53 -46.8 88.4 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.367 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.424 ' O ' HD12 ' A' ' 61' ' ' ILE . 81.0 mtp -56.64 -51.96 66.7 Favored 'General case' 0 C--O 1.22 -0.471 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.34 -179.426 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 33.9 m -67.08 -31.84 55.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 120.24 -0.584 . . . . 0.0 111.325 -175.96 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 71.0 mtt-85 -67.53 -43.77 79.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -179.478 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -58.37 -45.22 88.67 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.602 -179.378 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.424 HD12 ' O ' ' A' ' 57' ' ' MET . 2.5 mt -74.12 -34.2 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 O-C-N 121.313 -0.867 . . . . 0.0 112.067 -177.446 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -57.33 -37.68 72.92 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 177.321 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -76.62 -46.22 26.91 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.925 179.219 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.428 ' O ' HG23 ' A' ' 68' ' ' VAL . 50.7 mt-30 -55.29 -43.8 75.12 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.244 -178.557 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.72 -39.68 81.53 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 118.382 0.537 . . . . 0.0 111.312 -177.518 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.411 ' HB3' HH21 ' A' ' 70' ' ' ARG . 26.1 mt-10 -73.42 -30.23 63.1 Favored 'General case' 0 C--N 1.322 -0.63 0 O-C-N 121.436 -0.79 . . . . 0.0 111.094 178.8 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.12 -40.03 78.55 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 174.918 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 64' ' ' GLN . 73.0 t -65.9 -36.45 77.54 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.731 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -54.35 -38.72 66.4 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 118.902 0.774 . . . . 0.0 111.69 178.726 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.411 HH21 ' HB3' ' A' ' 66' ' ' GLU . 6.8 mmt180 -67.31 -43.27 82.1 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 -178.847 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 58.3 t -66.76 -42.89 90.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 179.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -57.78 -44.34 86.17 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 123.101 0.56 . . . . 0.0 109.999 178.573 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -65.61 -42.22 91.84 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.656 0.265 . . . . 0.0 110.467 179.605 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 46.2 tt0 -62.54 -40.59 97.28 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 120.922 0.391 . . . . 0.0 111.161 179.506 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 96.1 mt -82.94 0.97 41.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -179.929 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 66.31 22.59 71.17 Favored Glycine 0 CA--C 1.522 0.499 0 N-CA-C 114.24 0.456 . . . . 0.0 114.24 178.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? -76.68 140.25 40.82 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.972 -0.722 . . . . 0.0 110.8 -176.931 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -74.64 -35.72 62.88 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 178.869 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 19.9 mtp180 -150.65 162.37 40.79 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 102.631 -3.1 . . . . 0.0 102.631 176.399 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 4.6 mtp -137.31 152.93 50.29 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 177.496 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.553 ' HB3' ' HA ' ' A' ' 41' ' ' HIS . 7.0 tttp -129.75 133.7 47.17 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 176.588 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -130.23 125.44 34.88 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 123.387 0.43 . . . . 0.0 110.588 -174.571 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 52.8 tp -88.04 107.81 18.92 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 107.757 -1.201 . . . . 0.0 107.757 176.601 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -101.96 128.65 48.28 Favored 'General case' 0 CA--C 1.51 -0.56 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 16.3 t -121.31 110.0 26.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 117.945 0.338 . . . . 0.0 111.232 178.443 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -75.04 149.41 39.22 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 175.785 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -128.79 103.67 7.19 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 174.351 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 88.8 p -130.24 150.57 51.43 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.84 0.352 . . . . 0.0 111.823 -175.946 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 12.0 t -67.08 -29.36 69.11 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 113.229 0.825 . . . . 0.0 113.229 -178.083 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -138.61 167.4 22.02 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 106.358 -1.719 . . . . 0.0 106.358 -178.099 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -94.13 144.02 27.37 Favored Pre-proline 0 C--N 1.318 -0.787 0 N-CA-C 106.2 -1.778 . . . . 0.0 106.2 177.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -57.47 149.47 66.0 Favored 'Trans proline' 0 C--N 1.346 0.444 0 N-CA-C 114.802 1.039 . . . . 0.0 114.802 -179.966 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 15.1 m -76.64 -15.34 14.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 117.209 2.3 . . . . 0.0 117.209 -174.71 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -123.73 98.31 5.76 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 116.552 2.056 . . . . 0.0 116.552 -176.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 39.4 t0 38.07 50.02 1.3 Allowed 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 116.095 1.887 . . . . 0.0 116.095 170.924 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . 0.427 ' HA ' HG12 ' A' ' 99' ' ' ILE . 53.0 p-90 -80.03 -14.39 58.59 Favored 'General case' 0 N--CA 1.434 -1.231 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 176.849 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.5 mt-10 -66.84 -31.79 72.63 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 121.489 -0.757 . . . . 0.0 110.625 -177.439 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 38.6 mm-40 -65.12 -20.66 66.57 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.132 0.491 . . . . 0.0 109.99 173.951 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.427 HG12 ' HA ' ' A' ' 96' ' ' TRP . 12.3 mm -79.27 -45.52 23.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.897 0 N-CA-C 108.598 -0.889 . . . . 0.0 108.598 -179.299 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -65.03 -24.42 67.48 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.74 0.781 . . . . 0.0 110.184 178.09 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -77.6 -16.11 58.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.045 -0.98 . . . . 0.0 112.373 -179.29 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 59.5 pttt -113.1 126.58 55.62 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 113.153 0.797 . . . . 0.0 113.153 -176.039 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 46.5 m -70.44 126.41 29.57 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 103.496 -2.779 . . . . 0.0 103.496 171.545 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 81.1 t80 -82.82 119.31 24.21 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 178.012 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -121.73 122.68 40.1 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.912 0.863 . . . . 0.0 109.51 178.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -143.79 129.25 19.01 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 -178.81 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 65.11 -127.0 32.21 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 107.899 -2.08 . . . . 0.0 107.899 -176.962 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 67.3 p -104.46 7.89 35.51 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 121.171 0.51 . . . . 0.0 110.228 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 15.9 t -97.72 147.65 6.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -176.088 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.2 m -125.22 138.78 54.12 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 104.549 -2.389 . . . . 0.0 104.549 171.196 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 51.1 t -137.29 134.61 47.17 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.706 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -99.63 114.27 65.51 Favored Pre-proline 0 C--N 1.321 -0.632 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 177.769 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_endo -81.52 77.18 4.04 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.515 2.143 . . . . 0.0 114.644 -178.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -86.15 155.25 20.83 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . 0.411 HG21 ' CZ3' ' A' ' 96' ' ' TRP . 11.6 tt -147.83 146.16 18.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 -176.617 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . . . . . . . . . 72.7 t -114.48 118.16 57.74 Favored 'Isoleucine or valine' 0 C--O 1.235 0.335 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.85 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -73.4 143.27 46.84 Favored 'General case' 0 C--O 1.216 -0.665 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.01 175.42 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -83.42 -41.96 8.14 Favored Glycine 0 C--O 1.223 -0.548 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 169.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 10.9 t -57.74 -23.9 54.33 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 114.58 1.326 . . . . 0.0 114.58 -178.278 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 20.8 ptm -139.94 40.35 1.98 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-O 122.151 0.977 . . . . 0.0 109.721 177.759 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -50.79 -45.79 59.41 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 -172.615 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 23.3 mtm105 -57.06 -51.31 69.8 Favored 'General case' 0 N--CA 1.474 0.772 0 CA-C-N 118.967 0.803 . . . . 0.0 111.686 -178.301 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -73.79 -35.22 64.91 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.551 -175.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.7 -38.23 54.75 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -178.5 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.403 HD11 HD11 ' A' ' 11' ' ' ILE . 3.2 tm? -63.35 -41.98 98.89 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 121.745 -0.597 . . . . 0.0 110.964 -177.381 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -69.72 -13.38 62.26 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.235 -177.961 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -78.13 -34.42 49.94 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 110.132 -0.321 . . . . 0.0 110.132 177.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 4.6 p -93.01 -36.57 7.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 CA-C-O 120.872 0.367 . . . . 0.0 110.373 179.383 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -127.83 75.67 77.94 Favored Pre-proline 0 C--N 1.326 -0.434 0 O-C-N 122.149 -0.344 . . . . 0.0 111.246 178.229 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.19 -15.04 42.14 Favored 'Trans proline' 0 C--N 1.347 0.492 0 CA-C-O 121.276 0.448 . . . . 0.0 112.953 178.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 14.5 m -79.99 -7.14 58.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 178.771 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -75.87 132.91 40.63 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.451 0.643 . . . . 0.0 110.72 -179.461 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 75.1 ttt180 -77.06 95.58 4.23 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 175.353 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 23.8 p -62.71 -25.4 68.15 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 120.727 0.299 . . . . 0.0 110.907 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -62.42 -14.61 42.51 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.138 0.975 . . . . 0.0 112.544 177.711 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -71.2 -6.13 37.2 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 121.811 -0.556 . . . . 0.0 110.642 178.869 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 9.8 p -154.24 -179.87 8.32 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 122.711 0.404 . . . . 0.0 109.976 -178.958 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 2.3 p -146.56 156.24 43.09 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 103.324 -2.843 . . . . 0.0 103.324 173.635 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -68.29 -32.41 72.53 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.377 0.608 . . . . 0.0 110.921 -176.054 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 43.8 mp0 -68.02 -33.12 74.0 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.694 0.759 . . . . 0.0 109.696 179.028 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . . . . . . . . . 6.8 t-80 -83.54 -3.42 57.63 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.809 -0.632 . . . . 0.0 111.935 -178.221 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -78.03 38.18 0.27 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-O 121.504 0.669 . . . . 0.0 112.094 179.897 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 75.1 m -67.48 157.13 34.98 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.24 0.543 . . . . 0.0 110.676 -179.157 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 52.9 p90 -55.35 -33.38 63.34 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 -177.082 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 81.6 tt0 -72.61 -39.47 67.25 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.666 0.746 . . . . 0.0 111.176 178.945 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.25 -24.41 66.58 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 122.024 -0.423 . . . . 0.0 110.972 -176.836 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.488 ' HB3' ' H2 ' ' A' ' 1' ' ' MET . . . -59.88 -37.62 79.87 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 120.71 0.29 . . . . 0.0 110.682 175.304 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -71.5 -42.29 68.23 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.527 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 23.9 mmt -60.28 -33.8 72.85 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 121.049 0.452 . . . . 0.0 110.137 178.424 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -66.69 -38.64 87.18 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 122.056 -0.403 . . . . 0.0 110.328 178.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.25 -43.89 85.23 Favored 'General case' 0 CA--C 1.507 -0.686 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 178.023 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -64.05 -41.59 97.33 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-O 121.2 0.524 . . . . 0.0 109.886 -178.517 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 39.8 ttp180 -63.01 -42.31 99.78 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 176.881 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -62.15 -41.53 98.37 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 178.168 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 41.0 mt -63.58 -37.68 88.25 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.098 0.475 . . . . 0.0 110.034 179.913 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 20.9 m -69.83 -35.16 74.54 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.695 0.76 . . . . 0.0 110.505 176.146 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.85 -47.32 69.28 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.621 -178.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . . . . . . . . . 9.1 p -64.99 -40.3 88.6 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.639 0 C-N-CA 120.576 -0.449 . . . . 0.0 110.226 -178.623 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -61.64 -39.34 90.99 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.231 -0.588 . . . . 0.0 109.913 -179.418 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -65.47 -40.91 93.74 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 121.705 -0.622 . . . . 0.0 110.338 176.225 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 27.2 tp60 -59.59 -28.36 67.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.021 -179.38 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -61.19 -36.04 78.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.115 0.483 . . . . 0.0 110.397 -178.813 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 43.5 tp10 -68.37 -34.04 75.36 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.402 0.62 . . . . 0.0 109.693 178.062 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -70.83 -49.76 42.83 Favored 'General case' 0 C--N 1.324 -0.531 0 O-C-N 121.948 -0.47 . . . . 0.0 111.715 178.711 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -71.61 -17.64 62.27 Favored 'General case' 0 C--O 1.217 -0.62 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -174.421 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt -60.41 -17.96 47.58 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 118.763 0.71 . . . . 0.0 111.566 -179.617 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 68.5 p -70.29 -14.09 62.44 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 178.917 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -63.82 -24.37 67.72 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 121.95 -0.469 . . . . 0.0 111.077 -179.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -68.76 -14.37 62.98 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 178.827 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -108.72 13.42 25.08 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -176.775 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 26.8 m -66.48 141.9 17.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 122.202 1.001 . . . . 0.0 110.931 -179.949 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 18.5 p90 -115.63 24.97 11.13 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 179.53 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 5.4 pp0? -150.04 165.56 32.36 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 -177.379 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -152.12 143.97 23.69 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 178.791 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . -168.75 176.36 43.01 Favored Glycine 0 C--O 1.226 -0.398 0 N-CA-C 109.979 -1.249 . . . . 0.0 109.979 -179.456 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -140.93 -16.44 0.87 Allowed 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.004 1.112 . . . . 0.0 114.004 -179.16 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 6.7 tp 53.53 -166.94 0.07 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 109.716 -0.475 . . . . 0.0 109.716 -173.503 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -166.24 162.38 17.37 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 103.001 -2.962 . . . . 0.0 103.001 177.071 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 34.4 ttm180 -148.99 -63.84 0.23 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -175.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.41 171.53 17.91 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.518 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -151.03 142.61 23.58 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 173.606 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 39.3 tp -163.35 157.55 20.19 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 104.716 -2.327 . . . . 0.0 104.716 178.307 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 9.4 p90 -162.77 162.91 26.86 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 -178.24 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -138.74 135.96 35.26 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 176.524 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 . . . . . 0 C--O 1.254 1.298 0 N-CA-C 104.037 -2.579 . . . . 0.0 104.037 -178.084 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.1 ptm . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.818 0.342 . . . . 25.0 110.939 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 12.8 m-85 -111.11 157.0 20.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.191 -0.459 . . . . 25.0 110.929 -179.963 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.731 HD13 ' CE2' ' A' ' 144' ' ' PHE . 10.7 tp -70.56 -36.63 73.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.118 -0.492 . . . . 25.0 110.834 -179.88 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 88' ' ' SER . 3.5 mm? -73.73 -55.25 6.48 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.229 -0.442 . . . . 25.0 110.958 179.877 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -54.04 -35.45 62.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 25.0 110.851 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.68 ' HB2' ' HB2' ' A' ' 147' ' ' ALA . 14.7 t80 -52.46 -46.1 66.34 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.152 -0.476 . . . . 25.0 110.948 -179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.497 ' CG2' HD11 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -71.22 -54.32 11.35 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.093 -179.977 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 30.7 t80 -51.19 -38.94 55.15 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.273 -0.421 . . . . 25.0 110.926 -179.893 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 26.6 m95 -75.63 -48.26 22.95 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.114 -0.494 . . . . 25.0 110.863 179.968 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.35 -48.3 74.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 25.0 110.882 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 35.6 mm -56.84 -48.09 81.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.211 -0.45 . . . . 25.0 111.138 179.857 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.49 -44.15 62.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 25.0 111.093 179.849 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.552 ' HB1' HD13 ' A' ' 157' ' ' LEU . . . -72.0 -33.09 67.81 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.213 -0.449 . . . . 25.0 111.087 179.941 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.85 -51.86 59.78 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.889 179.981 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.484 ' CB ' HD13 ' A' ' 33' ' ' LEU . 3.8 mt -56.66 -56.13 25.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 25.0 110.903 -179.947 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.7 p -56.57 -33.0 38.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.19 -0.459 . . . . 25.0 111.134 179.804 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.2 t-20 -69.97 -17.88 63.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.283 -0.417 . . . . 25.0 110.891 179.982 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -92.0 33.87 1.04 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.86 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 62.94 45.82 94.86 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.713 -0.756 . . . . 25.0 112.457 -179.973 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -103.4 104.06 14.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.857 0.36 . . . . 25.0 110.878 -179.764 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -50.9 111.42 1.26 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.798 -0.715 . . . . 25.0 112.438 -179.995 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.548 HG11 ' HB2' ' A' ' 25' ' ' ALA . 21.7 t -69.98 106.53 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 120.763 0.316 . . . . 25.0 111.078 -179.926 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.56 HD11 HD22 ' A' ' 43' ' ' LEU . 3.9 mt -69.12 -34.77 65.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.138 -0.483 . . . . 25.0 111.106 179.905 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -169.28 116.08 0.6 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.863 179.957 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.548 ' HB2' HG11 ' A' ' 22' ' ' VAL . . . -108.57 104.47 13.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.079 179.926 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 179.08 29.77 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.752 -0.737 . . . . 25.0 112.487 -179.925 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 52.24 -96.81 0.05 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.827 0.346 . . . . 25.0 110.882 -179.833 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 5.7 t 69.11 -70.68 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.839 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -141.29 -44.84 0.37 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.134 -0.485 . . . . 25.0 110.869 179.901 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.57 173.12 15.58 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.916 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 59.9 mt -103.65 130.24 54.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.153 -0.476 . . . . 25.0 111.18 179.904 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -109.76 135.73 50.21 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.124 -0.489 . . . . 25.0 110.918 179.94 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.484 HD13 ' CB ' ' A' ' 15' ' ' LEU . 11.3 mt -146.03 124.51 12.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.195 -0.457 . . . . 25.0 110.942 -179.948 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -74.24 133.64 42.66 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.151 -0.477 . . . . 25.0 110.9 179.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.4 104.04 38.97 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.594 0.711 . . . . 25.0 111.112 179.907 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -32.35 18.68 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.627 2.218 . . . . 25.0 112.328 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -57.68 -25.63 60.53 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.256 -0.429 . . . . 25.0 110.823 179.968 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 66.27 39.7 4.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.93 -179.955 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.07 -176.52 1.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.213 -0.449 . . . . 25.0 110.843 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -49.07 -34.54 13.84 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.058 -0.519 . . . . 25.0 110.945 -179.815 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -105.51 122.8 46.77 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.051 -0.522 . . . . 25.0 110.909 179.848 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -74.12 -56.03 5.4 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.893 179.978 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.56 HD22 HD11 ' A' ' 23' ' ' ILE . 63.0 mt -119.59 155.26 32.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 25.0 110.895 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 21.5 t -115.9 148.61 18.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.14 -0.482 . . . . 25.0 111.169 179.845 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.634 ' HG3' HD11 ' A' ' 82' ' ' LEU . 1.3 mtt180 -132.23 140.15 48.56 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.216 -0.447 . . . . 25.0 110.827 -179.909 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.522 HD12 ' O ' ' A' ' 45' ' ' ARG . 4.5 mp -134.35 126.56 29.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.891 179.998 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -126.71 150.01 49.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.167 -0.47 . . . . 25.0 110.987 -179.967 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.15 94.84 4.2 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.164 -0.471 . . . . 25.0 110.859 179.894 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' HIS . . . . . . . . . . . . . 13.8 t60 -151.57 148.95 28.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 25.0 110.875 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -92.99 140.06 29.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.455 . . . . 25.0 110.874 179.958 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -117.34 152.09 35.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.226 -0.443 . . . . 25.0 110.871 -179.878 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -104.32 -36.25 7.67 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.147 -0.479 . . . . 25.0 110.933 179.848 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -135.97 -175.13 3.87 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.203 -0.453 . . . . 25.0 110.932 -179.984 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 28.7 ptt85 -80.38 -30.54 37.86 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.172 -0.467 . . . . 25.0 110.796 -179.894 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.4 -35.1 62.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.263 -0.426 . . . . 25.0 110.917 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.12 -34.87 61.73 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.231 -0.441 . . . . 25.0 110.905 -179.908 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . 0.568 ' O ' HD12 ' A' ' 61' ' ' ILE . 1.8 tpp -72.57 -52.28 16.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 25.0 110.877 179.912 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.502 ' CG1' HD12 ' A' ' 99' ' ' ILE . 34.2 m -58.95 -34.26 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.268 -0.424 . . . . 25.0 111.154 179.911 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 4.6 mtm-85 -66.51 -37.68 85.57 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.165 -0.47 . . . . 25.0 110.868 -179.937 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.8 -54.13 46.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 25.0 110.879 179.949 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.568 HD12 ' O ' ' A' ' 57' ' ' MET . 2.4 mp -60.73 -37.85 77.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.288 -0.414 . . . . 25.0 111.139 179.948 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -51.43 -34.89 37.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.086 -0.506 . . . . 25.0 110.942 179.944 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -76.78 -35.67 57.51 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.151 -0.477 . . . . 25.0 110.917 -179.882 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.74 ' O ' HG23 ' A' ' 68' ' ' VAL . 2.8 mp0 -54.42 -59.72 4.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.173 -0.467 . . . . 25.0 110.924 -179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.507 ' HB1' ' CB ' ' A' ' 106' ' ' LYS . . . -52.22 -38.35 57.77 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 25.0 111.083 179.924 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -60.89 -42.04 97.23 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.19 -0.459 . . . . 25.0 110.886 -179.95 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.48 -37.2 57.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.884 -179.907 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.744 HG11 HG13 ' A' ' 109' ' ' VAL . 68.1 t -52.85 -35.74 22.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 25.0 111.124 179.985 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -53.93 -36.69 63.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.813 -179.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 93.1 mtt-85 -72.29 -37.12 69.08 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.176 -0.466 . . . . 25.0 110.842 -179.891 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 86.5 t -70.87 -52.8 25.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 25.0 111.166 179.964 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.37 -36.36 75.62 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.806 179.987 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' HIS . . . . . . . . . . . . . 46.9 t60 -58.25 -45.27 88.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.818 -179.924 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.5 mt-30 -72.54 -37.55 68.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 25.0 110.9 -179.849 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 2.3 mp -70.98 -19.63 62.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 25.0 110.896 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 55.32 33.34 58.2 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.773 -0.727 . . . . 25.0 112.501 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -98.03 175.34 6.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.847 0.356 . . . . 25.0 110.897 -179.89 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.6 mtt180 -71.27 -52.83 16.75 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.163 -0.471 . . . . 25.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 18.9 mtt85 -148.74 163.86 36.07 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.144 -0.48 . . . . 25.0 110.859 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . . 45.8 mmm -134.9 130.97 36.73 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.176 -0.465 . . . . 25.0 110.869 179.934 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.7 120.12 39.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.184 -0.462 . . . . 25.0 110.901 179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.661 ' O ' HG13 ' A' ' 111' ' ' VAL . 0.6 OUTLIER -111.57 130.99 55.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.314 -0.403 . . . . 25.0 110.967 179.878 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.62 ' N ' HD13 ' A' ' 82' ' ' LEU . 2.3 tp -104.08 97.72 7.65 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.196 -0.456 . . . . 25.0 110.917 179.856 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -100.21 126.68 46.53 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.166 -0.47 . . . . 25.0 110.821 179.91 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.544 HG23 ' CB ' ' A' ' 114' ' ' ALA . 7.0 p -129.6 154.87 40.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.142 -0.481 . . . . 25.0 111.133 179.971 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -122.56 127.4 49.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.866 -179.953 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -98.39 114.61 27.01 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 25.0 110.865 -179.938 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.598 ' O ' HD11 ' A' ' 4' ' ' LEU . 60.2 p -143.76 169.52 17.62 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.862 -179.778 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 77.8 m -89.86 -51.22 5.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.086 -0.506 . . . . 25.0 111.157 -179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 37.0 tp10 -120.58 135.24 55.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.837 179.975 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.773 ' HB2' ' HD2' ' A' ' 117' ' ' ARG . . . -69.24 160.15 80.1 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.54 0.686 . . . . 25.0 111.092 179.959 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.571 ' HD2' ' HB1' ' A' ' 91' ' ' ALA . 54.3 Cg_endo -69.58 -170.48 0.38 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.753 2.302 . . . . 25.0 112.383 -179.997 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.6 m -145.79 80.67 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 25.0 111.151 179.83 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -172.98 45.38 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.461 . . . . 25.0 110.786 179.89 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.9 t70 63.51 55.85 1.7 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.252 -0.431 . . . . 25.0 110.858 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' TRP . . . . . . . . . . . . . 24.3 p-90 -84.39 -29.63 26.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.202 -0.454 . . . . 25.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -50.7 -48.2 58.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.199 -0.455 . . . . 25.0 110.846 -179.86 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.6 tt0 -51.92 -33.57 37.81 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.136 -0.484 . . . . 25.0 110.847 -179.874 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' ILE . . . . . 0.557 HG22 ' HG3' ' A' ' 113' ' ' PRO . 21.6 mm -59.99 -46.4 94.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.154 -0.476 . . . . 25.0 111.098 -179.98 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -61.82 -31.11 71.32 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 25.0 111.02 179.922 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 26.6 ttmt -73.0 -38.07 66.74 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.186 -0.461 . . . . 25.0 110.932 179.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 10.1 ptmt -89.08 156.54 18.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.197 -0.456 . . . . 25.0 110.881 179.884 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 91.3 m -122.81 143.98 49.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.22 -0.445 . . . . 25.0 111.161 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -90.75 104.16 16.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.241 -0.436 . . . . 25.0 110.904 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -112.43 101.09 9.3 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.142 -0.481 . . . . 25.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.507 ' CB ' ' HB1' ' A' ' 65' ' ' ALA . 0.2 OUTLIER -98.01 103.28 15.2 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.081 -0.508 . . . . 25.0 110.823 -179.988 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 52.75 -112.41 2.14 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.725 . . . . 25.0 112.437 179.835 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 6.1 p -95.08 29.81 2.33 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.816 0.341 . . . . 25.0 111.125 -179.824 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.744 HG13 HG11 ' A' ' 68' ' ' VAL . 17.5 t -122.46 151.61 26.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.461 . . . . 25.0 111.096 179.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.8 t -137.73 112.5 8.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.106 -0.497 . . . . 25.0 110.893 -179.818 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 111' ' ' VAL . . . . . 0.661 HG13 ' O ' ' A' ' 82' ' ' LEU . 18.9 t -140.94 138.9 34.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.148 -0.478 . . . . 25.0 111.082 -179.952 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -124.04 141.86 38.21 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.648 0.737 . . . . 25.0 110.885 -179.991 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 113' ' ' PRO . . . . . 0.557 ' HG3' HG22 ' A' ' 99' ' ' ILE . 54.6 Cg_endo -69.65 135.61 31.16 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.669 2.246 . . . . 25.0 112.351 179.963 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.544 ' CB ' HG23 ' A' ' 85' ' ' VAL . . . -134.26 135.14 42.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.203 -0.453 . . . . 25.0 111.111 179.875 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 115' ' ' ILE . . . . . . . . . . . . . 20.0 tt -145.98 137.93 19.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.267 -0.424 . . . . 25.0 111.165 -179.997 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 116' ' ' VAL . . . . . 0.695 HG12 ' HB3' ' A' ' 124' ' ' ASP . 4.7 m -130.74 101.85 6.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.209 -0.45 . . . . 25.0 111.203 179.862 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.773 ' HD2' ' HB2' ' A' ' 91' ' ' ALA . 0.0 OUTLIER -95.2 154.73 17.05 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.137 -0.483 . . . . 25.0 110.889 -179.961 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.65 -29.46 18.37 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.765 -0.731 . . . . 25.0 112.482 -179.983 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 119' ' ' THR . . . . . . . . . . . . . 14.1 p -57.51 -45.37 85.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 25.0 111.172 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 1.7 mtm -134.59 46.93 2.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.819 179.925 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.453 ' CD1' HD12 ' A' ' 125' ' ' LEU . 0.2 OUTLIER -61.31 -59.19 5.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 25.0 110.85 -179.963 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -62.72 -35.58 80.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.17 -0.468 . . . . 25.0 110.91 179.908 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -66.57 -41.09 89.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 25.0 110.8 -179.954 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . 0.695 ' HB3' HG12 ' A' ' 116' ' ' VAL . 1.1 m-20 -77.43 -33.25 54.91 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.214 -0.448 . . . . 25.0 110.897 -179.964 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 125' ' ' LEU . . . . . 0.497 HD11 ' CG2' ' A' ' 7' ' ' THR . 0.2 OUTLIER -52.66 -33.8 48.81 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.11 -0.495 . . . . 25.0 110.932 -179.954 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 126' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -75.36 -30.2 60.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.174 -0.466 . . . . 25.0 110.846 179.962 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -73.54 -37.83 65.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 25.0 111.17 179.906 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 128' ' ' VAL . . . . . . . . . . . . . 21.4 t -90.34 -60.63 2.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.231 -0.441 . . . . 25.0 111.108 179.979 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 129' ' ' PHE . . . . . 0.478 ' HZ ' HD11 ' A' ' 46' ' ' LEU . 31.0 m-85 -112.44 77.54 2.32 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 121.586 0.708 . . . . 25.0 110.881 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.85 -29.45 23.44 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.643 2.229 . . . . 25.0 112.321 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 43.3 t -69.44 -16.04 63.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.219 -0.446 . . . . 25.0 110.799 -179.813 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -54.24 146.17 15.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.854 -179.877 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 87.3 mtt180 -91.06 122.63 33.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.205 -0.452 . . . . 25.0 110.854 -179.93 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.81 -33.6 18.56 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.143 -0.48 . . . . 25.0 111.176 -179.992 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.0 -32.4 21.13 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.181 -0.463 . . . . 25.0 110.851 -179.988 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 136' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -35.57 52.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.152 -0.477 . . . . 25.0 110.875 179.989 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 137' ' ' CYS . . . . . . . . . . . . . 34.9 t -62.81 94.4 0.07 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.195 -0.457 . . . . 25.0 110.828 -179.818 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -154.66 -173.25 4.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.15 -0.477 . . . . 25.0 110.873 -179.745 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 139' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.26 -31.75 14.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.949 179.942 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -34.59 44.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.133 -0.485 . . . . 25.0 110.939 -179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 141' ' ' HIS . . . . . 0.447 ' O ' ' HB3' ' A' ' 142' ' ' ALA . 42.7 m170 -79.15 -28.38 42.82 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.154 -0.475 . . . . 25.0 110.888 -179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 142' ' ' ALA . . . . . 0.447 ' HB3' ' O ' ' A' ' 141' ' ' HIS . . . 68.91 -77.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 25.0 111.098 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 143' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -165.38 -169.88 1.72 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.212 -0.449 . . . . 25.0 110.858 -179.876 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 144' ' ' PHE . . . . . 0.731 ' CE2' HD13 ' A' ' 3' ' ' LEU . 13.8 m-85 -52.13 -29.34 21.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.126 -0.488 . . . . 25.0 110.834 -179.868 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 145' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.17 -34.71 32.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.111 -0.495 . . . . 25.0 110.877 -179.915 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 146' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.26 -33.01 62.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 25.0 110.969 -179.974 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 147' ' ' ALA . . . . . 0.68 ' HB2' ' HB2' ' A' ' 6' ' ' TYR . . . -53.88 -35.39 61.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.471 . . . . 25.0 111.154 179.763 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 148' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -61.47 -44.76 96.53 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.436 . . . . 25.0 110.852 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 149' ' ' MET . . . . . . . . . . . . . 2.2 mmt -76.93 -35.73 57.1 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.24 -0.437 . . . . 25.0 110.852 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -55.75 -35.65 66.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.252 -0.431 . . . . 25.0 111.132 179.891 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 151' ' ' ARG . . . . . . . . . . . . . 8.3 ttt180 -65.13 -53.81 39.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.236 -0.438 . . . . 25.0 110.863 -179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -43.79 82.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 25.0 110.877 -179.917 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.12 -39.5 93.15 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 25.0 110.959 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.588 ' O ' HG23 ' A' ' 158' ' ' VAL . 38.9 t80 -53.57 -44.23 69.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 25.0 110.861 -179.923 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 155' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -51.93 -46.12 64.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.145 -0.48 . . . . 25.0 110.884 -179.908 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 156' ' ' SER . . . . . . . . . . . . . 3.5 m -76.15 -36.22 58.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.869 -179.933 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 157' ' ' LEU . . . . . 0.552 HD13 ' HB1' ' A' ' 13' ' ' ALA . 10.5 tt -57.17 -34.99 69.03 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 25.0 110.89 179.994 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 158' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 154' ' ' PHE . 84.1 t -52.63 -54.5 15.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.2 -0.454 . . . . 25.0 111.101 179.795 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 159' ' ' LEU . . . . . 0.653 HD13 ' O ' ' A' ' 159' ' ' LEU . 3.3 tm? -75.25 -33.35 61.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 25.0 110.886 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 16.8 ttpt -60.74 -36.25 78.42 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.257 -0.429 . . . . 25.0 110.838 179.85 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 161' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.37 -30.09 50.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.195 -0.457 . . . . 25.0 110.986 179.931 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -57.58 -43.26 84.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 25.0 110.858 -179.898 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -77.07 -35.97 56.25 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.22 -0.445 . . . . 25.0 110.793 -179.876 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -66.44 -35.6 80.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 25.0 110.885 -179.88 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 165' ' ' ARG . . . . . . . . . . . . . 2.4 ttt-85 -51.88 -36.0 47.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 25.0 110.885 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 6.4 mmtp -51.84 -51.64 55.14 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.229 -0.441 . . . . 25.0 110.901 179.966 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 167' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -35.55 68.31 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 25.0 111.174 179.982 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 168' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -51.92 -36.0 47.59 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.186 -0.461 . . . . 25.0 110.921 179.93 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -51.55 -35.62 41.73 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.118 -0.492 . . . . 25.0 111.13 179.927 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -51.65 125.54 15.11 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 25.0 111.098 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 171' ' ' VAL . . . . . . . . . . . . . 34.2 m -51.8 139.02 8.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.218 -0.446 . . . . 25.0 111.084 -179.994 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 172' ' ' PHE . . . . . . . . . . . . . 29.3 p90 -148.82 -170.66 3.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 25.0 110.908 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 173' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -176.48 134.47 0.23 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.171 -0.468 . . . . 25.0 110.897 -179.961 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -177.64 163.1 1.86 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.249 -0.432 . . . . 25.0 110.917 -179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 175' ' ' GLY . . . . . . . . . . . . . . . 112.0 -176.42 18.02 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.846 -0.692 . . . . 25.0 112.555 -179.96 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 176' ' ' LYS . . . . . . . . . . . . . 7.0 mttt -141.79 178.63 7.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.781 0.324 . . . . 25.0 110.924 -179.949 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 177' ' ' LEU . . . . . . . . . . . . . 2.2 tt -142.53 -43.4 0.32 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.46 . . . . 25.0 110.915 179.911 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 178' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -53.8 136.14 40.56 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.206 -0.452 . . . . 25.0 110.872 179.928 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 179' ' ' ARG . . . . . . . . . . . . . 7.2 ttp180 -175.71 139.52 0.42 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 25.0 110.908 -179.93 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 51.4 tt0 -140.72 157.75 44.97 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.153 -0.476 . . . . 25.0 110.831 -179.885 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 181' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -133.39 177.04 7.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.08 -0.509 . . . . 25.0 110.903 -179.969 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 182' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.25 137.02 50.84 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.217 -0.447 . . . . 25.0 110.954 179.936 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 183' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -51.2 159.87 0.59 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.148 -0.478 . . . . 25.0 110.94 -179.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 184' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -145.02 134.08 22.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.485 . . . . 25.0 110.878 -179.943 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 185' ' ' GLN . . . . . 0.548 ' HG3' ' OXT' ' A' ' 185' ' ' GLN . 12.1 pt20 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 25.0 110.903 -179.922 . . . . . . . . 1 1 . 1 stop_ save_